A0A3Q0KEA1_SCHMA Loading...

Round spermatid basic protein 1-like protein

AlphaFold DB , UniProt , Accession A0A3Q0KEA1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 528 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.5	Very low	38.7	Very low	252 Å²	252	172.5 Å²	172.5	100%	1.241	87%	0.866	S	S	*	*				0	120.6	0	-78.8	170.1	150.3	0	0	108.6
2	K	33.7	Very low	38.6	Very low	206 Å²	206	168.4 Å²	168.4	90%	0.896	87%	0.865	S	S	*	*			trans	-86.3	142.8	176.8	-80.8	176.9	172.3	176.3	0	109.8
3	T	40.7	Very low	38.6	Very low	126 Å²	126	166.4 Å²	166.4	77%	0.773	87%	0.866	S	S	*	*			trans	-174.5	111.4	145.5	36.9	0	0	0	0	109.2
4	H	38.6	Very low	38.9	Very low	174 Å²	174	166.7 Å²	166.7	81%	0.806	87%	0.869	S	S	*	*				76.9	121	104.2	-83.6	-77.1	0	0	0	116.5
5	K	44.2	Very low	38.8	Very low	209 Å²	209	169.7 Å²	169.7	91%	0.909	87%	0.873	S	S	*	*				179.8	141.4	111.1	-109.7	176.5	174	178.1	0	113.4
6	L	33.7	Very low	39.1	Very low	167 Å²	167	167.2 Å²	167.2	87%	0.874	88%	0.875	S	S	*	*			trans	-75.3	152.9	168.3	-74.3	113.9	0	0	0	111.9
7	A	45.5	Very low	39.1	Very low	107 Å²	107	169.4 Å²	169.4	88%	0.884	88%	0.875	S	S	*	*			trans	-158.9	132.5	147	0	0	0	0	0	110.8
8	S	35.9	Very low	39.4	Very low	114 Å²	114	171.4 Å²	171.4	80%	0.797	88%	0.881	S	S	*	*			trans	-102.4	140.8	175.9	56.3	0	0	0	0	111.3
9	H	42.5	Very low	39.3	Very low	183 Å²	183	172.7 Å²	172.7	85%	0.847	87%	0.873	S	S	*	*			trans	-145	125.2	162.3	-106.6	-44.1	0	0	0	112.7
10	R	37	Very low	39.5	Very low	205 Å²	205	173 Å²	173	77%	0.774	88%	0.875	S	S	*	*			trans	-4.8	157.7	138.3	-78.6	179.9	166.2	159.5	-0.2	117.2
11	E	34.4	Very low	39.5	Very low	155 Å²	155	172.2 Å²	172.2	72%	0.724	87%	0.866	S	S	*	*			cis	-174.1	146.8	-2.5	-114.6	163	178.6	0	0	104.1
12	S	37.2	Very low	39.4	Very low	123 Å²	123	165.2 Å²	165.2	86%	0.86	84%	0.841	S	S	*	*			trans	173.8	113.4	143.4	35.2	0	0	0	0	111.6
13	T	38.6	Very low	39.6	Very low	142 Å²	142	166.9 Å²	166.9	87%	0.871	84%	0.842	S	S	*	*			trans	-125.5	118.2	167.5	48.7	0	0	0	0	108.9
14	N	42.9	Very low	39.5	Very low	171 Å²	171	169.1 Å²	169.1	91%	0.914	84%	0.841	S	S	*	*			trans	-93.8	123.7	171.2	-83.7	-29.6	0	0	0	110.2
15	K	38.2	Very low	39.4	Very low	212 Å²	212	171 Å²	171	92%	0.922	84%	0.841	S	S	*	*			trans	-125.4	120.2	167.4	-100.4	-179	176.6	173.1	0	107.8
16	S	43.1	Very low	39.1	Very low	129 Å²	129	169.7 Å²	169.7	90%	0.902	84%	0.843	S	S	*	*			trans	-104.8	129	166.3	40	0	0	0	0	110
17	K	39.5	Very low	39.2	Very low	204 Å²	204	164.6 Å²	164.6	89%	0.887	83%	0.831	S	S	*	*			trans	-104	137.6	172.7	-81.8	172.4	171.3	169.2	0	107.7
18	E	43.5	Very low	38.8	Very low	207 Å²	207	166.8 Å²	166.8	97%	0.967	83%	0.833	S	S	*	*			trans	-137.3	146.1	146.2	-102.5	-165.7	162.4	0	0	110.7
19	R	37.3	Very low	38.8	Very low	196 Å²	196	164.5 Å²	164.5	74%	0.74	83%	0.828	S	S	*	*			trans	-146.2	115.9	-155.5	175	-160.9	-171.7	-158.9	6.8	106.9
20	I	44.2	Very low	38.6	Very low	178 Å²	178	163.2 Å²	163.2	91%	0.913	83%	0.826	S	S	*	*			trans	-138.8	127.4	158.7	-61.8	-175.9	0	0	0	110.2
21	K	38.7	Very low	38.6	Very low	157 Å²	157	159.2 Å²	159.2	68%	0.683	82%	0.82	S	S	*	*			trans	-89.2	151.4	177.9	-67	169.4	168.4	179.6	0	109.7
22	S	38.3	Very low	38.8	Very low	104 Å²	104	158.6 Å²	158.6	73%	0.727	82%	0.822	S	S	*	*				162.2	138.3	100	67.6	0	0	0	0	114.8
23	R	38.7	Very low	38.9	Very low	241 Å²	241	158 Å²	158	91%	0.909	81%	0.813	S	S	*	*			trans	56.5	155.4	144.3	-74.2	171.9	149	167.7	-6.8	121.1
24	K	37.8	Very low	38.7	Very low	174 Å²	174	155.8 Å²	155.8	76%	0.757	80%	0.803	S	S	*	*			cis	174.2	145.4	-35.7	-149.9	179.2	-175.3	176.6	0	105.1
25	R	37.1	Very low	38.5	Very low	214 Å²	214	153.1 Å²	153.1	81%	0.808	80%	0.798	S	S	*	*			trans	85.4	120.2	160.7	-59.9	179.7	168.1	176.6	-4.5	116.7
26	L	36.1	Very low	38.4	Very low	181 Å²	181	147.8 Å²	147.8	95%	0.948	79%	0.787	S	S	*	*				80.8	127.2	59.4	-84.8	163.6	0	0	0	114.9
27	G	37.5	Very low	38.1	Very low	59 Å²	59	148.9 Å²	148.9	61%	0.608	78%	0.783	S	S	*	*			trans	124.3	98.3	163.5	0	0	0	0	0	113.7
28	T	36.4	Very low	38	Very low	154 Å²	154	144 Å²	144	95%	0.945	77%	0.774	S	S	*	*				72.8	133	84.3	58.5	0	0	0	0	116.5
29	G	35.9	Very low	37.8	Very low	66 Å²	66	139.3 Å²	139.3	68%	0.68	77%	0.765	S	S	*	*			trans	109.8	100.9	157	0	0	0	0	0	114.2
30	L	37.6	Very low	37.6	Very low	155 Å²	155	134.3 Å²	134.3	81%	0.812	76%	0.76	S	S	*	*				90.8	120.1	82.4	-78.9	168.6	0	0	0	113.4
31	D	38	Very low	37.4	Very low	121 Å²	121	134.7 Å²	134.7	65%	0.647	76%	0.757	S	S	*	*			trans	80.2	127.6	134.7	-56.7	-14.4	0	0	0	123.5
32	N	38.7	Very low	37.4	Very low	142 Å²	142	131 Å²	131	76%	0.759	76%	0.757	S	S	*	*			trans	70.1	150.2	133.9	-72.3	-9.5	0	0	0	118.5
33	V	38.3	Very low	37.2	Very low	111 Å²	111	134 Å²	134	67%	0.673	76%	0.762	S	S	*	*			cis	-168.6	155.2	-8.6	133.7	0	0	0	0	103.8
34	S	35.3	Very low	37.5	Very low	96 Å²	96	128.2 Å²	128.2	67%	0.671	75%	0.754	S	S	*	*			trans	1.8	137.9	163.8	67.5	0	0	0	0	120.3
35	S	37.5	Very low	37.6	Very low	114 Å²	114	126.1 Å²	126.1	80%	0.797	76%	0.756	S	S	*	*				160	142.9	99.4	50	0	0	0	0	111.7
36	S	36.4	Very low	38.2	Very low	100 Å²	100	119.7 Å²	119.7	70%	0.699	74%	0.744	S	S	*	*			trans	-58	138.6	172.8	46.3	0	0	0	0	113.2
37	N	38.6	Very low	38.7	Very low	152 Å²	152	117.2 Å²	117.2	81%	0.813	74%	0.738	S	S	*	*				-173.7	147	117.8	-98.1	-15.1	0	0	0	113.5
38	S	37.4	Very low	39.5	Very low	101 Å²	101	121.2 Å²	121.2	71%	0.706	75%	0.746	S	S	*	*			trans	-40.7	140.4	167.4	52.5	0	0	0	0	115.7
39	S	37.5	Very low	40.5	Very low	109 Å²	109	125.7 Å²	125.7	76%	0.762	75%	0.745	S	S	*	*				168.2	138.6	110.1	50.7	0	0	0	0	112.4
40	S	33.4	Very low	41.9	Very low	91 Å²	91	128.5 Å²	128.5	64%	0.636	74%	0.741	S	S	*	*			trans	6.2	153	151.6	45.6	0	0	0	0	122.6
41	H	40	Very low	43.9	Very low	186 Å²	186	125.4 Å²	125.4	86%	0.861	73%	0.725	S	S	*	*			trans	93.9	134.7	170.7	-55.6	-72.2	0	0	0	113.9
42	A	39.9	Very low	45.7	Very low	81 Å²	81	123.3 Å²	123.3	67%	0.669	72%	0.718	S	S	*	*			cis	-150.2	144.1	18.8	0	0	0	0	0	110.2	V44	A42-V44 PolarHBondContact O-N 3.21Å
43	I	34.3	Very low	47.3	Very low	165 Å²	165	122.1 Å²	122.1	85%	0.846	71%	0.711	S	S	*	*			trans	-74.2	102.8	167	-63.4	172.2	0	0	0	106.8	T45	I43-T45 HydrophobicContact CG2-CG2 4.35Å
44	V	44.2	Very low	49.1	Very low	120 Å²	120	118.9 Å²	118.9	73%	0.727	70%	0.696	S	S	*	*			trans	-102.2	108.1	166.9	176.7	0	0	0	0	107.5	A42 S46	A42-V44 PolarHBondContact O-N 3.21Å; V44-S46 PolarHBondContact O-N 2.89Å
45	T	39.2	Very low	51	Low	131 Å²	131	118.7 Å²	118.7	80%	0.804	68%	0.684	S	S	*	*			trans	-71.2	105.1	170.8	48.2	0	0	0	0	109.3	I43	I43-T45 HydrophobicContact CG2-CG2 4.35Å
46	S	50	Low	52.7	Low	79 Å²	79	118.2 Å²	118.2	55%	0.552	67%	0.672	S	S	*	*			trans	-110.3	147.6	160.8	-109.1	0	0	0	0	109.1	V44 N48	V44-S46 PolarHBondContact O-N 2.89Å; S46-N48 PolarHBondContact O-N 3.26Å
47	P	47.9	Very low	54.4	Low	129 Å²	129	118.2 Å²	118.2	84%	0.838	66%	0.663	S	S	*	*			trans	-74.2	81.5	-176.1	31.8	-31.9	0	0	0	108.7	R49	P47-R49 PolarHBondContact O-N 2.73Å; P47-R49 VanDerWaalsContact O-N 3.08Å
48	N	53.2	Low	55.6	Low	143 Å²	143	119.9 Å²	119.9	77%	0.765	66%	0.658	S	S	*	*			trans	-70.9	106.3	-177.1	-84.1	-21.1	0	0	0	109.4	S46 H50	S46-N48 PolarHBondContact O-N 3.26Å; N48-H50 VanDerWaalsContact C-N 3.27Å; N48-H50 PolarHBondContact O-N 2.93Å
49	R	56.6	Low	56.7	Low	247 Å²	247	119.4 Å²	119.4	93%	0.932	65%	0.647	S	S	*	*			trans	-48.2	97.5	153	-84.1	-178.3	170	-174	-2.7	107.7	P47 D51	P47-R49 PolarHBondContact O-N 2.73Å; P47-R49 VanDerWaalsContact O-N 3.08Å; R49-D51 PolarHBondContact O-N 3.01Å; R49-D51 VanDerWaalsContact O-N 3.08Å
50	H	66.8	Low	57.7	Low	126 Å²	126	118.1 Å²	118.1	58%	0.583	64%	0.638	S	S	*	*			trans	-66.6	106.8	172	-177.1	-81	0	0	0	106.9	N48 P52 H55	N48-H50 VanDerWaalsContact C-N 3.27Å; N48-H50 PolarHBondContact O-N 2.93Å; H50-P52 WeakPolarHBondContact O-CD 3.43Å; H50-H55 AromaticContact NE2-CD2 3.86Å; H50-H55 AromaticContact NE2-CG 3.72Å
51	D	79.1	Confident	58.9	Low	89 Å²	89	117.7 Å²	117.7	48%	0.476	64%	0.635	S	S	.	*			trans	-81.7	102.6	167.2	176.6	7.8	0	0	0	107.9	R49 L53 A54 H55	R49-D51 PolarHBondContact O-N 3.01Å; R49-D51 VanDerWaalsContact O-N 3.08Å; D51-L53 PolarHBondContact O-N 2.75Å; D51-L53 VanDerWaalsContact OD1-CB 3.29Å; D51-L53 WeakPolarHBondContact OD1-CB 3.31Å; D51-L53 PolarHBondContact OD1-N 3.36Å; D51-A54 HydrophobicContact CB-CB 3.94Å; D51-A54 PolarHBondContact O-N 2.65Å; D51-A54 PolarHBondContact OD1-N 3.4Å; D51-A54 VanDerWaalsContact OD2-CB 3.31Å; D51-A54 WeakPolarHBondContact OD2-CB 3.37Å; D51-A54 PolarHBondContact OD2-N 3.21Å; D51-H55 PolarHBondContact O-N 3.09Å
52	P	74.8	Confident	59.5	Low	77 Å²	77	115 Å²	115	50%	0.5	63%	0.626	S	S	.	*	H	α-helix	trans	-61.4	-26.4	179.8	26	-33	0	0	0	112	H50 H55 I56	H50-P52 WeakPolarHBondContact O-CD 3.43Å; P52-H55 PolarHBondContact O-N 3.3Å; P52-I56 WeakPolarHBondContact O-CB 3.05Å; P52-I56 WeakPolarHBondContact O-CD1 3.43Å; P52-I56 WeakPolarHBondContact O-CG1 3.38Å; P52-I56 PolarHBondContact O-N 3.08Å
53	L	72.8	Confident	59.8	Low	117 Å²	117	117 Å²	117	61%	0.613	63%	0.625	S	S	*	*	H	α-helix	trans	-71.6	-46.2	178.6	-148.8	85	0	0	0	110.9	D51 H55 I56 I57	D51-L53 PolarHBondContact O-N 2.75Å; D51-L53 VanDerWaalsContact OD1-CB 3.29Å; D51-L53 WeakPolarHBondContact OD1-CB 3.31Å; D51-L53 PolarHBondContact OD1-N 3.36Å; L53-H55 VanDerWaalsContact C-N 3.28Å; L53-H55 PolarHBondContact O-N 3.43Å; L53-I56 PolarHBondContact O-N 3.09Å; L53-I57 HydrophobicContact CD2-CD1 4.48Å; L53-I57 HydrophobicContact CG-CD1 4.43Å; L53-I57 VanDerWaalsContact O-CG1 3.26Å; L53-I57 WeakPolarHBondContact O-CG1 3.48Å; L53-I57 PolarHBondContact O-N 2.75Å
54	A	77.2	Confident	60.6	Low	44 Å²	44	118.6 Å²	118.6	36%	0.364	63%	0.626	S	S	.	*	H	α-helix	trans	-62.5	-35	173.6	0	0	0	0	0	112.4	D51 R58	D51-A54 HydrophobicContact CB-CB 3.94Å; D51-A54 PolarHBondContact O-N 2.65Å; D51-A54 PolarHBondContact OD1-N 3.4Å; D51-A54 VanDerWaalsContact OD2-CB 3.31Å; D51-A54 WeakPolarHBondContact OD2-CB 3.37Å; D51-A54 PolarHBondContact OD2-N 3.21Å; A54-R58 WeakPolarHBondContact O-CB 3.44Å; A54-R58 PolarHBondContact O-N 2.74Å
55	H	74	Confident	61.1	Low	91 Å²	91	118.5 Å²	118.5	42%	0.421	63%	0.626	S	S	.	*	H	α-helix	trans	-66.5	-44	174.8	-168.9	-101.9	0	0	0	111.9	H50 D51 P52 L53 R58 L59	H50-H55 AromaticContact NE2-CD2 3.86Å; H50-H55 AromaticContact NE2-CG 3.72Å; D51-H55 PolarHBondContact O-N 3.09Å; P52-H55 PolarHBondContact O-N 3.3Å; L53-H55 VanDerWaalsContact C-N 3.28Å; L53-H55 PolarHBondContact O-N 3.43Å; H55-R58 PolarHBondContact O-N 3.01Å; H55-L59 VanDerWaalsContact CE1-CD1 3.43Å; H55-L59 WeakPolarHBondContact CE1-CD1 3.27Å; H55-L59 WeakPolarHBondContact ND1-CD1 3.31Å; H55-L59 WeakPolarHBondContact O-CB 3.31Å; H55-L59 WeakPolarHBondContact O-CG 3.38Å; H55-L59 PolarHBondContact O-N 3.31Å
56	I	73.2	Confident	61.4	Low	104 Å²	104	117.6 Å²	117.6	53%	0.533	62%	0.622	S	S	.	*	H	α-helix	trans	-64	-42	175.7	-70	163.9	0	0	0	111.2	P52 L53 L59 S60	P52-I56 WeakPolarHBondContact O-CB 3.05Å; P52-I56 WeakPolarHBondContact O-CD1 3.43Å; P52-I56 WeakPolarHBondContact O-CG1 3.38Å; P52-I56 PolarHBondContact O-N 3.08Å; L53-I56 PolarHBondContact O-N 3.09Å; I56-L59 PolarHBondContact O-N 2.81Å; I56-S60 WeakPolarHBondContact O-CB 3.46Å; I56-S60 PolarHBondContact O-N 2.94Å; I56-S60 PolarHBondContact O-OG 3.38Å
57	I	71.7	Confident	61.3	Low	100 Å²	100	125.4 Å²	125.4	51%	0.513	64%	0.639	S	S	.	*	H	α-helix	trans	-65.9	-38.9	177	-66.7	165.9	0	0	0	111.2	L53 S60 S61	L53-I57 HydrophobicContact CD2-CD1 4.48Å; L53-I57 HydrophobicContact CG-CD1 4.43Å; L53-I57 VanDerWaalsContact O-CG1 3.26Å; L53-I57 WeakPolarHBondContact O-CG1 3.48Å; L53-I57 PolarHBondContact O-N 2.75Å; I57-S60 WeakPolarHBondContact CA-OG 3.48Å; I57-S60 PolarHBondContact O-N 3.28Å; I57-S60 PolarHBondContact O-OG 3.29Å; I57-S61 WeakPolarHBondContact O-CB 3.27Å; I57-S61 PolarHBondContact O-N 3.07Å; I57-S61 PolarHBondContact O-OG 3.08Å
58	R	64.8	Low	61.3	Low	188 Å²	188	123.6 Å²	123.6	71%	0.709	63%	0.63	S	S	*	*	H	α-helix	trans	-66.7	-40.9	174.5	-93.4	-178	168	167.4	-2.7	112.5	A54 H55 S61 N62	A54-R58 WeakPolarHBondContact O-CB 3.44Å; A54-R58 PolarHBondContact O-N 2.74Å; H55-R58 PolarHBondContact O-N 3.01Å; R58-S61 WeakPolarHBondContact CA-OG 3.32Å; R58-S61 PolarHBondContact O-N 3.39Å; R58-S61 PolarHBondContact O-OG 3.41Å; R58-N62 WeakPolarHBondContact O-CB 3.11Å; R58-N62 PolarHBondContact O-N 2.82Å; R58-N62 VanDerWaalsContact O-N 3.15Å
59	L	59.6	Low	61.5	Low	90 Å²	90	122.2 Å²	122.2	47%	0.471	63%	0.628	S	S	.	*	H	α-helix	trans	-64.3	-42.3	175.1	-78.5	167	0	0	0	111.1	H55 I56 S61 N62 L63	H55-L59 VanDerWaalsContact CE1-CD1 3.43Å; H55-L59 WeakPolarHBondContact CE1-CD1 3.27Å; H55-L59 WeakPolarHBondContact ND1-CD1 3.31Å; H55-L59 WeakPolarHBondContact O-CB 3.31Å; H55-L59 WeakPolarHBondContact O-CG 3.38Å; H55-L59 PolarHBondContact O-N 3.31Å; I56-L59 PolarHBondContact O-N 2.81Å; L59-S61 VanDerWaalsContact C-N 3.32Å; L59-S61 PolarHBondContact O-N 2.98Å; L59-N62 PolarHBondContact O-N 3.21Å; L59-L63 VanDerWaalsContact O-CG 3.32Å; L59-L63 WeakPolarHBondContact O-CG 3.34Å; L59-L63 PolarHBondContact O-N 2.79Å; L59-L63 VanDerWaalsContact O-N 3.08Å
60	S	59.5	Low	61.7	Low	82 Å²	82	120.6 Å²	120.6	57%	0.573	63%	0.628	S	S	*	*	H	α-helix	trans	-69	-29	177	63.3	0	0	0	0	112.9	I56 I57	I56-S60 WeakPolarHBondContact O-CB 3.46Å; I56-S60 PolarHBondContact O-N 2.94Å; I56-S60 PolarHBondContact O-OG 3.38Å; I57-S60 WeakPolarHBondContact CA-OG 3.48Å; I57-S60 PolarHBondContact O-N 3.28Å; I57-S60 PolarHBondContact O-OG 3.29Å
61	S	57.7	Low	61.8	Low	82 Å²	82	122 Å²	122	57%	0.573	63%	0.628	S	S	*	*	H	α-helix	trans	-77.1	-20.7	174.3	67.9	0	0	0	0	114.8	I57 R58 L59	I57-S61 WeakPolarHBondContact O-CB 3.27Å; I57-S61 PolarHBondContact O-N 3.07Å; I57-S61 PolarHBondContact O-OG 3.08Å; R58-S61 WeakPolarHBondContact CA-OG 3.32Å; R58-S61 PolarHBondContact O-N 3.39Å; R58-S61 PolarHBondContact O-OG 3.41Å; L59-S61 VanDerWaalsContact C-N 3.32Å; L59-S61 PolarHBondContact O-N 2.98Å
62	N	53	Low	62	Low	129 Å²	129	122.7 Å²	122.7	69%	0.69	63%	0.629	S	S	*	*	H	α-helix	trans	-113.4	1.7	-175.1	-79.6	-30.9	0	0	0	114.7	R58 L59 K64	R58-N62 WeakPolarHBondContact O-CB 3.11Å; R58-N62 PolarHBondContact O-N 2.82Å; R58-N62 VanDerWaalsContact O-N 3.15Å; L59-N62 PolarHBondContact O-N 3.21Å; N62-K64 PolarHBondContact O-N 2.89Å
63	L	46.5	Very low	62.6	Low	124 Å²	124	120 Å²	120	65%	0.649	61%	0.61	S	S	*	*			trans	-71	81.9	163.5	-75.4	163.4	0	0	0	108.5	L59 V65	L59-L63 VanDerWaalsContact O-CG 3.32Å; L59-L63 WeakPolarHBondContact O-CG 3.34Å; L59-L63 PolarHBondContact O-N 2.79Å; L59-L63 VanDerWaalsContact O-N 3.08Å; L63-V65 PolarHBondContact O-N 3.29Å
64	K	51.5	Low	63.4	Low	198 Å²	198	116.6 Å²	116.6	86%	0.861	60%	0.596	S	S	*	*			trans	-62.9	82.7	154.5	-74.8	-177.8	179.7	177.5	0	106.4	N62 P66	N62-K64 PolarHBondContact O-N 2.89Å; K64-P66 WeakPolarHBondContact O-CD 3.21Å
65	V	53.6	Low	64.1	Low	118 Å²	118	118.7 Å²	118.7	72%	0.715	60%	0.601	S	S	*	*			trans	-51.9	115.3	164.2	179.3	0	0	0	0	104.8	L63 R67	L63-V65 PolarHBondContact O-N 3.29Å; V65-R67 PolarHBondContact O-N 3.36Å; V65-R67 VanDerWaalsContact O-N 3.11Å
66	P	45.6	Very low	65	Low	112 Å²	112	114.9 Å²	114.9	73%	0.727	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-52.2	127.4	176.3	-21.9	31.6	0	0	0	106.8	K64 S68	K64-P66 WeakPolarHBondContact O-CD 3.21Å; P66-S68 PolarHBondContact O-N 3.28Å; P66-S68 VanDerWaalsContact O-N 3.1Å
67	R	48.4	Very low	66.2	Low	243 Å²	243	110.8 Å²	110.8	92%	0.917	56%	0.562	S	S	*	*	P	Polyproline II helix	trans	-52.2	126.7	172.8	-74.2	-176.6	175.7	142.9	-2.3	106.3	V65	V65-R67 PolarHBondContact O-N 3.36Å; V65-R67 VanDerWaalsContact O-N 3.11Å
68	S	48.6	Very low	67.4	Low	91 Å²	91	109 Å²	109	64%	0.636	55%	0.552	S	S	*	*	P	Polyproline II helix	trans	-50	141.8	173.5	35.9	0	0	0	0	108.5	P66 K70	P66-S68 PolarHBondContact O-N 3.28Å; P66-S68 VanDerWaalsContact O-N 3.1Å; S68-K70 PolarHBondContact O-N 3.18Å
69	P	56.9	Low	69	Low	114 Å²	114	103.8 Å²	103.8	74%	0.74	54%	0.541	S	S	*	.	P	Polyproline II helix	trans	-48.4	142	173.2	-23	31.1	0	0	0	109.1	R71	P69-R71 PolarHBondContact O-N 3.3Å
70	K	60.6	Low	70.8	Confident	213 Å²	213	102.9 Å²	102.9	93%	0.926	53%	0.534	S	S	*	.			trans	-55	108.7	174	-71.1	-173.8	176.9	-174.1	0	107.6	S68	S68-K70 PolarHBondContact O-N 3.18Å
71	R	68	Low	72.7	Confident	155 Å²	155	102.4 Å²	102.4	59%	0.585	52%	0.522	S	S	*	.			trans	-66.7	138.8	174.8	-69.7	-173.7	-179.9	-179.3	-0.6	108.1	P69 D75	P69-R71 PolarHBondContact O-N 3.3Å; R71-D75 HydrophobicContact CB-CB 4.23Å
72	H	84.1	Confident	74.6	Confident	105 Å²	105	100.6 Å²	100.6	49%	0.486	50%	0.503	S	S	.	.			trans	-66.6	146.3	170.9	-173.8	-102.1	0	0	0	108.1	C74 D75	H72-C74 PolarHBondContact CE1-SG 2.86Å; H72-C74 PolarHBondContact ND1-N 3.41Å; H72-C74 PolarHBondContact O-N 2.92Å; H72-D75 PolarHBondContact N-OD2 2.72Å; H72-D75 VanDerWaalsContact O-CB 3.27Å; H72-D75 WeakPolarHBondContact O-CB 3.49Å; H72-D75 PolarHBondContact O-N 2.77Å
73	L	87.3	Confident	76.7	Confident	19 Å²	19	101.2 Å²	101.2	10%	0.099	50%	0.502	C	S	.	.	G	3₁₀ helix	trans	-55.8	-32.5	-176	-67.5	180	0	0	0	112.9	D75 M76 L100 E104 L107 L108	L73-D75 PolarHBondContact O-N 3.38Å; L73-M76 HydrophobicContact CB-CE 4.36Å; L73-M76 HydrophobicContact CD2-CE 3.59Å; L73-M76 PolarHBondContact O-N 2.86Å; L73-L100 HydrophobicContact CD2-CD1 4.23Å; L73-L100 HydrophobicContact CD2-CD2 3.99Å; L73-E104 HydrophobicContact CD2-CB 4.1Å; L73-E104 HydrophobicContact CD2-CG 4.46Å; L73-L107 HydrophobicContact CD1-CB 4.09Å; L73-L107 HydrophobicContact CD1-CD2 3.67Å; L73-L107 HydrophobicContact CD1-CG 3.85Å; L73-L108 HydrophobicContact CB-CD1 4.27Å; L73-L108 HydrophobicContact CD2-CD1 4.4Å; L73-L108 VanDerWaalsContact O-CD1 3.3Å; L73-L108 WeakPolarHBondContact O-CD1 3.29Å
74	C	89.1	Confident	79.1	Confident	47 Å²	47	99.8 Å²	99.8	32%	0.318	50%	0.495	S	S	.	.	G	3₁₀ helix	trans	-68.7	-19.8	177.5	-55.9	0	0	0	0	113.3	H72 M76 I77	H72-C74 PolarHBondContact CE1-SG 2.86Å; H72-C74 PolarHBondContact ND1-N 3.41Å; H72-C74 PolarHBondContact O-N 2.92Å; C74-M76 PolarHBondContact O-N 3.08Å; C74-I77 PolarHBondContact O-N 3.29Å
75	D	91.9	Very high	81.3	Confident	88 Å²	88	90.4 Å²	90.4	47%	0.471	45%	0.454	S	S	.	.	G	3₁₀ helix	trans	-71.9	-9.2	178.1	-53.2	-20.1	0	0	0	112.2	R71 H72 L73	R71-D75 HydrophobicContact CB-CB 4.23Å; H72-D75 PolarHBondContact N-OD2 2.72Å; H72-D75 VanDerWaalsContact O-CB 3.27Å; H72-D75 WeakPolarHBondContact O-CB 3.49Å; H72-D75 PolarHBondContact O-N 2.77Å; L73-D75 PolarHBondContact O-N 3.38Å
76	M	94.5	Very high	83.4	Confident	11 Å²	11	85.3 Å²	85.3	5%	0.054	43%	0.426	C	S	.	.	G	3₁₀ helix	trans	-102.5	10.5	173.3	-60.6	171.6	-76.1	0	0	112.1	L73 C74 S92 L97 L100 L108	L73-M76 HydrophobicContact CB-CE 4.36Å; L73-M76 HydrophobicContact CD2-CE 3.59Å; L73-M76 PolarHBondContact O-N 2.86Å; C74-M76 PolarHBondContact O-N 3.08Å; M76-S92 WeakPolarHBondContact O-CB 3.08Å; M76-S92 PolarHBondContact O-OG 3.2Å; M76-L97 HydrophobicContact CB-CD2 3.95Å; M76-L97 HydrophobicContact SD-CD2 4.02Å; M76-L100 HydrophobicContact CE-CD1 3.72Å; M76-L100 HydrophobicContact CE-CD2 3.63Å; M76-L100 HydrophobicContact CE-CG 4.19Å; M76-L100 HydrophobicContact SD-CD1 3.94Å; M76-L100 HydrophobicContact SD-CD2 3.95Å; M76-L100 HydrophobicContact SD-CG 4.17Å; M76-L108 HydrophobicContact CB-CD1 3.99Å; M76-L108 HydrophobicContact CE-CD1 3.62Å; M76-L108 HydrophobicContact SD-CD1 4.41Å
77	I	97.2	Very high	85.9	Confident	18 Å²	18	80 Å²	80	9%	0.092	39%	0.391	C	S	.	.	S	Bend	trans	-114.9	104.8	172.4	-54.8	178.5	0	0	0	106.7	C74 L90 H91 L108 K111 Y112 I115	C74-I77 PolarHBondContact O-N 3.29Å; I77-L90 HydrophobicContact CG2-CD1 3.48Å; I77-L90 VanDerWaalsContact CG2-CD1 3.48Å; I77-L90 HydrophobicContact CG2-CD2 4.06Å; I77-L90 HydrophobicContact CG2-CG 3.78Å; I77-H91 CarbonylContact C-O 3.55Å; I77-H91 WeakPolarHBondContact CA-O 3.29Å; I77-L108 HydrophobicContact CD1-CG 4.42Å; I77-L108 HydrophobicContact CG1-CG 4.43Å; I77-K111 HydrophobicContact CD1-CB 4.43Å; I77-Y112 HydrophobicContact CD1-CD2 4.36Å; I77-Y112 HydrophobicContact CG1-CD2 4.23Å; I77-Y112 HydrophobicContact CG2-CD2 4.01Å; I77-Y112 HydrophobicContact CG2-CE2 4.35Å; I77-I115 HydrophobicContact CD1-CD1 3.98Å; I77-I115 HydrophobicContact CG2-CD1 4.41Å
78	H	97.9	Very high	88.3	Confident	62 Å²	62	71.4 Å²	71.4	29%	0.287	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	141.4	-174.1	-53.5	-82.7	0	0	0	110.4	L90 H91 Y93 E96	H78-L90 CarbonylContact O-C 3.56Å; H78-H91 HydrophobicContact CB-CB 4.23Å; H78-H91 PolarHBondContact N-O 3.22Å; H78-H91 PolarHBondContact O-N 2.93Å; H78-Y93 AromaticContact CD2-CD2 3.66Å; H78-Y93 AromaticContact CD2-CE2 3.59Å; H78-Y93 AromaticContact NE2-CD2 3.91Å; H78-E96 IonicContact CD2-OE2 2.71Å; H78-E96 IonicContact CE1-OE2 3.61Å; H78-E96 IonicContact NE2-OE1 3.62Å; H78-E96 IonicContact NE2-OE2 3.38Å; H78-E96 PolarHBondContact NE2-OE2 2.82Å
79	V	97.8	Very high	90.7	Very high	79 Å²	79	67 Å²	67	48%	0.479	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	121.1	174.2	177.1	0	0	0	0	108.3	Y88 L90 Y132	V79-Y88 HydrophobicContact CG1-CD1 3.93Å; V79-L90 HydrophobicContact CG2-CD1 3.9Å; V79-Y132 HydrophobicContact CB-CE1 4.48Å; V79-Y132 HydrophobicContact CG1-CE1 3.91Å; V79-Y132 HydrophobicContact CG2-CE1 3.86Å
80	E	97.8	Very high	92.7	Very high	71 Å²	71	61.7 Å²	61.7	33%	0.332	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	130.7	170.6	-176	-178.2	160.5	0	0	109.2	Y88 A89 H91	E80-Y88 CarbonylContact O-C 3.29Å; E80-Y88 VanDerWaalsContact O-CA 3.25Å; E80-Y88 WeakPolarHBondContact O-CA 3.26Å; E80-A89 HydrophobicContact CB-CB 4.39Å; E80-A89 PolarHBondContact N-O 3.04Å; E80-A89 PolarHBondContact O-N 3.47Å; E80-H91 IonicContact OE2-CE1 3Å; E80-H91 PolarHBondContact OE2-CE1 3.08Å; E80-H91 IonicContact OE2-NE2 3.56Å; E80-H91 PolarHBondContact OE2-NE2 2.83Å; E80-H91 VanDerWaalsContact OE2-NE2 3.16Å
81	H	98.2	Very high	94.5	Very high	72 Å²	72	51.8 Å²	51.8	33%	0.333	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	117.3	164.8	174.6	-117.1	0	0	0	108.2	E83 Y88	H81-E83 IonicContact CE1-OE1 3.85Å; H81-E83 IonicContact CE1-OE2 3.67Å; H81-E83 IonicContact ND1-OE1 3.36Å; H81-E83 PolarHBondContact ND1-OE1 2.97Å; H81-E83 IonicContact ND1-OE2 3.21Å; H81-E83 PolarHBondContact O-N 2.84Å; H81-Y88 HydrophobicContact CB-CD1 4.06Å; H81-Y88 HydrophobicContact CB-CE1 3.82Å; H81-Y88 AromaticContact CD2-CE1 3.56Å; H81-Y88 AromaticContact CD2-CZ 3.69Å; H81-Y88 AromaticContact CG-CE1 3.97Å
82	Y	97.9	Very high	95.9	Very high	44 Å²	44	44.4 Å²	44.4	17%	0.173	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	99.6	-177.7	-175.3	-107.2	0	0	0	110.5	N84 G85 G86 G87 Y422 V423 R424	Y82-N84 VanDerWaalsContact C-N 3.31Å; Y82-N84 HydrophobicContact CD1-CB 4.4Å; Y82-N84 HydrophobicContact CE1-CB 3.68Å; Y82-N84 PolarHBondContact O-N 3.46Å; Y82-N84 VanDerWaalsContact O-N 3.14Å; Y82-G85 CarbonylContact O-C 3.57Å; Y82-G85 PolarHBondContact O-N 3.35Å; Y82-G86 WeakPolarHBondContact O-CA 3.43Å; Y82-G86 PolarHBondContact O-N 2.91Å; Y82-G87 PolarHBondContact N-O 3.39Å; Y82-Y422 HydrophobicContact CD1-CD2 4.29Å; Y82-Y422 HydrophobicContact CD1-CE2 4.12Å; Y82-Y422 WeakPolarHBondContact CD1-O 3.43Å; Y82-Y422 HydrophobicContact CE1-CD2 4.08Å; Y82-Y422 AromaticContact CE1-CE2 3.51Å; Y82-Y422 HydrophobicContact CE1-CE2 3.51Å; Y82-V423 HydrophobicContact CD2-CG1 4.48Å; Y82-V423 HydrophobicContact CG-CG1 4.21Å; Y82-R424 WeakPolarHBondContact CD2-O 3.4Å; Y82-R424 HydrophobicContact CE1-CB 4.01Å; Y82-R424 HydrophobicContact CE2-CB 4.17Å; Y82-R424 WeakPolarHBondContact CE2-O 3.48Å
83	E	97	Very high	96.5	Very high	141 Å²	141	43.8 Å²	43.8	66%	0.659	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-39.7	-168.6	-65	-60	151.2	0	0	114.8	H81 G85	H81-E83 IonicContact CE1-OE1 3.85Å; H81-E83 IonicContact CE1-OE2 3.67Å; H81-E83 IonicContact ND1-OE1 3.36Å; H81-E83 PolarHBondContact ND1-OE1 2.97Å; H81-E83 IonicContact ND1-OE2 3.21Å; H81-E83 PolarHBondContact O-N 2.84Å; E83-G85 VanDerWaalsContact C-N 3.33Å; E83-G85 PolarHBondContact O-N 2.94Å
84	N	97.1	Very high	96.8	Very high	95 Å²	95	43 Å²	43	51%	0.508	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-19.6	-178	-74.7	51.1	0	0	0	114.2	Y82 Y422	Y82-N84 VanDerWaalsContact C-N 3.31Å; Y82-N84 HydrophobicContact CD1-CB 4.4Å; Y82-N84 HydrophobicContact CE1-CB 3.68Å; Y82-N84 PolarHBondContact O-N 3.46Å; Y82-N84 VanDerWaalsContact O-N 3.14Å; N84-Y422 PolarHBondContact O-OH 3.3Å
85	G	97.8	Very high	96.9	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-124.1	-8.7	-175.8	0	0	0	0	0	114.2	Y82 E83 G87 R421 Y422	Y82-G85 CarbonylContact O-C 3.57Å; Y82-G85 PolarHBondContact O-N 3.35Å; E83-G85 VanDerWaalsContact C-N 3.33Å; E83-G85 PolarHBondContact O-N 2.94Å; G85-G87 PolarHBondContact O-N 3.27Å; G85-G87 VanDerWaalsContact O-N 3.11Å; G85-R421 CarbonylContact O-C 3.51Å; G85-R421 WeakPolarHBondContact O-CA 3.43Å; G85-R421 WeakPolarHBondContact O-CB 3.39Å; G85-R421 WeakPolarHBondContact O-CG 3.25Å; G85-Y422 CarbonylContact C-O 3.52Å; G85-Y422 VanDerWaalsContact C-O 3.29Å; G85-Y422 WeakPolarHBondContact CA-O 3.29Å; G85-Y422 PolarHBondContact O-N 3.13Å
86	G	97.9	Very high	97	Very high	11 Å²	11	43.6 Å²	43.6	11%	0.113	21%	0.211	C	C	.	.	B	Isolated β-bridge	trans	66.5	3.9	-179.3	0	0	0	0	0	115.8	Y82 R421	Y82-G86 WeakPolarHBondContact O-CA 3.43Å; Y82-G86 PolarHBondContact O-N 2.91Å; G86-R421 WeakPolarHBondContact O-CD 3.38Å
87	G	98.2	Very high	97	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	164.6	178.2	0	0	0	0	0	112.6	Y82 G85 Y422	Y82-G87 PolarHBondContact N-O 3.39Å; G85-G87 PolarHBondContact O-N 3.27Å; G85-G87 VanDerWaalsContact O-N 3.11Å; G87-Y422 WeakPolarHBondContact CA-O 3.44Å; G87-Y422 PolarHBondContact N-O 3.3Å; G87-Y422 VanDerWaalsContact N-O 3.09Å
88	Y	98.6	Very high	96.7	Very high	63 Å²	63	43 Å²	43	25%	0.247	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	135.5	177.5	-62.8	-84.5	0	0	0	111.6	V79 E80 H81 H131 Y132 C133	V79-Y88 HydrophobicContact CG1-CD1 3.93Å; E80-Y88 CarbonylContact O-C 3.29Å; E80-Y88 VanDerWaalsContact O-CA 3.25Å; E80-Y88 WeakPolarHBondContact O-CA 3.26Å; H81-Y88 HydrophobicContact CB-CD1 4.06Å; H81-Y88 HydrophobicContact CB-CE1 3.82Å; H81-Y88 AromaticContact CD2-CE1 3.56Å; H81-Y88 AromaticContact CD2-CZ 3.69Å; H81-Y88 AromaticContact CG-CE1 3.97Å; Y88-H131 AromaticContact CD2-CE1 3.88Å; Y88-H131 AromaticContact CD2-NE2 3.74Å; Y88-H131 AromaticContact CE2-CE1 3.81Å; Y88-H131 AromaticContact CE2-NE2 3.83Å; Y88-Y132 CarbonylContact O-C 3.57Å; Y88-Y132 WeakPolarHBondContact O-CA 3.49Å; Y88-C133 PolarHBondContact O-N 3.3Å
89	A	98.7	Very high	96.3	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	148.4	171.3	0	0	0	0	0	111.1	E80 H91 I134 V423 L425	E80-A89 HydrophobicContact CB-CB 4.39Å; E80-A89 PolarHBondContact N-O 3.04Å; E80-A89 PolarHBondContact O-N 3.47Å; A89-H91 VanDerWaalsContact CB-NE2 3.26Å; A89-H91 WeakPolarHBondContact CB-NE2 3.4Å; A89-I134 WeakPolarHBondContact CA-O 3.4Å; A89-I134 HydrophobicContact CB-CG2 3.78Å; A89-V423 HydrophobicContact CB-CG1 4.09Å; A89-V423 HydrophobicContact CB-CG2 4.35Å; A89-L425 HydrophobicContact CB-CD2 3.94Å
90	L	98.5	Very high	96	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.005	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	126.8	-178.7	-164.6	72.6	0	0	0	110	I77 H78 V79 Y112 I115 L116 Y132 I134 G135 V136	I77-L90 HydrophobicContact CG2-CD1 3.48Å; I77-L90 VanDerWaalsContact CG2-CD1 3.48Å; I77-L90 HydrophobicContact CG2-CD2 4.06Å; I77-L90 HydrophobicContact CG2-CG 3.78Å; H78-L90 CarbonylContact O-C 3.56Å; V79-L90 HydrophobicContact CG2-CD1 3.9Å; L90-Y112 HydrophobicContact CD2-CD1 4.37Å; L90-Y112 HydrophobicContact CD2-CD2 4Å; L90-Y112 HydrophobicContact CD2-CE1 4.15Å; L90-Y112 HydrophobicContact CD2-CE2 3.76Å; L90-Y112 HydrophobicContact CD2-CG 4.28Å; L90-Y112 HydrophobicContact CG-CD2 4.44Å; L90-Y112 HydrophobicContact CG-CE2 3.86Å; L90-Y112 PolarHBondContact O-OH 3.4Å; L90-I115 HydrophobicContact CD1-CG2 3.94Å; L90-I115 HydrophobicContact CD2-CB 4.24Å; L90-I115 HydrophobicContact CD2-CG2 3.87Å; L90-L116 HydrophobicContact CB-CD1 4.38Å; L90-L116 HydrophobicContact CD2-CB 3.89Å; L90-L116 HydrophobicContact CD2-CD1 4.46Å; L90-Y132 HydrophobicContact CB-CD1 4.01Å; L90-Y132 HydrophobicContact CB-CE1 4.36Å; L90-Y132 HydrophobicContact CB-CG 4.27Å; L90-Y132 HydrophobicContact CD1-CD1 4.27Å; L90-Y132 HydrophobicContact CD1-CE1 3.76Å; L90-Y132 HydrophobicContact CD1-CE2 4.42Å; L90-I134 PolarHBondContact N-O 3.46Å; L90-G135 CarbonylContact O-C 3.55Å; L90-G135 VanDerWaalsContact O-CA 3.27Å; L90-G135 WeakPolarHBondContact O-CA 3.44Å; L90-V136 PolarHBondContact O-N 3.28Å
91	H	98.5	Very high	95.8	Very high	6 Å²	6	45.6 Å²	45.6	3%	0.028	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	143.3	-174.3	-59.4	-98.1	0	0	0	111.9	I77 H78 E80 A89 Y93 V136 H138	I77-H91 CarbonylContact C-O 3.55Å; I77-H91 WeakPolarHBondContact CA-O 3.29Å; H78-H91 HydrophobicContact CB-CB 4.23Å; H78-H91 PolarHBondContact N-O 3.22Å; H78-H91 PolarHBondContact O-N 2.93Å; E80-H91 IonicContact OE2-CE1 3Å; E80-H91 PolarHBondContact OE2-CE1 3.08Å; E80-H91 IonicContact OE2-NE2 3.56Å; E80-H91 PolarHBondContact OE2-NE2 2.83Å; E80-H91 VanDerWaalsContact OE2-NE2 3.16Å; A89-H91 VanDerWaalsContact CB-NE2 3.26Å; A89-H91 WeakPolarHBondContact CB-NE2 3.4Å; H91-Y93 HydrophobicContact CB-CE2 4.21Å; H91-V136 CarbonylContact C-O 3.5Å; H91-V136 VanDerWaalsContact CA-O 3.31Å; H91-V136 WeakPolarHBondContact CA-O 3.29Å; H91-H138 AromaticContact CE1-NE2 3.82Å; H91-H138 AromaticContact CG-NE2 3.99Å; H91-H138 AromaticContact ND1-CD2 3.8Å; H91-H138 AromaticContact ND1-CE1 3.99Å; H91-H138 AromaticContact ND1-NE2 2.96Å; H91-H138 PolarHBondContact ND1-NE2 3.36Å
92	S	98	Very high	95.5	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	156.8	159.1	-72.3	0	0	0	0	108.7	M76 Y112 V136 V137 H138	M76-S92 WeakPolarHBondContact O-CB 3.08Å; M76-S92 PolarHBondContact O-OG 3.2Å; S92-Y112 WeakPolarHBondContact OG-CD2 3.34Å; S92-V136 PolarHBondContact N-O 3.15Å; S92-V137 CarbonylContact O-C 3.58Å; S92-V137 WeakPolarHBondContact O-CA 3.49Å; S92-H138 PolarHBondContact O-N 3.08Å
93	Y	96	Very high	95.2	Very high	92 Å²	92	46.6 Å²	46.6	36%	0.361	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	120.4	-175.9	-62.4	-88.4	0	0	0	110	H78 H91 D95 E96 L97 H138	H78-Y93 AromaticContact CD2-CD2 3.66Å; H78-Y93 AromaticContact CD2-CE2 3.59Å; H78-Y93 AromaticContact NE2-CD2 3.91Å; H91-Y93 HydrophobicContact CB-CE2 4.21Å; Y93-D95 PolarHBondContact O-N 2.78Å; Y93-E96 WeakPolarHBondContact O-CB 3.45Å; Y93-E96 PolarHBondContact O-N 3.32Å; Y93-L97 WeakPolarHBondContact O-CG 3.44Å; Y93-L97 PolarHBondContact O-N 3.37Å; Y93-H138 HydrophobicContact CD1-CB 3.65Å; Y93-H138 AromaticContact CD1-CD2 3.67Å; Y93-H138 AromaticContact CD1-CG 3.93Å; Y93-H138 HydrophobicContact CE1-CB 4.03Å; Y93-H138 AromaticContact CE1-CD2 3.23Å; Y93-H138 WeakPolarHBondContact CE1-CD2 3.46Å; Y93-H138 AromaticContact CE1-CG 3.78Å; Y93-H138 HydrophobicContact CG-CB 4.5Å; Y93-H138 AromaticContact CZ-CD2 3.74Å
94	A	94.3	Very high	95.1	Very high	1 Å²	1	43.9 Å²	43.9	1%	0.008	22%	0.224	C	C	.	.	H	α-helix	trans	-54.8	-32	-178.1	0	0	0	0	0	112.8	L97 A98 H138 Y361	A94-L97 CarbonylContact O-C 3.56Å; A94-L97 PolarHBondContact O-N 3.06Å; A94-A98 PolarHBondContact O-N 3.34Å; A94-H138 VanDerWaalsContact CB-O 3.22Å; A94-H138 WeakPolarHBondContact CB-O 3.4Å; A94-H138 PolarHBondContact N-O 3.26Å; A94-Y361 HydrophobicContact CB-CD1 4.1Å; A94-Y361 HydrophobicContact CB-CD2 4.23Å; A94-Y361 HydrophobicContact CB-CG 3.91Å; A94-Y361 WeakPolarHBondContact O-CB 3.13Å
95	D	91.7	Very high	95	Very high	83 Å²	83	39.4 Å²	39.4	44%	0.444	20%	0.2	S	C	.	.	H	α-helix	trans	-67.4	-33.7	175.6	-67.2	-33	0	0	0	113.2	Y93 A98 R142	Y93-D95 PolarHBondContact O-N 2.78Å; D95-A98 WeakPolarHBondContact O-CB 3.41Å; D95-R142 IonicContact OD1-CZ 3.31Å; D95-R142 VanDerWaalsContact OD1-CZ 3.25Å; D95-R142 IonicContact OD1-NH1 3.48Å; D95-R142 PolarHBondContact OD1-NH1 2.89Å; D95-R142 IonicContact OD1-NH2 2.83Å; D95-R142 PolarHBondContact OD1-NH2 3.22Å; D95-R142 IonicContact OD2-NH2 3.08Å
96	E	93	Very high	94.9	Very high	65 Å²	65	40.6 Å²	40.6	30%	0.304	21%	0.21	S	C	.	.	H	α-helix	trans	-73.5	-36.4	173.3	-63.8	-175.7	162.7	0	0	111.1	H78 Y93 A98	H78-E96 IonicContact CD2-OE2 2.71Å; H78-E96 IonicContact CE1-OE2 3.61Å; H78-E96 IonicContact NE2-OE1 3.62Å; H78-E96 IonicContact NE2-OE2 3.38Å; H78-E96 PolarHBondContact NE2-OE2 2.82Å; Y93-E96 WeakPolarHBondContact O-CB 3.45Å; Y93-E96 PolarHBondContact O-N 3.32Å; E96-A98 VanDerWaalsContact C-N 3.26Å; E96-A98 PolarHBondContact O-N 2.93Å
97	L	94.4	Very high	94.8	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-74.1	-15.4	179.2	-58.9	-177.4	0	0	0	113.2	M76 Y93 A94 H99 L100 L105 L108 V137 F226 N359 Y361	M76-L97 HydrophobicContact CB-CD2 3.95Å; M76-L97 HydrophobicContact SD-CD2 4.02Å; Y93-L97 WeakPolarHBondContact O-CG 3.44Å; Y93-L97 PolarHBondContact O-N 3.37Å; A94-L97 CarbonylContact O-C 3.56Å; A94-L97 PolarHBondContact O-N 3.06Å; L97-H99 PolarHBondContact O-N 2.92Å; L97-H99 VanDerWaalsContact O-N 3.12Å; L97-L100 HydrophobicContact CB-CD1 4.41Å; L97-L100 HydrophobicContact CD2-CD1 3.81Å; L97-L100 WeakPolarHBondContact O-CB 3.46Å; L97-L100 WeakPolarHBondContact O-CG 3.28Å; L97-L100 PolarHBondContact O-N 2.86Å; L97-L100 VanDerWaalsContact O-N 3.12Å; L97-L105 HydrophobicContact CB-CD1 4Å; L97-L105 HydrophobicContact CD1-CD1 3.96Å; L97-L105 HydrophobicContact CG-CD1 4.39Å; L97-L108 HydrophobicContact CD1-CD2 4.2Å; L97-L108 HydrophobicContact CD2-CD1 3.53Å; L97-L108 HydrophobicContact CD2-CD2 3.81Å; L97-L108 HydrophobicContact CD2-CG 4.32Å; L97-V137 HydrophobicContact CD1-CG1 4.24Å; L97-F226 HydrophobicContact CD1-CE2 3.79Å; L97-F226 HydrophobicContact CD1-CZ 3.81Å; L97-N359 PolarHBondContact O-ND2 3.42Å; L97-Y361 HydrophobicContact CB-CD2 3.95Å; L97-Y361 HydrophobicContact CD1-CD2 4.36Å; L97-Y361 HydrophobicContact CD1-CE2 4.18Å
98	A	91.9	Very high	94.8	Very high	17 Å²	17	44.1 Å²	44.1	14%	0.14	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-24.9	-174	0	0	0	0	0	114.4	A94 D95 E96 N359 Y361	A94-A98 PolarHBondContact O-N 3.34Å; D95-A98 WeakPolarHBondContact O-CB 3.41Å; E96-A98 VanDerWaalsContact C-N 3.26Å; E96-A98 PolarHBondContact O-N 2.93Å; A98-N359 PolarHBondContact O-ND2 3.41Å; A98-Y361 VanDerWaalsContact CB-O 3.25Å; A98-Y361 WeakPolarHBondContact CB-O 3.21Å
99	H	88.8	Confident	94.8	Very high	170 Å²	170	41.1 Å²	41.1	79%	0.787	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-8.7	-178.3	-59.9	-54.4	0	0	0	114.2	L97	L97-H99 PolarHBondContact O-N 2.92Å; L97-H99 VanDerWaalsContact O-N 3.12Å
100	L	92.7	Very high	94.7	Very high	21 Å²	21	47.6 Å²	47.6	11%	0.11	24%	0.238	C	C	.	.	S	Bend	trans	-72.8	148.4	179.8	-58.8	179.4	0	0	0	111	L73 M76 L97 E104 L105 L108 N359	L73-L100 HydrophobicContact CD2-CD1 4.23Å; L73-L100 HydrophobicContact CD2-CD2 3.99Å; M76-L100 HydrophobicContact CE-CD1 3.72Å; M76-L100 HydrophobicContact CE-CD2 3.63Å; M76-L100 HydrophobicContact CE-CG 4.19Å; M76-L100 HydrophobicContact SD-CD1 3.94Å; M76-L100 HydrophobicContact SD-CD2 3.95Å; M76-L100 HydrophobicContact SD-CG 4.17Å; L97-L100 HydrophobicContact CB-CD1 4.41Å; L97-L100 HydrophobicContact CD2-CD1 3.81Å; L97-L100 WeakPolarHBondContact O-CB 3.46Å; L97-L100 WeakPolarHBondContact O-CG 3.28Å; L97-L100 PolarHBondContact O-N 2.86Å; L97-L100 VanDerWaalsContact O-N 3.12Å; L100-E104 HydrophobicContact CB-CB 4Å; L100-E104 HydrophobicContact CD2-CB 4.32Å; L100-L105 HydrophobicContact CB-CB 4.28Å; L100-L105 HydrophobicContact CD1-CD1 4.28Å; L100-L108 HydrophobicContact CD1-CD1 3.95Å; L100-N359 WeakPolarHBondContact O-CB 3.23Å; L100-N359 PolarHBondContact O-ND2 3Å
101	T	92.2	Very high	94.6	Very high	75 Å²	75	50.4 Å²	50.4	46%	0.46	25%	0.25	S	S	.	.			trans	-64.4	160.4	162.5	59.6	0	0	0	0	110.2	D103 E104 L105	T101-D103 PolarHBondContact O-N 2.86Å; T101-E104 WeakPolarHBondContact CB-OE2 3.44Å; T101-E104 WeakPolarHBondContact CG2-OE2 3.33Å; T101-E104 PolarHBondContact N-OE2 3.15Å; T101-E104 PolarHBondContact O-N 3.41Å; T101-E104 WeakPolarHBondContact OG1-CB 3.41Å; T101-E104 VanDerWaalsContact OG1-CD 3.26Å; T101-E104 WeakPolarHBondContact OG1-CG 3.22Å; T101-E104 PolarHBondContact OG1-N 3.41Å; T101-E104 PolarHBondContact OG1-OE2 3.11Å; T101-L105 WeakPolarHBondContact O-CB 3.2Å; T101-L105 PolarHBondContact O-N 2.87Å
102	A	91.8	Very high	94.6	Very high	20 Å²	20	50.1 Å²	50.1	17%	0.165	25%	0.249	C	C	.	.	H	α-helix	trans	-61.2	-33.1	177.7	0	0	0	0	0	112.5	A106 N357	A102-A106 VanDerWaalsContact O-CB 3.31Å; A102-A106 WeakPolarHBondContact O-CB 3.44Å; A102-A106 PolarHBondContact O-N 3.08Å; A102-N357 VanDerWaalsContact CB-O 3.28Å; A102-N357 WeakPolarHBondContact CB-O 3.31Å; A102-N357 WeakPolarHBondContact CB-OD1 3.11Å
103	D	92.8	Very high	94.6	Very high	117 Å²	117	50.3 Å²	50.3	63%	0.626	25%	0.25	S	S	*	.	H	α-helix	trans	-68.7	-46	175.9	-67.9	-31.8	0	0	0	112.3	T101 L105 A106 L107	T101-D103 PolarHBondContact O-N 2.86Å; D103-L105 VanDerWaalsContact C-N 3.3Å; D103-L105 PolarHBondContact O-N 3.23Å; D103-A106 PolarHBondContact O-N 2.88Å; D103-L107 WeakPolarHBondContact O-CB 3.43Å; D103-L107 PolarHBondContact O-N 3.22Å
104	E	94.9	Very high	94.7	Very high	84 Å²	84	53.4 Å²	53.4	39%	0.393	27%	0.265	S	S	.	.	H	α-helix	trans	-60.4	-41.6	174.5	-77.5	167.5	145.3	0	0	111.5	L73 L100 T101 L107 L108	L73-E104 HydrophobicContact CD2-CB 4.1Å; L73-E104 HydrophobicContact CD2-CG 4.46Å; L100-E104 HydrophobicContact CB-CB 4Å; L100-E104 HydrophobicContact CD2-CB 4.32Å; T101-E104 WeakPolarHBondContact CB-OE2 3.44Å; T101-E104 WeakPolarHBondContact CG2-OE2 3.33Å; T101-E104 PolarHBondContact N-OE2 3.15Å; T101-E104 PolarHBondContact O-N 3.41Å; T101-E104 WeakPolarHBondContact OG1-CB 3.41Å; T101-E104 VanDerWaalsContact OG1-CD 3.26Å; T101-E104 WeakPolarHBondContact OG1-CG 3.22Å; T101-E104 PolarHBondContact OG1-N 3.41Å; T101-E104 PolarHBondContact OG1-OE2 3.11Å; E104-L107 PolarHBondContact O-N 3.03Å; E104-L108 WeakPolarHBondContact O-CB 3.44Å; E104-L108 PolarHBondContact O-N 2.96Å
105	L	95.4	Very high	94.8	Very high	1 Å²	1	56 Å²	56	1%	0.005	28%	0.279	C	S	.	.	H	α-helix	trans	-66.4	-42.1	177.6	-176.2	57	0	0	0	112	L97 L100 T101 D103 L107 L108 A109 P225 F226 N359 P360 Y361	L97-L105 HydrophobicContact CB-CD1 4Å; L97-L105 HydrophobicContact CD1-CD1 3.96Å; L97-L105 HydrophobicContact CG-CD1 4.39Å; L100-L105 HydrophobicContact CB-CB 4.28Å; L100-L105 HydrophobicContact CD1-CD1 4.28Å; T101-L105 WeakPolarHBondContact O-CB 3.2Å; T101-L105 PolarHBondContact O-N 2.87Å; D103-L105 VanDerWaalsContact C-N 3.3Å; D103-L105 PolarHBondContact O-N 3.23Å; L105-L107 VanDerWaalsContact C-N 3.34Å; L105-L108 PolarHBondContact O-N 3.08Å; L105-A109 WeakPolarHBondContact O-CB 3.42Å; L105-A109 PolarHBondContact O-N 3.45Å; L105-P225 HydrophobicContact CD1-CG 4.49Å; L105-P225 HydrophobicContact CD2-CB 4.3Å; L105-P225 HydrophobicContact CD2-CG 3.62Å; L105-P225 HydrophobicContact CG-CB 4.08Å; L105-P225 HydrophobicContact CG-CG 3.79Å; L105-F226 HydrophobicContact CD1-CE2 4.18Å; L105-N359 WeakPolarHBondContact CD2-OD1 3.44Å; L105-P360 HydrophobicContact CD2-CG 4.31Å; L105-Y361 HydrophobicContact CD1-CD2 4.19Å; L105-Y361 HydrophobicContact CD1-CE2 3.98Å; L105-Y361 HydrophobicContact CD2-CD2 3.83Å; L105-Y361 HydrophobicContact CD2-CE2 3.88Å; L105-Y361 HydrophobicContact CG-CE2 4.44Å
106	A	95.3	Very high	95.1	Very high	25 Å²	25	52.1 Å²	52.1	21%	0.207	26%	0.258	C	S	.	.	H	α-helix	trans	-64.1	-39.6	175	0	0	0	0	0	111.8	A102 D103 A109 R110	A102-A106 VanDerWaalsContact O-CB 3.31Å; A102-A106 WeakPolarHBondContact O-CB 3.44Å; A102-A106 PolarHBondContact O-N 3.08Å; D103-A106 PolarHBondContact O-N 2.88Å; A106-A109 PolarHBondContact O-N 3.4Å; A106-R110 WeakPolarHBondContact O-CG 3.31Å; A106-R110 PolarHBondContact O-N 3.05Å; A106-R110 VanDerWaalsContact O-N 3.17Å
107	L	95.7	Very high	95.3	Very high	85 Å²	85	49.2 Å²	49.2	45%	0.445	24%	0.244	S	C	.	.	H	α-helix	trans	-65.6	-42.4	174.7	-179.1	59.3	0	0	0	111.4	L73 D103 E104 L105 R110 K111	L73-L107 HydrophobicContact CD1-CB 4.09Å; L73-L107 HydrophobicContact CD1-CD2 3.67Å; L73-L107 HydrophobicContact CD1-CG 3.85Å; D103-L107 WeakPolarHBondContact O-CB 3.43Å; D103-L107 PolarHBondContact O-N 3.22Å; E104-L107 PolarHBondContact O-N 3.03Å; L105-L107 VanDerWaalsContact C-N 3.34Å; L107-R110 PolarHBondContact O-N 3.29Å; L107-K111 WeakPolarHBondContact O-CG 3.45Å; L107-K111 PolarHBondContact O-N 2.87Å
108	L	97.5	Very high	95.4	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-61.8	-46	175.6	-175.6	146.5	0	0	0	111.3	L73 M76 I77 L97 L100 E104 L105 R110 K111 Y112 F226	L73-L108 HydrophobicContact CB-CD1 4.27Å; L73-L108 HydrophobicContact CD2-CD1 4.4Å; L73-L108 VanDerWaalsContact O-CD1 3.3Å; L73-L108 WeakPolarHBondContact O-CD1 3.29Å; M76-L108 HydrophobicContact CB-CD1 3.99Å; M76-L108 HydrophobicContact CE-CD1 3.62Å; M76-L108 HydrophobicContact SD-CD1 4.41Å; I77-L108 HydrophobicContact CD1-CG 4.42Å; I77-L108 HydrophobicContact CG1-CG 4.43Å; L97-L108 HydrophobicContact CD1-CD2 4.2Å; L97-L108 HydrophobicContact CD2-CD1 3.53Å; L97-L108 HydrophobicContact CD2-CD2 3.81Å; L97-L108 HydrophobicContact CD2-CG 4.32Å; L100-L108 HydrophobicContact CD1-CD1 3.95Å; E104-L108 WeakPolarHBondContact O-CB 3.44Å; E104-L108 PolarHBondContact O-N 2.96Å; L105-L108 PolarHBondContact O-N 3.08Å; L108-R110 VanDerWaalsContact C-N 3.31Å; L108-R110 PolarHBondContact O-N 3.46Å; L108-K111 PolarHBondContact O-N 3.39Å; L108-K111 VanDerWaalsContact O-N 3.11Å; L108-Y112 WeakPolarHBondContact O-CB 3.41Å; L108-Y112 PolarHBondContact O-N 3.45Å; L108-F226 HydrophobicContact CD2-CE1 4.18Å; L108-F226 HydrophobicContact CD2-CZ 3.57Å
109	A	98.1	Very high	95.5	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-58.2	-41.7	177.7	0	0	0	0	0	112.1	L105 A106 Y112 F113 F226 L229	L105-A109 WeakPolarHBondContact O-CB 3.42Å; L105-A109 PolarHBondContact O-N 3.45Å; A106-A109 PolarHBondContact O-N 3.4Å; A109-Y112 WeakPolarHBondContact O-CB 3.35Å; A109-Y112 PolarHBondContact O-N 2.97Å; A109-F113 WeakPolarHBondContact O-CD2 3.49Å; A109-F113 PolarHBondContact O-N 3.25Å; A109-F113 VanDerWaalsContact O-N 3.12Å; A109-F226 HydrophobicContact CB-CD1 3.86Å; A109-F226 HydrophobicContact CB-CD2 4.21Å; A109-F226 HydrophobicContact CB-CE1 3.99Å; A109-F226 HydrophobicContact CB-CE2 4.31Å; A109-F226 HydrophobicContact CB-CG 3.99Å; A109-F226 HydrophobicContact CB-CZ 4.23Å; A109-L229 HydrophobicContact CB-CD1 3.92Å
110	R	97.4	Very high	95.7	Very high	137 Å²	137	51.1 Å²	51.1	52%	0.517	25%	0.249	S	C	.	.	H	α-helix	trans	-64.3	-43.2	173.9	-70.2	179.3	-176.2	-81.4	2.7	112.5	A106 L107 L108 K114 L229	A106-R110 WeakPolarHBondContact O-CG 3.31Å; A106-R110 PolarHBondContact O-N 3.05Å; A106-R110 VanDerWaalsContact O-N 3.17Å; L107-R110 PolarHBondContact O-N 3.29Å; L108-R110 VanDerWaalsContact C-N 3.31Å; L108-R110 PolarHBondContact O-N 3.46Å; R110-K114 WeakPolarHBondContact O-CB 3.26Å; R110-K114 PolarHBondContact O-N 2.8Å; R110-L229 HydrophobicContact CG-CD1 3.99Å
111	K	97.1	Very high	95.8	Very high	59 Å²	59	57 Å²	57	26%	0.257	27%	0.269	S	S	.	.	H	α-helix	trans	-63.6	-42.2	176.3	-75.3	-178	178.4	-176	0	111.4	I77 L107 L108 F113 K114 I115	I77-K111 HydrophobicContact CD1-CB 4.43Å; L107-K111 WeakPolarHBondContact O-CG 3.45Å; L107-K111 PolarHBondContact O-N 2.87Å; L108-K111 PolarHBondContact O-N 3.39Å; L108-K111 VanDerWaalsContact O-N 3.11Å; K111-F113 PolarHBondContact O-N 3.5Å; K111-K114 WeakPolarHBondContact O-CB 3.47Å; K111-K114 PolarHBondContact O-N 3.17Å; K111-I115 WeakPolarHBondContact O-CG1 3.39Å; K111-I115 PolarHBondContact O-N 2.9Å
112	Y	98.4	Very high	95.8	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-55.8	-52.3	177	-174.4	-83.6	0	0	0	111	I77 L90 S92 L108 A109 K114 I115 L116 G135 V136 V137 F226 F434	I77-Y112 HydrophobicContact CD1-CD2 4.36Å; I77-Y112 HydrophobicContact CG1-CD2 4.23Å; I77-Y112 HydrophobicContact CG2-CD2 4.01Å; I77-Y112 HydrophobicContact CG2-CE2 4.35Å; L90-Y112 HydrophobicContact CD2-CD1 4.37Å; L90-Y112 HydrophobicContact CD2-CD2 4Å; L90-Y112 HydrophobicContact CD2-CE1 4.15Å; L90-Y112 HydrophobicContact CD2-CE2 3.76Å; L90-Y112 HydrophobicContact CD2-CG 4.28Å; L90-Y112 HydrophobicContact CG-CD2 4.44Å; L90-Y112 HydrophobicContact CG-CE2 3.86Å; L90-Y112 PolarHBondContact O-OH 3.4Å; S92-Y112 WeakPolarHBondContact OG-CD2 3.34Å; L108-Y112 WeakPolarHBondContact O-CB 3.41Å; L108-Y112 PolarHBondContact O-N 3.45Å; A109-Y112 WeakPolarHBondContact O-CB 3.35Å; A109-Y112 PolarHBondContact O-N 2.97Å; Y112-K114 PolarHBondContact O-N 3.3Å; Y112-I115 PolarHBondContact O-N 2.99Å; Y112-L116 HydrophobicContact CE1-CD2 4.08Å; Y112-L116 WeakPolarHBondContact O-CB 3.49Å; Y112-L116 PolarHBondContact O-N 2.77Å; Y112-G135 WeakPolarHBondContact OH-CA 3.28Å; Y112-V136 PolarHBondContact OH-N 3.43Å; Y112-V136 PolarHBondContact OH-O 3.43Å; Y112-V137 HydrophobicContact CE1-CG2 4.23Å; Y112-V137 HydrophobicContact CE2-CG2 4.21Å; Y112-F226 HydrophobicContact CD1-CD1 4.22Å; Y112-F226 HydrophobicContact CD1-CE1 4.02Å; Y112-F226 HydrophobicContact CD2-CE1 4.16Å; Y112-F226 HydrophobicContact CG-CD1 4.38Å; Y112-F226 AromaticContact CG-CE1 3.75Å; Y112-F226 HydrophobicContact CG-CE1 3.75Å; Y112-F434 AromaticContact CE1-CD2 3.96Å; Y112-F434 HydrophobicContact CE1-CD2 3.96Å; Y112-F434 HydrophobicContact CE1-CE2 4.18Å
113	F	98.3	Very high	95.9	Very high	5 Å²	5	70.8 Å²	70.8	2%	0.022	31%	0.312	C	S	.	.	H	α-helix	trans	-68.3	-32.8	177.5	-69.8	-52.5	0	0	0	113.8	A109 K111 I115 L116 F117 F226 L229 V230 L236 F434	A109-F113 WeakPolarHBondContact O-CD2 3.49Å; A109-F113 PolarHBondContact O-N 3.25Å; A109-F113 VanDerWaalsContact O-N 3.12Å; K111-F113 PolarHBondContact O-N 3.5Å; F113-I115 VanDerWaalsContact C-N 3.31Å; F113-I115 PolarHBondContact O-N 2.82Å; F113-L116 HydrophobicContact CD1-CD2 4.38Å; F113-L116 PolarHBondContact O-N 3.16Å; F113-F117 HydrophobicContact CB-CD2 4.02Å; F113-F117 HydrophobicContact CB-CE2 4.36Å; F113-F117 AromaticContact CD1-CD2 3.79Å; F113-F117 HydrophobicContact CD1-CD2 3.79Å; F113-F117 AromaticContact CD1-CE2 3.3Å; F113-F117 HydrophobicContact CD1-CE2 3.3Å; F113-F117 HydrophobicContact CD1-CZ 4.14Å; F113-F117 AromaticContact CE1-CE2 3.86Å; F113-F117 HydrophobicContact CE1-CE2 3.86Å; F113-F117 HydrophobicContact CE1-CZ 4.39Å; F113-F117 HydrophobicContact CG-CD2 4.27Å; F113-F117 HydrophobicContact CG-CE2 4.1Å; F113-F117 WeakPolarHBondContact O-CB 3.4Å; F113-F117 PolarHBondContact O-N 3.48Å; F113-F226 HydrophobicContact CE2-CB 4.13Å; F113-F226 HydrophobicContact CE2-CD1 4.18Å; F113-F226 VanDerWaalsContact CE2-O 3.31Å; F113-F226 WeakPolarHBondContact CE2-O 3.3Å; F113-F226 HydrophobicContact CZ-CB 4.06Å; F113-F226 HydrophobicContact CZ-CD1 4.22Å; F113-L229 HydrophobicContact CD2-CB 4.11Å; F113-L229 HydrophobicContact CD2-CD1 3.75Å; F113-L229 HydrophobicContact CE2-CB 3.93Å; F113-L229 HydrophobicContact CE2-CD1 3.91Å; F113-L229 HydrophobicContact CE2-CG 4.44Å; F113-V230 HydrophobicContact CD1-CG1 4.13Å; F113-V230 HydrophobicContact CD2-CG1 4.14Å; F113-V230 HydrophobicContact CE1-CG1 3.8Å; F113-V230 HydrophobicContact CE1-CG2 4.35Å; F113-V230 HydrophobicContact CE2-CG1 3.82Å; F113-V230 HydrophobicContact CE2-CG2 4.38Å; F113-V230 HydrophobicContact CG-CG1 4.28Å; F113-V230 HydrophobicContact CZ-CB 4.39Å; F113-V230 HydrophobicContact CZ-CG1 3.63Å; F113-V230 HydrophobicContact CZ-CG2 3.78Å; F113-L236 HydrophobicContact CB-CD1 3.91Å; F113-L236 HydrophobicContact CD2-CD1 3.95Å; F113-L236 HydrophobicContact CG-CD1 4.06Å; F113-F434 AromaticContact CE1-CD1 3.65Å; F113-F434 HydrophobicContact CE1-CD1 3.65Å; F113-F434 AromaticContact CE1-CD2 3.91Å; F113-F434 HydrophobicContact CE1-CD2 3.91Å; F113-F434 AromaticContact CE1-CE1 3.68Å; F113-F434 HydrophobicContact CE1-CE1 3.68Å; F113-F434 AromaticContact CE1-CE2 3.92Å; F113-F434 HydrophobicContact CE1-CE2 3.92Å; F113-F434 AromaticContact CE1-CG 3.77Å; F113-F434 HydrophobicContact CE1-CG 3.77Å; F113-F434 AromaticContact CE1-CZ 3.81Å; F113-F434 HydrophobicContact CE1-CZ 3.81Å; F113-F434 HydrophobicContact CZ-CD1 4.05Å; F113-F434 HydrophobicContact CZ-CD2 4.48Å; F113-F434 AromaticContact CZ-CE1 3.57Å; F113-F434 HydrophobicContact CZ-CE1 3.57Å; F113-F434 HydrophobicContact CZ-CE2 4.03Å; F113-F434 HydrophobicContact CZ-CG 4.48Å; F113-F434 AromaticContact CZ-CZ 3.56Å; F113-F434 HydrophobicContact CZ-CZ 3.56Å
114	K	96.8	Very high	95.8	Very high	156 Å²	156	68.9 Å²	68.9	68%	0.678	32%	0.321	S	S	*	.	H	α-helix	trans	-59.4	-45	171.3	-175	176.2	179.9	178.4	0	110.5	R110 K111 Y112 T118	R110-K114 WeakPolarHBondContact O-CB 3.26Å; R110-K114 PolarHBondContact O-N 2.8Å; K111-K114 WeakPolarHBondContact O-CB 3.47Å; K111-K114 PolarHBondContact O-N 3.17Å; Y112-K114 PolarHBondContact O-N 3.3Å; K114-T118 VanDerWaalsContact O-CB 3.25Å; K114-T118 WeakPolarHBondContact O-CB 3.17Å; K114-T118 PolarHBondContact O-N 3.03Å; K114-T118 PolarHBondContact O-OG1 3.16Å
115	I	97	Very high	95.8	Very high	57 Å²	57	66.7 Å²	66.7	29%	0.292	31%	0.313	S	S	.	.	H	α-helix	trans	-66.7	-48.5	178.1	-67.2	165.6	0	0	0	110.6	I77 L90 K111 Y112 F113 Y132	I77-I115 HydrophobicContact CD1-CD1 3.98Å; I77-I115 HydrophobicContact CG2-CD1 4.41Å; L90-I115 HydrophobicContact CD1-CG2 3.94Å; L90-I115 HydrophobicContact CD2-CB 4.24Å; L90-I115 HydrophobicContact CD2-CG2 3.87Å; K111-I115 WeakPolarHBondContact O-CG1 3.39Å; K111-I115 PolarHBondContact O-N 2.9Å; Y112-I115 PolarHBondContact O-N 2.99Å; F113-I115 VanDerWaalsContact C-N 3.31Å; F113-I115 PolarHBondContact O-N 2.82Å; I115-Y132 HydrophobicContact CG2-CD2 4.33Å; I115-Y132 HydrophobicContact CG2-CE2 3.38Å; I115-Y132 WeakPolarHBondContact CG2-OH 3.21Å
116	L	98.2	Very high	95.6	Very high	0 Å²	0	73 Å²	73	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-66.1	-42.8	-175.1	-179.5	64.4	0	0	0	113.7	L90 Y112 F113 S130 Y132 F434 P436	L90-L116 HydrophobicContact CB-CD1 4.38Å; L90-L116 HydrophobicContact CD2-CB 3.89Å; L90-L116 HydrophobicContact CD2-CD1 4.46Å; Y112-L116 HydrophobicContact CE1-CD2 4.08Å; Y112-L116 WeakPolarHBondContact O-CB 3.49Å; Y112-L116 PolarHBondContact O-N 2.77Å; F113-L116 HydrophobicContact CD1-CD2 4.38Å; F113-L116 PolarHBondContact O-N 3.16Å; L116-S130 WeakPolarHBondContact O-CB 3.44Å; L116-S130 PolarHBondContact O-OG 3.17Å; L116-Y132 HydrophobicContact CD1-CG 4.49Å; L116-F434 HydrophobicContact CD2-CB 3.45Å; L116-F434 VanDerWaalsContact CD2-CB 3.45Å; L116-F434 HydrophobicContact CD2-CD2 4.33Å; L116-F434 HydrophobicContact CD2-CG 4.18Å; L116-P436 HydrophobicContact CD1-CG 4.12Å; L116-P436 HydrophobicContact CG-CG 4.33Å
117	F	97.6	Very high	95.6	Very high	5 Å²	5	72.9 Å²	72.9	2%	0.022	33%	0.334	C	S	.	.	H	α-helix	trans	-104	2.3	-171.2	-62.4	-48.2	0	0	0	114.3	F113 E119 V230 A318 F434 P436 L458 Y461	F113-F117 HydrophobicContact CB-CD2 4.02Å; F113-F117 HydrophobicContact CB-CE2 4.36Å; F113-F117 AromaticContact CD1-CD2 3.79Å; F113-F117 HydrophobicContact CD1-CD2 3.79Å; F113-F117 AromaticContact CD1-CE2 3.3Å; F113-F117 HydrophobicContact CD1-CE2 3.3Å; F113-F117 HydrophobicContact CD1-CZ 4.14Å; F113-F117 AromaticContact CE1-CE2 3.86Å; F113-F117 HydrophobicContact CE1-CE2 3.86Å; F113-F117 HydrophobicContact CE1-CZ 4.39Å; F113-F117 HydrophobicContact CG-CD2 4.27Å; F113-F117 HydrophobicContact CG-CE2 4.1Å; F113-F117 WeakPolarHBondContact O-CB 3.4Å; F113-F117 PolarHBondContact O-N 3.48Å; F117-E119 PolarHBondContact O-N 2.97Å; F117-V230 HydrophobicContact CE2-CG1 4.14Å; F117-A318 HydrophobicContact CE1-CB 4.1Å; F117-A318 HydrophobicContact CZ-CB 4.43Å; F117-F434 HydrophobicContact CZ-CB 4.14Å; F117-P436 HydrophobicContact CD1-CB 4.2Å; F117-P436 HydrophobicContact CD1-CG 4.1Å; F117-P436 HydrophobicContact CE1-CB 4.43Å; F117-P436 HydrophobicContact CE1-CG 4.21Å; F117-L458 HydrophobicContact CB-CD1 3.81Å; F117-L458 HydrophobicContact CD1-CD1 3.64Å; F117-L458 HydrophobicContact CD2-CD1 3.46Å; F117-L458 VanDerWaalsContact CD2-CD1 3.46Å; F117-L458 HydrophobicContact CD2-CD2 4.2Å; F117-L458 HydrophobicContact CE1-CD1 3.97Å; F117-L458 HydrophobicContact CE2-CD1 3.79Å; F117-L458 HydrophobicContact CE2-CD2 4.2Å; F117-L458 HydrophobicContact CG-CD1 3.38Å; F117-L458 HydrophobicContact CZ-CD1 4.03Å; F117-Y461 WeakPolarHBondContact CD1-OH 3.48Å; F117-Y461 WeakPolarHBondContact O-CE1 3.47Å
118	T	95.4	Very high	95.5	Very high	66 Å²	66	69.6 Å²	69.6	41%	0.405	32%	0.317	S	S	.	.			trans	-66.2	120.6	172.1	-71.1	0	0	0	0	109.6	K114	K114-T118 VanDerWaalsContact O-CB 3.25Å; K114-T118 WeakPolarHBondContact O-CB 3.17Å; K114-T118 PolarHBondContact O-N 3.03Å; K114-T118 PolarHBondContact O-OG1 3.16Å
119	E	95.3	Very high	95.4	Very high	17 Å²	17	69.9 Å²	69.9	8%	0.079	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	148.4	175.1	-67.5	-176	144.8	0	0	112.1	F117 P128 F129 R437 Y461	F117-E119 PolarHBondContact O-N 2.97Å; E119-P128 HydrophobicContact CB-CB 4.08Å; E119-P128 HydrophobicContact CG-CB 4.44Å; E119-P128 WeakPolarHBondContact OE2-CB 3.5Å; E119-F129 CarbonylContact C-O 3.59Å; E119-F129 VanDerWaalsContact CA-O 3.28Å; E119-F129 WeakPolarHBondContact CA-O 3.15Å; E119-R437 WeakPolarHBondContact OE1-CG 3.37Å; E119-R437 IonicContact OE1-CZ 3.83Å; E119-R437 IonicContact OE1-NE 3.77Å; E119-R437 PolarHBondContact OE1-NE 3.34Å; E119-R437 IonicContact OE1-NH2 2.77Å; E119-R437 PolarHBondContact OE1-NH2 3.49Å; E119-R437 IonicContact OE2-CZ 2.89Å; E119-R437 IonicContact OE2-NE 3.7Å; E119-R437 IonicContact OE2-NH2 3.34Å; E119-R437 PolarHBondContact OE2-NH2 3.13Å; E119-Y461 VanDerWaalsContact CD-CE1 3.47Å; E119-Y461 HydrophobicContact CG-CD1 4.24Å; E119-Y461 HydrophobicContact CG-CE1 3.69Å
120	R	93	Very high	95.4	Very high	144 Å²	144	69.9 Å²	69.9	54%	0.543	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	153.7	171.4	-63.4	179.2	178.5	168.7	-0.4	109.1	F129	R120-F129 HydrophobicContact CB-CE1 4.4Å; R120-F129 HydrophobicContact CB-CE2 4.25Å; R120-F129 HydrophobicContact CB-CZ 4.04Å; R120-F129 PolarHBondContact N-O 2.61Å; R120-F129 VanDerWaalsContact O-CD1 3.24Å; R120-F129 WeakPolarHBondContact O-CD1 3.08Å; R120-F129 WeakPolarHBondContact O-CE1 3.13Å; R120-F129 PolarHBondContact O-N 3.17Å; R120-F129 VanDerWaalsContact O-N 3.13Å
121	R	93.3	Very high	95.4	Very high	143 Å²	143	65.5 Å²	65.5	54%	0.54	30%	0.304	S	S	.	.			trans	-110.5	135.3	166.9	-68.7	-178.8	171.9	-86.9	4.5	108.2	P128 D468	R121-P128 HydrophobicContact CG-CB 4.44Å; R121-D468 IonicContact CZ-OD2 3.64Å; R121-D468 VanDerWaalsContact CZ-OD2 3.3Å; R121-D468 IonicContact NE-OD2 3.61Å; R121-D468 IonicContact NH2-OD2 3.03Å; R121-D468 PolarHBondContact NH2-OD2 3.35Å
122	K	92.9	Very high	95.4	Very high	137 Å²	137	64.1 Å²	64.1	60%	0.596	30%	0.297	S	S	*	.			trans	-134.9	135.6	176.7	-174.9	-179.7	178.1	-177.7	0	108.6	G124 V125 F129	K122-G124 PolarHBondContact O-N 3.36Å; K122-V125 HydrophobicContact CB-CG2 4.17Å; K122-V125 PolarHBondContact O-N 3.32Å; K122-F129 HydrophobicContact CB-CE1 3.82Å; K122-F129 HydrophobicContact CB-CZ 4.04Å
123	R	93.5	Very high	95.4	Very high	248 Å²	248	64.1 Å²	64.1	94%	0.936	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.1	130	174.3	-173.8	179.2	178.8	-174	0.3	110
124	G	91.6	Very high	95.5	Very high	78 Å²	78	63.9 Å²	63.9	80%	0.804	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	91	-12.5	-178	0	0	0	0	0	115.1	K122	K122-G124 PolarHBondContact O-N 3.36Å
125	V	93.3	Very high	95.6	Very high	38 Å²	38	56.5 Å²	56.5	23%	0.23	26%	0.264	C	S	.	.			trans	-96.1	123.7	171.7	-175.7	0	0	0	0	108.7	K122 V127 F129 R381	K122-V125 HydrophobicContact CB-CG2 4.17Å; K122-V125 PolarHBondContact O-N 3.32Å; V125-V127 VanDerWaalsContact C-N 3.32Å; V125-V127 WeakPolarHBondContact CG1-O 3.42Å; V125-V127 PolarHBondContact O-N 2.71Å; V125-F129 HydrophobicContact CB-CD1 4.33Å; V125-F129 HydrophobicContact CB-CE1 4.24Å; V125-F129 HydrophobicContact CG1-CD1 3.77Å; V125-F129 HydrophobicContact CG1-CE1 4.16Å; V125-F129 HydrophobicContact CG2-CE1 4.2Å; V125-R381 HydrophobicContact CG1-CB 4.21Å; V125-R381 HydrophobicContact CG1-CG 4.29Å; V125-R381 WeakPolarHBondContact CG1-O 3.16Å; V125-R381 HydrophobicContact CG2-CB 4.45Å; V125-R381 HydrophobicContact CG2-CG 4.37Å
126	R	93.1	Very high	95.6	Very high	132 Å²	132	53.8 Å²	53.8	50%	0.498	25%	0.25	S	S	.	.	S	Bend	trans	-73.8	-18.4	-172.3	-69.4	-170.6	-83.6	178	-2.5	114.4	V384 D385 E388	R126-V384 HydrophobicContact CB-CB 4.45Å; R126-V384 HydrophobicContact CB-CG2 3.82Å; R126-V384 VanDerWaalsContact NH2-CG1 3.26Å; R126-D385 IonicContact CZ-OD1 3.93Å; R126-D385 IonicContact NE-OD1 3.55Å; R126-D385 IonicContact NH2-OD1 2.77Å; R126-D385 PolarHBondContact NH2-OD1 3.13Å; R126-E388 IonicContact CZ-OE1 2.84Å; R126-E388 IonicContact NH1-OE1 2.73Å; R126-E388 PolarHBondContact NH1-OE1 3.28Å; R126-E388 IonicContact NH2-OE1 3.59Å; R126-E388 PolarHBondContact NH2-OE1 3.09Å; R126-E388 IonicContact NH2-OE2 2.89Å
127	V	93.3	Very high	95.6	Very high	24 Å²	24	53.8 Å²	53.8	15%	0.145	25%	0.25	C	S	.	.	S	Bend	trans	-128.6	151.8	-177.5	-66.7	0	0	0	0	111.5	V125 Y383 V384 N438	V125-V127 VanDerWaalsContact C-N 3.32Å; V125-V127 WeakPolarHBondContact CG1-O 3.42Å; V125-V127 PolarHBondContact O-N 2.71Å; V127-Y383 HydrophobicContact CG1-CD1 4.25Å; V127-V384 HydrophobicContact CG1-CG2 3.7Å; V127-N438 HydrophobicContact CG2-CB 4.38Å
128	P	94.6	Very high	95.6	Very high	15 Å²	15	54.8 Å²	54.8	10%	0.097	26%	0.255	C	S	.	.			trans	-61.9	145.9	163.8	30.6	-35.6	0	0	0	109.6	E119 R121 N438	E119-P128 HydrophobicContact CB-CB 4.08Å; E119-P128 HydrophobicContact CG-CB 4.44Å; E119-P128 WeakPolarHBondContact OE2-CB 3.5Å; R121-P128 HydrophobicContact CG-CB 4.44Å; P128-N438 PolarHBondContact O-ND2 3.26Å; P128-N438 VanDerWaalsContact O-ND2 3.13Å
129	F	96.2	Very high	95.6	Very high	7 Å²	7	52 Å²	52	3%	0.031	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	143.2	-171.9	65.6	-90	0	0	0	112.1	E119 R120 K122 V125 P380 R381	E119-F129 CarbonylContact C-O 3.59Å; E119-F129 VanDerWaalsContact CA-O 3.28Å; E119-F129 WeakPolarHBondContact CA-O 3.15Å; R120-F129 HydrophobicContact CB-CE1 4.4Å; R120-F129 HydrophobicContact CB-CE2 4.25Å; R120-F129 HydrophobicContact CB-CZ 4.04Å; R120-F129 PolarHBondContact N-O 2.61Å; R120-F129 VanDerWaalsContact O-CD1 3.24Å; R120-F129 WeakPolarHBondContact O-CD1 3.08Å; R120-F129 WeakPolarHBondContact O-CE1 3.13Å; R120-F129 PolarHBondContact O-N 3.17Å; R120-F129 VanDerWaalsContact O-N 3.13Å; K122-F129 HydrophobicContact CB-CE1 3.82Å; K122-F129 HydrophobicContact CB-CZ 4.04Å; V125-F129 HydrophobicContact CB-CD1 4.33Å; V125-F129 HydrophobicContact CB-CE1 4.24Å; V125-F129 HydrophobicContact CG1-CD1 3.77Å; V125-F129 HydrophobicContact CG1-CE1 4.16Å; V125-F129 HydrophobicContact CG2-CE1 4.2Å; F129-P380 HydrophobicContact CB-CB 4.1Å; F129-P380 HydrophobicContact CB-CG 4.07Å; F129-R381 HydrophobicContact CB-CG 3.95Å; F129-R381 HydrophobicContact CD1-CG 3.66Å; F129-R381 HydrophobicContact CD2-CG 3.22Å; F129-R381 HydrophobicContact CE1-CG 3.89Å; F129-R381 HydrophobicContact CE2-CG 3.5Å; F129-R381 HydrophobicContact CG-CB 4.49Å; F129-R381 HydrophobicContact CG-CG 3.32Å; F129-R381 HydrophobicContact CZ-CG 3.82Å
130	S	97.2	Very high	95.6	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	147.9	162.8	176.4	0	0	0	0	110.4	L116 Y132 P380	L116-S130 WeakPolarHBondContact O-CB 3.44Å; L116-S130 PolarHBondContact O-OG 3.17Å; S130-Y132 PolarHBondContact O-N 3.2Å; S130-Y132 PolarHBondContact OG-N 3.17Å; S130-Y132 VanDerWaalsContact OG-N 3.1Å; S130-Y132 PolarHBondContact OG-O 2.95Å; S130-P380 WeakPolarHBondContact O-CG 3.4Å
131	H	96.6	Very high	95.7	Very high	44 Å²	44	44.5 Å²	44.5	20%	0.204	21%	0.211	C	C	.	.	S	Bend	trans	-65.8	-21.5	171.4	-168.5	56	0	0	0	113.2	Y88	Y88-H131 AromaticContact CD2-CE1 3.88Å; Y88-H131 AromaticContact CD2-NE2 3.74Å; Y88-H131 AromaticContact CE2-CE1 3.81Å; Y88-H131 AromaticContact CE2-NE2 3.83Å
132	Y	98.5	Very high	95.5	Very high	31 Å²	31	38.6 Å²	38.6	12%	0.122	19%	0.189	C	C	.	.			trans	-108	141.6	-174.4	-56.4	-81.6	0	0	0	111	V79 Y88 L90 I115 L116 S130	V79-Y132 HydrophobicContact CB-CE1 4.48Å; V79-Y132 HydrophobicContact CG1-CE1 3.91Å; V79-Y132 HydrophobicContact CG2-CE1 3.86Å; Y88-Y132 CarbonylContact O-C 3.57Å; Y88-Y132 WeakPolarHBondContact O-CA 3.49Å; L90-Y132 HydrophobicContact CB-CD1 4.01Å; L90-Y132 HydrophobicContact CB-CE1 4.36Å; L90-Y132 HydrophobicContact CB-CG 4.27Å; L90-Y132 HydrophobicContact CD1-CD1 4.27Å; L90-Y132 HydrophobicContact CD1-CE1 3.76Å; L90-Y132 HydrophobicContact CD1-CE2 4.42Å; I115-Y132 HydrophobicContact CG2-CD2 4.33Å; I115-Y132 HydrophobicContact CG2-CE2 3.38Å; I115-Y132 WeakPolarHBondContact CG2-OH 3.21Å; L116-Y132 HydrophobicContact CD1-CG 4.49Å; S130-Y132 PolarHBondContact O-N 3.2Å; S130-Y132 PolarHBondContact OG-N 3.17Å; S130-Y132 VanDerWaalsContact OG-N 3.1Å; S130-Y132 PolarHBondContact OG-O 2.95Å
133	C	98.6	Very high	95.3	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.173	C	C	.	.	S	Bend	trans	-75.2	-39.7	174.2	-55.5	0	0	0	0	111.1	Y88 V377 D379 V423 P436	Y88-C133 PolarHBondContact O-N 3.3Å; C133-V377 HydrophobicContact CB-CB 4.08Å; C133-V377 HydrophobicContact CB-CG1 3.74Å; C133-V377 VanDerWaalsContact O-CG1 3.29Å; C133-V377 WeakPolarHBondContact O-CG1 3.48Å; C133-D379 VanDerWaalsContact SG-CA 3.54Å; C133-V423 HydrophobicContact CB-CG2 4.08Å; C133-P436 WeakPolarHBondContact O-CD 3.31Å
134	I	98.8	Very high	95.2	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154	147.3	-174.2	-174.7	166.8	0	0	0	110.5	A89 L90 V136 V377 L425 Y433 F434 I435	A89-I134 WeakPolarHBondContact CA-O 3.4Å; A89-I134 HydrophobicContact CB-CG2 3.78Å; L90-I134 PolarHBondContact N-O 3.46Å; I134-V136 HydrophobicContact CD1-CG2 4.24Å; I134-V136 HydrophobicContact CG1-CG2 4.15Å; I134-V377 HydrophobicContact CB-CG1 4.26Å; I134-V377 HydrophobicContact CB-CG2 4.27Å; I134-V377 HydrophobicContact CD1-CG2 4.05Å; I134-V377 HydrophobicContact CG2-CG2 4.29Å; I134-L425 HydrophobicContact CG2-CD2 3.5Å; I134-Y433 HydrophobicContact CD1-CD2 4.41Å; I134-F434 WeakPolarHBondContact CA-O 3.08Å; I134-I435 HydrophobicContact CD1-CG1 4.27Å; I134-I435 HydrophobicContact CG1-CG1 4.26Å
135	G	98.8	Very high	95.2	Very high	0 Å²	0	22 Å²	22	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	136.7	165.1	0	0	0	0	0	111	L90 Y112 Y433 F434	L90-G135 CarbonylContact O-C 3.55Å; L90-G135 VanDerWaalsContact O-CA 3.27Å; L90-G135 WeakPolarHBondContact O-CA 3.44Å; Y112-G135 WeakPolarHBondContact OH-CA 3.28Å; G135-Y433 CarbonylContact O-C 3.58Å; G135-Y433 WeakPolarHBondContact O-CA 3.32Å; G135-F434 PolarHBondContact N-O 3.38Å; G135-F434 PolarHBondContact O-N 3.38Å
136	V	98.8	Very high	95.2	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	133.3	174	-169.7	0	0	0	0	110.5	L90 H91 S92 Y112 I134 H138 L425 L427 D431 I432	L90-V136 PolarHBondContact O-N 3.28Å; H91-V136 CarbonylContact C-O 3.5Å; H91-V136 VanDerWaalsContact CA-O 3.31Å; H91-V136 WeakPolarHBondContact CA-O 3.29Å; S92-V136 PolarHBondContact N-O 3.15Å; Y112-V136 PolarHBondContact OH-N 3.43Å; Y112-V136 PolarHBondContact OH-O 3.43Å; I134-V136 HydrophobicContact CD1-CG2 4.24Å; I134-V136 HydrophobicContact CG1-CG2 4.15Å; V136-H138 VanDerWaalsContact CG1-CE1 3.45Å; V136-H138 WeakPolarHBondContact CG1-CE1 3.47Å; V136-L425 HydrophobicContact CG2-CD1 4.16Å; V136-L427 HydrophobicContact CB-CD2 4.45Å; V136-L427 HydrophobicContact CG1-CD2 3.85Å; V136-L427 HydrophobicContact CG2-CD2 3.66Å; V136-D431 HydrophobicContact CG1-CB 4.13Å; V136-I432 WeakPolarHBondContact CA-O 3.48Å
137	V	98.3	Very high	95.2	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	102	166.1	-172.8	0	0	0	0	107.9	S92 L97 Y112 G139 A140 F226 I432 F434	S92-V137 CarbonylContact O-C 3.58Å; S92-V137 WeakPolarHBondContact O-CA 3.49Å; L97-V137 HydrophobicContact CD1-CG1 4.24Å; Y112-V137 HydrophobicContact CE1-CG2 4.23Å; Y112-V137 HydrophobicContact CE2-CG2 4.21Å; V137-G139 PolarHBondContact O-N 3.45Å; V137-A140 HydrophobicContact CB-CB 4.18Å; V137-A140 HydrophobicContact CG1-CB 3.81Å; V137-F226 HydrophobicContact CG1-CD2 4.43Å; V137-F226 HydrophobicContact CG1-CE2 4.05Å; V137-F226 HydrophobicContact CG1-CZ 4.14Å; V137-F226 HydrophobicContact CG2-CD1 3.77Å; V137-F226 HydrophobicContact CG2-CD2 4.49Å; V137-F226 HydrophobicContact CG2-CE1 3.61Å; V137-F226 HydrophobicContact CG2-CE2 4.37Å; V137-F226 HydrophobicContact CG2-CG 4.21Å; V137-F226 HydrophobicContact CG2-CZ 3.93Å; V137-I432 HydrophobicContact CB-CD1 4.08Å; V137-I432 HydrophobicContact CB-CG1 3.76Å; V137-I432 HydrophobicContact CG2-CG1 4.4Å; V137-I432 PolarHBondContact N-O 3.03Å; V137-I432 PolarHBondContact O-N 3.36Å; V137-F434 HydrophobicContact CG2-CE2 3.94Å
138	H	97.2	Very high	95.3	Very high	26 Å²	26	13.6 Å²	13.6	12%	0.12	7%	0.066	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	130.1	-171.6	-67.5	-73.6	0	0	0	111.5	H91 S92 Y93 A94 V136 A140 D431	H91-H138 AromaticContact CE1-NE2 3.82Å; H91-H138 AromaticContact CG-NE2 3.99Å; H91-H138 AromaticContact ND1-CD2 3.8Å; H91-H138 AromaticContact ND1-CE1 3.99Å; H91-H138 AromaticContact ND1-NE2 2.96Å; H91-H138 PolarHBondContact ND1-NE2 3.36Å; S92-H138 PolarHBondContact O-N 3.08Å; Y93-H138 HydrophobicContact CD1-CB 3.65Å; Y93-H138 AromaticContact CD1-CD2 3.67Å; Y93-H138 AromaticContact CD1-CG 3.93Å; Y93-H138 HydrophobicContact CE1-CB 4.03Å; Y93-H138 AromaticContact CE1-CD2 3.23Å; Y93-H138 WeakPolarHBondContact CE1-CD2 3.46Å; Y93-H138 AromaticContact CE1-CG 3.78Å; Y93-H138 HydrophobicContact CG-CB 4.5Å; Y93-H138 AromaticContact CZ-CD2 3.74Å; A94-H138 VanDerWaalsContact CB-O 3.22Å; A94-H138 WeakPolarHBondContact CB-O 3.4Å; A94-H138 PolarHBondContact N-O 3.26Å; V136-H138 VanDerWaalsContact CG1-CE1 3.45Å; V136-H138 WeakPolarHBondContact CG1-CE1 3.47Å; H138-A140 VanDerWaalsContact C-N 3.29Å; H138-A140 PolarHBondContact O-N 2.92Å; H138-D431 WeakPolarHBondContact CA-OD1 3.23Å; H138-D431 IonicContact CE1-OD2 3.54Å; H138-D431 IonicContact CG-OD1 2.73Å; H138-D431 VanDerWaalsContact ND1-CG 3.33Å; H138-D431 IonicContact ND1-OD1 2.69Å; H138-D431 PolarHBondContact ND1-OD1 2.63Å; H138-D431 IonicContact ND1-OD2 3.46Å; H138-D431 PolarHBondContact ND1-OD2 3.42Å
139	G	94.7	Very high	95.2	Very high	9 Å²	9	14.3 Å²	14.3	9%	0.093	7%	0.071	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.1	10.6	176.5	0	0	0	0	0	116.5	V137 R142 N430 D431	V137-G139 PolarHBondContact O-N 3.45Å; G139-R142 WeakPolarHBondContact O-CB 3.47Å; G139-R142 WeakPolarHBondContact O-CG 3.5Å; G139-R142 PolarHBondContact O-NE 2.95Å; G139-N430 CarbonylContact C-O 3.45Å; G139-N430 WeakPolarHBondContact CA-O 3.35Å; G139-N430 PolarHBondContact N-O 2.89Å; G139-D431 PolarHBondContact N-OD1 3.08Å
140	A	95.6	Very high	95.1	Very high	1 Å²	1	16 Å²	16	1%	0.008	8%	0.078	C	C	.	.	G	3₁₀ helix	trans	-68.9	-35.3	-178.9	0	0	0	0	0	113.7	V137 H138 R142 Y361 N430 I432	V137-A140 HydrophobicContact CB-CB 4.18Å; V137-A140 HydrophobicContact CG1-CB 3.81Å; H138-A140 VanDerWaalsContact C-N 3.29Å; H138-A140 PolarHBondContact O-N 2.92Å; A140-R142 PolarHBondContact O-N 3.36Å; A140-Y361 HydrophobicContact CB-CE1 3.92Å; A140-Y361 WeakPolarHBondContact O-CE1 3.2Å; A140-N430 PolarHBondContact N-O 3.46Å; A140-I432 HydrophobicContact CB-CD1 3.54Å; A140-I432 HydrophobicContact CB-CG1 3.81Å; A140-I432 HydrophobicContact CB-CG2 4.38Å
141	A	94.5	Very high	94.9	Very high	2 Å²	2	16 Å²	16	2%	0.017	8%	0.078	C	C	.	.	G	3₁₀ helix	trans	-77.7	16.5	-179.4	0	0	0	0	0	114	R143 M144 L322 N430 I432	A141-R143 PolarHBondContact O-N 2.72Å; A141-M144 HydrophobicContact CB-CG 4.25Å; A141-M144 WeakPolarHBondContact O-CB 3.39Å; A141-M144 PolarHBondContact O-N 2.85Å; A141-L322 HydrophobicContact CB-CD1 3.77Å; A141-L322 HydrophobicContact CB-CD2 4.04Å; A141-L322 HydrophobicContact CB-CG 3.61Å; A141-N430 PolarHBondContact N-O 3.36Å; A141-I432 HydrophobicContact CB-CG2 3.82Å
142	R	89.9	Confident	94.8	Very high	18 Å²	18	15.2 Å²	15.2	7%	0.068	8%	0.077	C	C	.	.	G	3₁₀ helix	trans	-57.5	-23.9	-178.3	58.4	174.8	70.4	-172.2	-2.3	114.6	D95 G139 A140 Y363 L365 N430	D95-R142 IonicContact OD1-CZ 3.31Å; D95-R142 VanDerWaalsContact OD1-CZ 3.25Å; D95-R142 IonicContact OD1-NH1 3.48Å; D95-R142 PolarHBondContact OD1-NH1 2.89Å; D95-R142 IonicContact OD1-NH2 2.83Å; D95-R142 PolarHBondContact OD1-NH2 3.22Å; D95-R142 IonicContact OD2-NH2 3.08Å; G139-R142 WeakPolarHBondContact O-CB 3.47Å; G139-R142 WeakPolarHBondContact O-CG 3.5Å; G139-R142 PolarHBondContact O-NE 2.95Å; A140-R142 PolarHBondContact O-N 3.36Å; R142-Y363 HydrophobicContact CB-CE2 4.31Å; R142-Y363 WeakPolarHBondContact CB-OH 3.4Å; R142-Y363 HydrophobicContact CG-CE1 4.02Å; R142-Y363 HydrophobicContact CG-CE2 4.11Å; R142-Y363 VanDerWaalsContact CG-OH 3.23Å; R142-Y363 WeakPolarHBondContact CG-OH 3.32Å; R142-Y363 PolarHBondContact NH1-O 2.98Å; R142-Y363 PolarHBondContact O-OH 2.88Å; R142-L365 HydrophobicContact CB-CD1 3.74Å; R142-L365 HydrophobicContact CB-CG 4.33Å; R142-N430 WeakPolarHBondContact CA-OD1 3.37Å; R142-N430 HydrophobicContact CB-CB 4.39Å
143	R	88.7	Confident	94.5	Very high	69 Å²	69	18.4 Å²	18.4	26%	0.26	10%	0.104	S	C	.	.	G	3₁₀ helix	trans	-84.4	-15.1	178.6	-72.9	-167	-56.5	161.6	-1.5	113.3	A141 K223 P360 Y363	A141-R143 PolarHBondContact O-N 2.72Å; R143-K223 PolarHBondContact NH2-O 2.96Å; R143-P360 VanDerWaalsContact NE-CB 3.28Å; R143-P360 VanDerWaalsContact NH2-CB 3.34Å; R143-Y363 WeakPolarHBondContact CA-OH 3.32Å; R143-Y363 HydrophobicContact CG-CE1 3.46Å; R143-Y363 VanDerWaalsContact CG-CE1 3.46Å; R143-Y363 WeakPolarHBondContact CG-OH 3.45Å; R143-Y363 PolarHBondContact N-OH 3.37Å
144	M	91.5	Very high	94.2	Very high	12 Å²	12	20.6 Å²	20.6	6%	0.059	12%	0.122	C	C	.	.	S	Bend	trans	-70	139.3	175.2	-65.3	-53	91.8	0	0	109.3	A141 L217 M220 L322 K324	A141-M144 HydrophobicContact CB-CG 4.25Å; A141-M144 WeakPolarHBondContact O-CB 3.39Å; A141-M144 PolarHBondContact O-N 2.85Å; M144-L217 HydrophobicContact SD-CD1 4.45Å; M144-M220 HydrophobicContact CE-CB 3.56Å; M144-M220 HydrophobicContact CE-CG 4.22Å; M144-M220 WeakPolarHBondContact CE-O 3.42Å; M144-M220 HydrophobicContact CE-SD 4.44Å; M144-M220 HydrophobicContact SD-CB 3.78Å; M144-L322 HydrophobicContact CG-CD1 3.68Å; M144-L322 HydrophobicContact CG-CD2 4.07Å; M144-L322 HydrophobicContact CG-CG 4.46Å; M144-L322 HydrophobicContact SD-CD1 4.38Å; M144-K324 HydrophobicContact CB-CD 4Å; M144-K324 HydrophobicContact CB-CG 4.22Å; M144-K324 WeakPolarHBondContact O-CE 3.18Å
145	P	92	Very high	94	Very high	34 Å²	34	23.7 Å²	23.7	22%	0.221	13%	0.134	C	C	.	.			trans	-65.8	168.3	174.4	30.4	-35.8	0	0	0	111	L147 Y150 M220 K324	P145-L147 PolarHBondContact O-N 3.25Å; P145-L147 VanDerWaalsContact O-N 3.16Å; P145-Y150 HydrophobicContact CB-CD2 4.45Å; P145-Y150 HydrophobicContact CB-CG 4.45Å; P145-Y150 HydrophobicContact CG-CD2 3.92Å; P145-Y150 HydrophobicContact CG-CG 3.84Å; P145-M220 HydrophobicContact CG-SD 4.39Å; P145-K324 WeakPolarHBondContact O-CE 3.46Å
146	E	91.8	Very high	93.9	Very high	14 Å²	14	26 Å²	26	7%	0.065	15%	0.149	C	C	.	.			trans	-65.4	114.6	163.3	-161.5	-72.8	139.5	0	0	108.1	L148 S149 Y150	E146-L148 PolarHBondContact O-N 3.32Å; E146-L148 PolarHBondContact OE2-N 3.09Å; E146-S149 PolarHBondContact O-N 3.18Å; E146-S149 WeakPolarHBondContact OE2-CB 3.43Å; E146-S149 PolarHBondContact OE2-N 2.88Å; E146-S149 PolarHBondContact OE2-OG 3Å; E146-Y150 WeakPolarHBondContact O-CB 3.44Å; E146-Y150 PolarHBondContact O-N 3.11Å
147	L	94.8	Very high	93.8	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-67	-39.5	-161.6	-66.9	174.5	0	0	0	112.7	P145 Y150 L151 L217 L253 K324 I452	P145-L147 PolarHBondContact O-N 3.25Å; P145-L147 VanDerWaalsContact O-N 3.16Å; L147-Y150 PolarHBondContact O-N 3.08Å; L147-L151 WeakPolarHBondContact O-CB 3.45Å; L147-L151 VanDerWaalsContact O-CG 3.22Å; L147-L151 WeakPolarHBondContact O-CG 3.17Å; L147-L151 PolarHBondContact O-N 2.93Å; L147-L217 HydrophobicContact CD2-CD1 4.1Å; L147-L253 HydrophobicContact CB-CD1 4.17Å; L147-L253 HydrophobicContact CD1-CD1 3.96Å; L147-L253 HydrophobicContact CD1-CG 4.48Å; L147-L253 HydrophobicContact CD2-CD1 4.24Å; L147-L253 HydrophobicContact CG-CD1 4.35Å; L147-K324 HydrophobicContact CD1-CB 3.98Å; L147-K324 HydrophobicContact CD1-CG 3.99Å; L147-K324 HydrophobicContact CG-CB 4.04Å; L147-K324 HydrophobicContact CG-CG 3.98Å; L147-I452 HydrophobicContact CD1-CD1 3.9Å; L147-I452 HydrophobicContact CD1-CG1 3.78Å; L147-I452 HydrophobicContact CD2-CD1 3.99Å
148	L	94.9	Very high	93.6	Very high	3 Å²	3	34.1 Å²	34.1	2%	0.016	19%	0.192	C	C	.	.	H	α-helix	trans	-66.5	-42.8	-179.8	-68.4	-174.6	0	0	0	111.9	E146 L151 S152 Y179 V180 V183 L197 V326 S450	E146-L148 PolarHBondContact O-N 3.32Å; E146-L148 PolarHBondContact OE2-N 3.09Å; L148-L151 PolarHBondContact O-N 2.83Å; L148-S152 VanDerWaalsContact O-CB 3.27Å; L148-S152 WeakPolarHBondContact O-CB 3.14Å; L148-S152 PolarHBondContact O-N 2.93Å; L148-Y179 HydrophobicContact CD1-CE1 4.39Å; L148-Y179 HydrophobicContact CD2-CE1 4.24Å; L148-V180 HydrophobicContact CB-CG2 4Å; L148-V183 HydrophobicContact CD1-CG1 4.13Å; L148-L197 HydrophobicContact CD2-CD2 3.88Å; L148-V326 HydrophobicContact CD1-CG1 4Å; L148-V326 HydrophobicContact CD1-CG2 3.85Å; L148-V326 HydrophobicContact CG-CG2 4.48Å; L148-S450 WeakPolarHBondContact CG-OG 3.38Å
149	S	92.4	Very high	93.5	Very high	30 Å²	30	37.7 Å²	37.7	21%	0.21	21%	0.212	C	C	.	.	H	α-helix	trans	-66.5	-41.1	178.1	-56.7	0	0	0	0	111.3	E146 S153	E146-S149 PolarHBondContact O-N 3.18Å; E146-S149 WeakPolarHBondContact OE2-CB 3.43Å; E146-S149 PolarHBondContact OE2-N 2.88Å; E146-S149 PolarHBondContact OE2-OG 3Å; S149-S153 PolarHBondContact O-N 2.71Å; S149-S153 PolarHBondContact O-OG 2.77Å
150	Y	94	Very high	93.6	Very high	44 Å²	44	37.2 Å²	37.2	17%	0.173	21%	0.208	C	C	.	.	H	α-helix	trans	-58.8	-55.4	173.4	172.9	-100.4	0	0	0	111.3	P145 E146 L147 S152 S153 A154 D214 S216 L217 M220	P145-Y150 HydrophobicContact CB-CD2 4.45Å; P145-Y150 HydrophobicContact CB-CG 4.45Å; P145-Y150 HydrophobicContact CG-CD2 3.92Å; P145-Y150 HydrophobicContact CG-CG 3.84Å; E146-Y150 WeakPolarHBondContact O-CB 3.44Å; E146-Y150 PolarHBondContact O-N 3.11Å; L147-Y150 PolarHBondContact O-N 3.08Å; Y150-S152 PolarHBondContact O-N 3.32Å; Y150-S153 WeakPolarHBondContact O-CB 3.39Å; Y150-S153 PolarHBondContact O-N 3.08Å; Y150-S153 VanDerWaalsContact O-N 3.08Å; Y150-A154 PolarHBondContact O-N 2.99Å; Y150-D214 WeakPolarHBondContact CE1-OD2 3.35Å; Y150-D214 PolarHBondContact OH-OD1 3.06Å; Y150-D214 PolarHBondContact OH-OD2 2.94Å; Y150-D214 VanDerWaalsContact OH-OD2 3.08Å; Y150-S216 WeakPolarHBondContact OH-CB 3.23Å; Y150-L217 HydrophobicContact CE1-CB 4.49Å; Y150-M220 HydrophobicContact CE2-CE 4.19Å
151	L	92.9	Very high	93.6	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-66.6	-36.4	-176.8	-64	178.9	0	0	0	112.7	L147 L148 S153 A154 Y155 L176 F212 L253	L147-L151 WeakPolarHBondContact O-CB 3.45Å; L147-L151 VanDerWaalsContact O-CG 3.22Å; L147-L151 WeakPolarHBondContact O-CG 3.17Å; L147-L151 PolarHBondContact O-N 2.93Å; L148-L151 PolarHBondContact O-N 2.83Å; L151-S153 PolarHBondContact O-N 3.04Å; L151-A154 PolarHBondContact O-N 3.04Å; L151-Y155 HydrophobicContact CD2-CD2 4.12Å; L151-Y155 HydrophobicContact CD2-CE2 4.23Å; L151-Y155 CarbonylContact O-C 3.5Å; L151-Y155 WeakPolarHBondContact O-CA 3.49Å; L151-Y155 PolarHBondContact O-N 2.8Å; L151-L176 HydrophobicContact CB-CD2 3.54Å; L151-L176 WeakPolarHBondContact O-CD2 3.42Å; L151-F212 HydrophobicContact CD1-CZ 4.14Å; L151-F212 HydrophobicContact CD2-CE1 4.19Å; L151-F212 HydrophobicContact CD2-CE2 3.66Å; L151-F212 HydrophobicContact CD2-CZ 3.29Å; L151-F212 HydrophobicContact CG-CZ 4.34Å; L151-L253 HydrophobicContact CD1-CD1 3.69Å; L151-L253 HydrophobicContact CD1-CD2 3.54Å; L151-L253 HydrophobicContact CD1-CG 4.27Å; L151-L253 HydrophobicContact CG-CD1 4.44Å
152	S	93.7	Very high	93.7	Very high	26 Å²	26	37.8 Å²	37.8	18%	0.182	21%	0.211	C	C	.	.	H	α-helix	trans	-62.9	-28.5	174.6	-177.7	0	0	0	0	112.6	L148 Y150 P156	L148-S152 VanDerWaalsContact O-CB 3.27Å; L148-S152 WeakPolarHBondContact O-CB 3.14Å; L148-S152 PolarHBondContact O-N 2.93Å; Y150-S152 PolarHBondContact O-N 3.32Å; S152-P156 WeakPolarHBondContact O-CA 3.32Å; S152-P156 WeakPolarHBondContact O-CB 3.4Å
153	S	92.6	Very high	94	Very high	99 Å²	99	37.6 Å²	37.6	69%	0.692	21%	0.212	S	C	*	.	H	α-helix	trans	-82.3	-41.9	177.9	-55	0	0	0	0	111.2	S149 Y150 L151	S149-S153 PolarHBondContact O-N 2.71Å; S149-S153 PolarHBondContact O-OG 2.77Å; Y150-S153 WeakPolarHBondContact O-CB 3.39Å; Y150-S153 PolarHBondContact O-N 3.08Å; Y150-S153 VanDerWaalsContact O-N 3.08Å; L151-S153 PolarHBondContact O-N 3.04Å
154	A	93.2	Very high	94.1	Very high	46 Å²	46	35.6 Å²	35.6	38%	0.38	21%	0.207	S	C	.	.	H	α-helix	trans	-76.1	-40.4	-178.3	0	0	0	0	0	113.2	Y150 L151	Y150-A154 PolarHBondContact O-N 2.99Å; L151-A154 PolarHBondContact O-N 3.04Å
155	Y	94.9	Very high	94.1	Very high	65 Å²	65	35.6 Å²	35.6	26%	0.255	21%	0.208	S	C	.	.			trans	-133.4	57.5	-174.2	-46.9	-79.7	0	0	0	112.5	L151 N157 L158 F212 D214	L151-Y155 HydrophobicContact CD2-CD2 4.12Å; L151-Y155 HydrophobicContact CD2-CE2 4.23Å; L151-Y155 CarbonylContact O-C 3.5Å; L151-Y155 WeakPolarHBondContact O-CA 3.49Å; L151-Y155 PolarHBondContact O-N 2.8Å; Y155-N157 PolarHBondContact O-N 3.42Å; Y155-N157 VanDerWaalsContact O-N 3.08Å; Y155-L158 WeakPolarHBondContact O-CB 3.34Å; Y155-L158 PolarHBondContact O-N 3.27Å; Y155-L158 VanDerWaalsContact O-N 3.09Å; Y155-F212 AromaticContact CD2-CD2 3.97Å; Y155-F212 HydrophobicContact CD2-CD2 3.97Å; Y155-F212 HydrophobicContact CD2-CE2 4.1Å; Y155-F212 HydrophobicContact CD2-CG 4.26Å; Y155-F212 HydrophobicContact CE1-CB 4.38Å; Y155-F212 HydrophobicContact CE1-CD2 4.3Å; Y155-F212 AromaticContact CE2-CD2 3.45Å; Y155-F212 HydrophobicContact CE2-CD2 3.45Å; Y155-F212 VanDerWaalsContact CE2-CD2 3.45Å; Y155-F212 AromaticContact CE2-CE2 3.62Å; Y155-F212 HydrophobicContact CE2-CE2 3.62Å; Y155-F212 HydrophobicContact CE2-CG 4.14Å; Y155-F212 HydrophobicContact CE2-CZ 4.44Å; Y155-F212 AromaticContact CZ-CD2 3.64Å; Y155-D214 WeakPolarHBondContact CE2-OD2 3.38Å; Y155-D214 VanDerWaalsContact OH-CG 3.23Å; Y155-D214 PolarHBondContact OH-OD2 2.91Å
156	P	95.7	Very high	93.9	Very high	47 Å²	47	39 Å²	39	31%	0.305	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-29.1	-173.5	22.7	-34.4	0	0	0	114.2	S152 S177	S152-P156 WeakPolarHBondContact O-CA 3.32Å; S152-P156 WeakPolarHBondContact O-CB 3.4Å; P156-S177 VanDerWaalsContact O-CB 3.27Å; P156-S177 WeakPolarHBondContact O-CB 3.36Å; P156-S177 PolarHBondContact O-N 3.07Å; P156-S177 PolarHBondContact O-OG 3.02Å
157	N	96.8	Very high	93.7	Very high	134 Å²	134	44 Å²	44	72%	0.717	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.1	2.1	-175.9	-61	-32.2	0	0	0	113.4	Y155 N159	Y155-N157 PolarHBondContact O-N 3.42Å; Y155-N157 VanDerWaalsContact O-N 3.08Å; N157-N159 PolarHBondContact O-N 3.27Å
158	L	95	Very high	93.1	Very high	37 Å²	37	49.9 Å²	49.9	19%	0.194	27%	0.27	C	S	.	.			trans	-61.1	127.1	176.9	-179.8	68.4	0	0	0	109.7	Y155 V160 S175 L176 L200 F212	Y155-L158 WeakPolarHBondContact O-CB 3.34Å; Y155-L158 PolarHBondContact O-N 3.27Å; Y155-L158 VanDerWaalsContact O-N 3.09Å; L158-V160 HydrophobicContact CD2-CG1 4.13Å; L158-V160 HydrophobicContact CG-CG1 4.15Å; L158-V160 PolarHBondContact O-N 3.33Å; L158-S175 CarbonylContact O-C 3.55Å; L158-S175 WeakPolarHBondContact O-CA 3.23Å; L158-L176 HydrophobicContact CB-CB 4.27Å; L158-L176 HydrophobicContact CD2-CD2 4.45Å; L158-L176 PolarHBondContact O-N 3.08Å; L158-L200 HydrophobicContact CD2-CD1 4.05Å; L158-F212 HydrophobicContact CD2-CD1 3.45Å; L158-F212 VanDerWaalsContact CD2-CD1 3.45Å; L158-F212 HydrophobicContact CD2-CE1 3.81Å; L158-F212 HydrophobicContact CD2-CG 4.49Å
159	N	94.8	Very high	92.7	Very high	101 Å²	101	57.6 Å²	57.6	54%	0.54	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	117.7	175.4	-73.1	-26.3	0	0	0	109.5	N157 T173 R210	N157-N159 PolarHBondContact O-N 3.27Å; N159-T173 HydrophobicContact CB-CG2 4.09Å; N159-R210 WeakPolarHBondContact O-CD 3.24Å; N159-R210 PolarHBondContact O-NH1 3.3Å
160	V	96.2	Very high	92.6	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	152.3	-179.1	-61.9	0	0	0	0	111.3	L158 T173 L174 L176 Y179 L197 L200 R210	L158-V160 HydrophobicContact CD2-CG1 4.13Å; L158-V160 HydrophobicContact CG-CG1 4.15Å; L158-V160 PolarHBondContact O-N 3.33Å; V160-T173 WeakPolarHBondContact O-CA 3.41Å; V160-L174 HydrophobicContact CG2-CD2 4.36Å; V160-L174 HydrophobicContact CG2-CG 4.42Å; V160-L174 WeakPolarHBondContact CG2-O 3.45Å; V160-L174 PolarHBondContact N-O 2.97Å; V160-L174 PolarHBondContact O-N 2.81Å; V160-L174 VanDerWaalsContact O-N 3.15Å; V160-L176 HydrophobicContact CG1-CB 4.02Å; V160-L176 HydrophobicContact CG1-CD1 4.11Å; V160-L176 HydrophobicContact CG2-CD1 4.46Å; V160-Y179 HydrophobicContact CG2-CG 4.28Å; V160-L197 HydrophobicContact CB-CD1 3.59Å; V160-L197 HydrophobicContact CG1-CD1 3.94Å; V160-L197 HydrophobicContact CG2-CD1 3.93Å; V160-L200 HydrophobicContact CG1-CD1 3.97Å; V160-L200 HydrophobicContact CG1-CD2 4.08Å; V160-R210 PolarHBondContact O-NH1 2.91Å
161	S	95.7	Very high	92.5	Very high	15 Å²	15	60 Å²	60	11%	0.105	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	141.8	176.9	-62.5	0	0	0	0	110.5	E172 H198 R210	S161-E172 WeakPolarHBondContact CA-O 3.3Å; S161-H198 WeakPolarHBondContact CB-ND1 3.47Å; S161-H198 PolarHBondContact O-N 3.42Å; S161-R210 PolarHBondContact OG-NE 3.1Å; S161-R210 PolarHBondContact OG-NH1 2.96Å; S161-R210 VanDerWaalsContact OG-NH1 3.09Å; S161-R210 PolarHBondContact OG-NH2 3.25Å
162	T	97	Very high	92.6	Very high	0 Å²	0	64.5 Å²	64.5	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	175.4	172.4	-175.8	0	0	0	0	108.5	T171 E172 L174 F194 G195 P196	T162-T171 WeakPolarHBondContact O-CA 3.39Å; T162-E172 HydrophobicContact CG2-CB 3.95Å; T162-E172 PolarHBondContact N-O 3.45Å; T162-E172 PolarHBondContact O-N 2.85Å; T162-L174 HydrophobicContact CG2-CD2 3.38Å; T162-F194 HydrophobicContact CG2-CE1 4.23Å; T162-F194 HydrophobicContact CG2-CZ 4.41Å; T162-G195 VanDerWaalsContact OG1-CA 3.32Å; T162-G195 WeakPolarHBondContact OG1-CA 3.46Å; T162-P196 WeakPolarHBondContact CA-O 3.26Å; T162-P196 VanDerWaalsContact CB-O 3.31Å; T162-P196 WeakPolarHBondContact CB-O 3.04Å; T162-P196 PolarHBondContact OG1-O 2.79Å
163	N	95	Very high	92.7	Very high	14 Å²	14	66.9 Å²	66.9	8%	0.075	37%	0.367	C	S	.	.			trans	-138.4	151.2	168.7	62.1	-87	0	0	0	110.3	A170 G195 P196 H198	N163-A170 WeakPolarHBondContact CB-O 3.29Å; N163-G195 WeakPolarHBondContact O-CA 3.35Å; N163-P196 VanDerWaalsContact OD1-CG 3.28Å; N163-P196 WeakPolarHBondContact OD1-CG 3.4Å; N163-H198 PolarHBondContact OD1-NE2 3.1Å
164	P	91.9	Very high	92.9	Very high	26 Å²	26	63.5 Å²	63.5	17%	0.169	34%	0.341	C	S	.	.			trans	-54.1	147.4	169.4	-23.5	33.3	0	0	0	111.3	E166 Q167 A170 E172	P164-E166 VanDerWaalsContact C-N 3.25Å; P164-E166 PolarHBondContact O-N 3.04Å; P164-Q167 HydrophobicContact CB-CB 4.21Å; P164-Q167 HydrophobicContact CG-CB 4.47Å; P164-Q167 CarbonylContact O-C 3.58Å; P164-Q167 PolarHBondContact O-N 2.86Å; P164-Q167 VanDerWaalsContact O-N 3.16Å; P164-A170 HydrophobicContact CG-CB 4.42Å; P164-E172 WeakPolarHBondContact CG-OE1 3.42Å
165	L	91.1	Very high	93.1	Very high	12 Å²	12	62.9 Å²	62.9	6%	0.063	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-35.8	-175.4	-71.6	-175.2	0	0	0	112.8	F194 H257 I262 I297	L165-F194 VanDerWaalsContact CD2-O 3.29Å; L165-F194 WeakPolarHBondContact CD2-O 3.45Å; L165-H257 WeakPolarHBondContact CD2-CD2 3.31Å; L165-H257 VanDerWaalsContact CD2-NE2 3.34Å; L165-H257 WeakPolarHBondContact CD2-NE2 3.44Å; L165-I262 HydrophobicContact CB-CD1 3.67Å; L165-I262 HydrophobicContact CD1-CD1 3.63Å; L165-I262 HydrophobicContact CG-CD1 4.29Å; L165-I297 HydrophobicContact CB-CG2 4.38Å
166	E	86.7	Confident	93.2	Very high	106 Å²	106	59.8 Å²	59.8	50%	0.495	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-15.5	-178.2	-54.2	84.9	174.8	0	0	112.8	P164 I262 I295 I297	P164-E166 VanDerWaalsContact C-N 3.25Å; P164-E166 PolarHBondContact O-N 3.04Å; E166-I262 HydrophobicContact CG-CD1 4.5Å; E166-I262 WeakPolarHBondContact OE1-CD1 3.31Å; E166-I295 HydrophobicContact CB-CD1 4.29Å; E166-I295 HydrophobicContact CG-CD1 3.61Å; E166-I297 HydrophobicContact CG-CD1 4.46Å
167	Q	87.5	Confident	93.3	Very high	119 Å²	119	59.6 Å²	59.6	56%	0.556	32%	0.321	S	S	*	.			trans	-127.9	85.8	-173.2	-61.2	-179.8	4.5	0	0	110.7	P164 N169 A170	P164-Q167 HydrophobicContact CB-CB 4.21Å; P164-Q167 HydrophobicContact CG-CB 4.47Å; P164-Q167 CarbonylContact O-C 3.58Å; P164-Q167 PolarHBondContact O-N 2.86Å; P164-Q167 VanDerWaalsContact O-N 3.16Å; Q167-N169 PolarHBondContact O-N 3.25Å; Q167-A170 HydrophobicContact CB-CB 3.98Å; Q167-A170 PolarHBondContact O-N 2.99Å
168	K	83.9	Confident	93.3	Very high	123 Å²	123	56.7 Å²	56.7	54%	0.535	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-25.9	-179	-66.2	-173.5	175.8	-172.9	0	114.2	H298	K168-H298 PolarHBondContact NZ-O 2.89Å
169	N	85.3	Confident	93.4	Very high	166 Å²	166	55 Å²	55	89%	0.888	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	-5.8	-177.2	-60.1	-10.3	0	0	0	113.2	Q167	Q167-N169 PolarHBondContact O-N 3.25Å
170	A	91.2	Very high	93.5	Very high	29 Å²	29	50.3 Å²	50.3	24%	0.24	27%	0.27	C	S	.	.			trans	-81.6	154.3	172.6	0	0	0	0	0	109.5	N163 P164 Q167	N163-A170 WeakPolarHBondContact CB-O 3.29Å; P164-A170 HydrophobicContact CG-CB 4.42Å; Q167-A170 HydrophobicContact CB-CB 3.98Å; Q167-A170 PolarHBondContact O-N 2.99Å
171	T	92	Very high	93.5	Very high	96 Å²	96	56.4 Å²	56.4	59%	0.589	30%	0.296	S	S	*	.			trans	-132.8	130.6	171.4	-64.1	0	0	0	0	108.8	T162	T162-T171 WeakPolarHBondContact O-CA 3.39Å
172	E	94.4	Very high	93.5	Very high	93 Å²	93	57.4 Å²	57.4	44%	0.435	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	140.7	174.8	-65.7	-179.7	171.9	0	0	108.7	S161 T162 P164	S161-E172 WeakPolarHBondContact CA-O 3.3Å; T162-E172 HydrophobicContact CG2-CB 3.95Å; T162-E172 PolarHBondContact N-O 3.45Å; T162-E172 PolarHBondContact O-N 2.85Å; P164-E172 WeakPolarHBondContact CG-OE1 3.42Å
173	T	96.2	Very high	93.5	Very high	76 Å²	76	57.5 Å²	57.5	47%	0.466	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	133.4	174.8	-66.4	0	0	0	0	110.1	N159 V160 R210	N159-T173 HydrophobicContact CB-CG2 4.09Å; V160-T173 WeakPolarHBondContact O-CA 3.41Å; T173-R210 VanDerWaalsContact CG2-NH1 3.28Å; T173-R210 PolarHBondContact OG1-NH1 3.02Å; T173-R210 PolarHBondContact OG1-NH2 2.87Å
174	L	97.4	Very high	93.5	Very high	29 Å²	29	60.2 Å²	60.2	15%	0.152	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	166.9	178.5	64.6	167.8	0	0	0	110	V160 T162 Q178 Y179 F194	V160-L174 HydrophobicContact CG2-CD2 4.36Å; V160-L174 HydrophobicContact CG2-CG 4.42Å; V160-L174 WeakPolarHBondContact CG2-O 3.45Å; V160-L174 PolarHBondContact N-O 2.97Å; V160-L174 PolarHBondContact O-N 2.81Å; V160-L174 VanDerWaalsContact O-N 3.15Å; T162-L174 HydrophobicContact CG2-CD2 3.38Å; L174-Q178 HydrophobicContact CD1-CB 4.16Å; L174-Q178 HydrophobicContact CD1-CG 3.98Å; L174-Y179 HydrophobicContact CD2-CD2 4.47Å; L174-F194 HydrophobicContact CD1-CE1 4.33Å; L174-F194 HydrophobicContact CD1-CZ 4.32Å
175	S	97.3	Very high	93.6	Very high	33 Å²	33	67.4 Å²	67.4	23%	0.231	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	149.4	171.4	68.8	0	0	0	0	110.9	L158 S177 Q178 Y179	L158-S175 CarbonylContact O-C 3.55Å; L158-S175 WeakPolarHBondContact O-CA 3.23Å; S175-S177 VanDerWaalsContact C-N 3.28Å; S175-S177 PolarHBondContact O-N 3.07Å; S175-S177 PolarHBondContact OG-OG 2.69Å; S175-S177 VanDerWaalsContact OG-OG 3.07Å; S175-Q178 PolarHBondContact O-N 2.93Å; S175-Q178 VanDerWaalsContact OG-CB 3.31Å; S175-Q178 WeakPolarHBondContact OG-CB 3.39Å; S175-Q178 PolarHBondContact OG-N 2.83Å; S175-Y179 PolarHBondContact O-N 3.01Å
176	L	96.7	Very high	93.7	Very high	0 Å²	0	68.8 Å²	68.8	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-59.8	-39	178.4	-179.8	56.5	0	0	0	112.4	L151 L158 V160 Q178 Y179 V180	L151-L176 HydrophobicContact CB-CD2 3.54Å; L151-L176 WeakPolarHBondContact O-CD2 3.42Å; L158-L176 HydrophobicContact CB-CB 4.27Å; L158-L176 HydrophobicContact CD2-CD2 4.45Å; L158-L176 PolarHBondContact O-N 3.08Å; V160-L176 HydrophobicContact CG1-CB 4.02Å; V160-L176 HydrophobicContact CG1-CD1 4.11Å; V160-L176 HydrophobicContact CG2-CD1 4.46Å; L176-Q178 VanDerWaalsContact C-N 3.3Å; L176-Q178 PolarHBondContact O-N 3.45Å; L176-Y179 HydrophobicContact CD1-CD1 4.3Å; L176-Y179 WeakPolarHBondContact O-CB 3.18Å; L176-Y179 PolarHBondContact O-N 2.78Å; L176-V180 HydrophobicContact CD1-CG2 4Å; L176-V180 HydrophobicContact CG-CG2 4.47Å; L176-V180 WeakPolarHBondContact O-CG2 3.49Å; L176-V180 PolarHBondContact O-N 2.85Å
177	S	96.4	Very high	94.2	Very high	42 Å²	42	66 Å²	66	29%	0.294	34%	0.336	S	S	.	.	H	α-helix	trans	-58.4	-41.1	173.6	51.8	0	0	0	0	112.6	P156 S175 K181	P156-S177 VanDerWaalsContact O-CB 3.27Å; P156-S177 WeakPolarHBondContact O-CB 3.36Å; P156-S177 PolarHBondContact O-N 3.07Å; P156-S177 PolarHBondContact O-OG 3.02Å; S175-S177 VanDerWaalsContact C-N 3.28Å; S175-S177 PolarHBondContact O-N 3.07Å; S175-S177 PolarHBondContact OG-OG 2.69Å; S175-S177 VanDerWaalsContact OG-OG 3.07Å; S177-K181 VanDerWaalsContact O-CB 3.31Å; S177-K181 WeakPolarHBondContact O-CB 3.29Å; S177-K181 PolarHBondContact O-N 3.48Å
178	Q	97.3	Very high	94.4	Very high	74 Å²	74	63.1 Å²	63.1	35%	0.346	33%	0.332	S	S	.	.	H	α-helix	trans	-70.9	-38.2	176.7	-174.8	56.5	51.3	0	0	111.7	L174 S175 L176 K181 N182	L174-Q178 HydrophobicContact CD1-CB 4.16Å; L174-Q178 HydrophobicContact CD1-CG 3.98Å; S175-Q178 PolarHBondContact O-N 2.93Å; S175-Q178 VanDerWaalsContact OG-CB 3.31Å; S175-Q178 WeakPolarHBondContact OG-CB 3.39Å; S175-Q178 PolarHBondContact OG-N 2.83Å; L176-Q178 VanDerWaalsContact C-N 3.3Å; L176-Q178 PolarHBondContact O-N 3.45Å; Q178-K181 PolarHBondContact O-N 3.03Å; Q178-N182 PolarHBondContact NE2-OD1 3.14Å; Q178-N182 VanDerWaalsContact O-CG 3.31Å; Q178-N182 PolarHBondContact O-N 3.1Å; Q178-N182 PolarHBondContact O-ND2 2.87Å
179	Y	97.5	Very high	94.8	Very high	0 Å²	0	65.3 Å²	65.3	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-58.2	-53.6	173.4	176.9	-91.4	0	0	0	110.9	L148 V160 L174 S175 L176 K181 N182 V183 Y192 F194 G195 L197	L148-Y179 HydrophobicContact CD1-CE1 4.39Å; L148-Y179 HydrophobicContact CD2-CE1 4.24Å; V160-Y179 HydrophobicContact CG2-CG 4.28Å; L174-Y179 HydrophobicContact CD2-CD2 4.47Å; S175-Y179 PolarHBondContact O-N 3.01Å; L176-Y179 HydrophobicContact CD1-CD1 4.3Å; L176-Y179 WeakPolarHBondContact O-CB 3.18Å; L176-Y179 PolarHBondContact O-N 2.78Å; Y179-K181 VanDerWaalsContact C-N 3.34Å; Y179-K181 PolarHBondContact O-N 3.5Å; Y179-N182 WeakPolarHBondContact O-CB 3.32Å; Y179-N182 PolarHBondContact O-N 3.42Å; Y179-N182 VanDerWaalsContact O-N 3.08Å; Y179-V183 HydrophobicContact CD1-CG2 4.1Å; Y179-V183 HydrophobicContact CE1-CG2 3.54Å; Y179-V183 HydrophobicContact CE2-CG2 4.39Å; Y179-V183 PolarHBondContact O-N 3.31Å; Y179-Y192 PolarHBondContact OH-OH 2.9Å; Y179-F194 HydrophobicContact CD2-CD1 4.05Å; Y179-F194 AromaticContact CD2-CE1 3.73Å; Y179-F194 HydrophobicContact CD2-CE1 3.73Å; Y179-F194 AromaticContact CE2-CD1 3.86Å; Y179-F194 HydrophobicContact CE2-CD1 3.86Å; Y179-F194 AromaticContact CE2-CE1 3.93Å; Y179-F194 HydrophobicContact CE2-CE1 3.93Å; Y179-G195 WeakPolarHBondContact CE2-O 3.43Å; Y179-G195 PolarHBondContact OH-O 2.93Å; Y179-L197 HydrophobicContact CD1-CD1 4.47Å; Y179-L197 HydrophobicContact CE1-CB 3.79Å; Y179-L197 HydrophobicContact CE1-CD1 4.46Å; Y179-L197 HydrophobicContact CE1-CD2 4.5Å; Y179-L197 HydrophobicContact CE1-CG 4.48Å; Y179-L197 HydrophobicContact CE2-CB 4.24Å; Y179-L197 PolarHBondContact OH-N 3.31Å
180	V	96.6	Very high	95.2	Very high	4 Å²	4	57.5 Å²	57.5	2%	0.024	31%	0.308	C	S	.	.	H	α-helix	trans	-62.4	-41.6	-179.6	173.3	0	0	0	0	110.9	L148 L176 N182 V183 Q184	L148-V180 HydrophobicContact CB-CG2 4Å; L176-V180 HydrophobicContact CD1-CG2 4Å; L176-V180 HydrophobicContact CG-CG2 4.47Å; L176-V180 WeakPolarHBondContact O-CG2 3.49Å; L176-V180 PolarHBondContact O-N 2.85Å; V180-N182 VanDerWaalsContact C-N 3.29Å; V180-N182 PolarHBondContact O-N 2.88Å; V180-V183 WeakPolarHBondContact O-CB 3.48Å; V180-V183 PolarHBondContact O-N 2.77Å; V180-V183 VanDerWaalsContact O-N 3.16Å; V180-Q184 HydrophobicContact CG1-CG 4.06Å; V180-Q184 WeakPolarHBondContact O-CB 3.4Å; V180-Q184 WeakPolarHBondContact O-CG 3.34Å; V180-Q184 PolarHBondContact O-N 3.42Å
181	K	96.1	Very high	95.4	Very high	128 Å²	128	58.2 Å²	58.2	56%	0.557	31%	0.307	S	S	*	.	H	α-helix	trans	-57.2	-40.3	173.6	-174.8	177.3	-179.7	178.9	0	112.9	S177 Q178 Y179 K185	S177-K181 VanDerWaalsContact O-CB 3.31Å; S177-K181 WeakPolarHBondContact O-CB 3.29Å; S177-K181 PolarHBondContact O-N 3.48Å; Q178-K181 PolarHBondContact O-N 3.03Å; Y179-K181 VanDerWaalsContact C-N 3.34Å; Y179-K181 PolarHBondContact O-N 3.5Å; K181-K185 VanDerWaalsContact O-CB 3.26Å; K181-K185 WeakPolarHBondContact O-CB 3.28Å; K181-K185 PolarHBondContact O-N 2.73Å
182	N	96.1	Very high	95.6	Very high	35 Å²	35	53.6 Å²	53.6	19%	0.187	28%	0.279	C	S	.	.	H	α-helix	trans	-68.8	-40.8	176.6	-71.8	-21.5	0	0	0	112.1	Q178 Y179 V180 K185 T186 F194	Q178-N182 PolarHBondContact NE2-OD1 3.14Å; Q178-N182 VanDerWaalsContact O-CG 3.31Å; Q178-N182 PolarHBondContact O-N 3.1Å; Q178-N182 PolarHBondContact O-ND2 2.87Å; Y179-N182 WeakPolarHBondContact O-CB 3.32Å; Y179-N182 PolarHBondContact O-N 3.42Å; Y179-N182 VanDerWaalsContact O-N 3.08Å; V180-N182 VanDerWaalsContact C-N 3.29Å; V180-N182 PolarHBondContact O-N 2.88Å; N182-K185 PolarHBondContact O-N 3.04Å; N182-T186 WeakPolarHBondContact O-CB 3.42Å; N182-T186 WeakPolarHBondContact O-CG2 3.36Å; N182-T186 PolarHBondContact O-N 3.32Å; N182-T186 PolarHBondContact O-OG1 2.79Å; N182-F194 HydrophobicContact CB-CD1 3.81Å; N182-F194 HydrophobicContact CB-CD2 3.92Å; N182-F194 HydrophobicContact CB-CE1 3.87Å; N182-F194 HydrophobicContact CB-CE2 3.99Å; N182-F194 HydrophobicContact CB-CG 3.85Å; N182-F194 HydrophobicContact CB-CZ 3.97Å; N182-F194 VanDerWaalsContact ND2-CZ 3.31Å; N182-F194 WeakPolarHBondContact ND2-CZ 3.24Å
183	V	96.4	Very high	95.6	Very high	2 Å²	2	55.4 Å²	55.4	1%	0.012	28%	0.282	C	S	.	.	H	α-helix	trans	-58.7	-53	172.2	169.5	0	0	0	0	110.3	L148 Y179 V180 K185 T186 Y187 Y192 F194 V326	L148-V183 HydrophobicContact CD1-CG1 4.13Å; Y179-V183 HydrophobicContact CD1-CG2 4.1Å; Y179-V183 HydrophobicContact CE1-CG2 3.54Å; Y179-V183 HydrophobicContact CE2-CG2 4.39Å; Y179-V183 PolarHBondContact O-N 3.31Å; V180-V183 WeakPolarHBondContact O-CB 3.48Å; V180-V183 PolarHBondContact O-N 2.77Å; V180-V183 VanDerWaalsContact O-N 3.16Å; V183-K185 VanDerWaalsContact C-N 3.34Å; V183-K185 PolarHBondContact O-N 3.12Å; V183-T186 CarbonylContact O-C 3.49Å; V183-T186 PolarHBondContact O-N 3.12Å; V183-T186 VanDerWaalsContact O-N 3.13Å; V183-T186 PolarHBondContact O-OG1 2.86Å; V183-Y187 VanDerWaalsContact O-CB 3.32Å; V183-Y187 WeakPolarHBondContact O-CB 3.31Å; V183-Y187 PolarHBondContact O-N 2.84Å; V183-Y192 HydrophobicContact CB-CD2 4.47Å; V183-Y192 HydrophobicContact CB-CG 4.4Å; V183-Y192 HydrophobicContact CG1-CD1 3.66Å; V183-Y192 HydrophobicContact CG1-CD2 4.27Å; V183-Y192 HydrophobicContact CG1-CE1 4.09Å; V183-Y192 HydrophobicContact CG1-CG 3.77Å; V183-Y192 HydrophobicContact CG2-CD2 3.92Å; V183-Y192 HydrophobicContact CG2-CE1 4.49Å; V183-Y192 HydrophobicContact CG2-CE2 3.85Å; V183-Y192 HydrophobicContact CG2-CG 4.28Å; V183-F194 HydrophobicContact CG2-CD1 4.49Å; V183-V326 HydrophobicContact CG1-CG1 4.01Å
184	Q	94.5	Very high	95.6	Very high	71 Å²	71	53.7 Å²	53.7	33%	0.332	27%	0.268	S	S	.	.	H	α-helix	trans	-58.7	-43.7	-179.8	-64.8	179.4	-22	0	0	111.9	V180 T186 P328	V180-Q184 HydrophobicContact CG1-CG 4.06Å; V180-Q184 WeakPolarHBondContact O-CB 3.4Å; V180-Q184 WeakPolarHBondContact O-CG 3.34Å; V180-Q184 PolarHBondContact O-N 3.42Å; Q184-T186 VanDerWaalsContact C-N 3.26Å; Q184-T186 PolarHBondContact O-N 2.77Å; Q184-P328 HydrophobicContact CB-CB 4.11Å; Q184-P328 HydrophobicContact CG-CB 3.8Å; Q184-P328 HydrophobicContact CG-CG 4.31Å
185	K	94.6	Very high	95.5	Very high	177 Å²	177	52.4 Å²	52.4	77%	0.77	26%	0.262	S	S	*	.	H	α-helix	trans	-61.8	-32	178.5	180	-177.6	175.7	-172.6	0	113.1	K181 N182 V183	K181-K185 VanDerWaalsContact O-CB 3.26Å; K181-K185 WeakPolarHBondContact O-CB 3.28Å; K181-K185 PolarHBondContact O-N 2.73Å; N182-K185 PolarHBondContact O-N 3.04Å; V183-K185 VanDerWaalsContact C-N 3.34Å; V183-K185 PolarHBondContact O-N 3.12Å
186	T	94.4	Very high	95.5	Very high	41 Å²	41	51.2 Å²	51.2	25%	0.252	25%	0.253	S	S	.	.	H	α-helix	trans	-108.2	-0.8	-172.3	61.4	0	0	0	0	113.7	N182 V183 Q184 R193	N182-T186 WeakPolarHBondContact O-CB 3.42Å; N182-T186 WeakPolarHBondContact O-CG2 3.36Å; N182-T186 PolarHBondContact O-N 3.32Å; N182-T186 PolarHBondContact O-OG1 2.79Å; V183-T186 CarbonylContact O-C 3.49Å; V183-T186 PolarHBondContact O-N 3.12Å; V183-T186 VanDerWaalsContact O-N 3.13Å; V183-T186 PolarHBondContact O-OG1 2.86Å; Q184-T186 VanDerWaalsContact C-N 3.26Å; Q184-T186 PolarHBondContact O-N 2.77Å; T186-R193 HydrophobicContact CG2-CB 4.47Å; T186-R193 PolarHBondContact O-N 2.7Å; T186-R193 PolarHBondContact OG1-N 2.7Å
187	Y	95.2	Very high	95.5	Very high	49 Å²	49	51.3 Å²	51.3	19%	0.192	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	130	179.3	-179.2	-90.9	0	0	0	111.6	V183 G190 I191 V326 P328 R370 A448	V183-Y187 VanDerWaalsContact O-CB 3.32Å; V183-Y187 WeakPolarHBondContact O-CB 3.31Å; V183-Y187 PolarHBondContact O-N 2.84Å; Y187-G190 WeakPolarHBondContact OH-CA 3.41Å; Y187-G190 PolarHBondContact OH-N 3.45Å; Y187-I191 CarbonylContact C-O 3.51Å; Y187-I191 VanDerWaalsContact CA-O 3.28Å; Y187-I191 WeakPolarHBondContact CA-O 3.35Å; Y187-I191 WeakPolarHBondContact CD2-O 3.34Å; Y187-V326 HydrophobicContact CD2-CG1 4.31Å; Y187-V326 HydrophobicContact CE2-CG1 4.33Å; Y187-V326 VanDerWaalsContact CE2-O 3.31Å; Y187-V326 WeakPolarHBondContact CE2-O 3.45Å; Y187-V326 PolarHBondContact OH-O 2.89Å; Y187-V326 VanDerWaalsContact OH-O 3.1Å; Y187-P328 HydrophobicContact CD1-CG 3.85Å; Y187-P328 HydrophobicContact CD2-CG 3.81Å; Y187-P328 HydrophobicContact CE1-CG 4.43Å; Y187-P328 HydrophobicContact CE2-CG 4.39Å; Y187-P328 HydrophobicContact CG-CG 3.51Å; Y187-R370 PolarHBondContact OH-NH1 3.06Å; Y187-A448 HydrophobicContact CE2-CB 4.38Å
188	A	92.5	Very high	95.5	Very high	57 Å²	57	52.3 Å²	52.3	47%	0.471	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	127.8	173.7	0	0	0	0	0	109.8	G190 I191	A188-G190 VanDerWaalsContact C-N 3.25Å; A188-G190 PolarHBondContact O-N 3.11Å; A188-G190 VanDerWaalsContact O-N 3.11Å; A188-I191 PolarHBondContact N-O 2.84Å; A188-I191 WeakPolarHBondContact O-CG1 3.46Å; A188-I191 PolarHBondContact O-N 2.79Å
189	N	92.1	Very high	95.4	Very high	170 Å²	170	51.2 Å²	51.2	91%	0.909	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	50	39.5	170.2	-57.9	-25.5	0	0	0	115
190	G	94.1	Very high	95.3	Very high	1 Å²	1	51.2 Å²	51.2	1%	0.01	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	95.8	-1.5	173.9	0	0	0	0	0	115.6	Y187 A188 S447 A448	Y187-G190 WeakPolarHBondContact OH-CA 3.41Å; Y187-G190 PolarHBondContact OH-N 3.45Å; A188-G190 VanDerWaalsContact C-N 3.25Å; A188-G190 PolarHBondContact O-N 3.11Å; A188-G190 VanDerWaalsContact O-N 3.11Å; G190-S447 WeakPolarHBondContact O-CB 3.34Å; G190-A448 VanDerWaalsContact O-CB 3.26Å; G190-A448 WeakPolarHBondContact O-CB 3.42Å; G190-A448 PolarHBondContact O-N 3Å
191	I	96.1	Very high	95.3	Very high	44 Å²	44	51.3 Å²	51.3	23%	0.226	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	164.4	171	59.9	168.9	0	0	0	110.3	Y187 A188 H257 Q260	Y187-I191 CarbonylContact C-O 3.51Å; Y187-I191 VanDerWaalsContact CA-O 3.28Å; Y187-I191 WeakPolarHBondContact CA-O 3.35Å; Y187-I191 WeakPolarHBondContact CD2-O 3.34Å; A188-I191 PolarHBondContact N-O 2.84Å; A188-I191 WeakPolarHBondContact O-CG1 3.46Å; A188-I191 PolarHBondContact O-N 2.79Å; I191-H257 WeakPolarHBondContact CA-O 3.32Å; I191-H257 WeakPolarHBondContact CB-O 3.39Å; I191-Q260 HydrophobicContact CD1-CB 3.86Å
192	Y	95.9	Very high	95.2	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	147.8	168.4	58.6	-98.6	0	0	0	111.6	Y179 V183 F194 G195 S255 R256 H257 Q260 V326 A448	Y179-Y192 PolarHBondContact OH-OH 2.9Å; V183-Y192 HydrophobicContact CB-CD2 4.47Å; V183-Y192 HydrophobicContact CB-CG 4.4Å; V183-Y192 HydrophobicContact CG1-CD1 3.66Å; V183-Y192 HydrophobicContact CG1-CD2 4.27Å; V183-Y192 HydrophobicContact CG1-CE1 4.09Å; V183-Y192 HydrophobicContact CG1-CG 3.77Å; V183-Y192 HydrophobicContact CG2-CD2 3.92Å; V183-Y192 HydrophobicContact CG2-CE1 4.49Å; V183-Y192 HydrophobicContact CG2-CE2 3.85Å; V183-Y192 HydrophobicContact CG2-CG 4.28Å; Y192-F194 VanDerWaalsContact C-N 3.32Å; Y192-F194 HydrophobicContact CD2-CB 3.95Å; Y192-F194 VanDerWaalsContact CD2-O 3.29Å; Y192-F194 WeakPolarHBondContact CD2-O 3.37Å; Y192-F194 HydrophobicContact CE2-CB 4.42Å; Y192-F194 WeakPolarHBondContact CE2-O 3.33Å; Y192-F194 PolarHBondContact O-N 3.37Å; Y192-G195 WeakPolarHBondContact CE2-O 3.33Å; Y192-S255 PolarHBondContact OH-OG 3.23Å; Y192-R256 WeakPolarHBondContact CE1-O 3.35Å; Y192-R256 VanDerWaalsContact OH-C 3.27Å; Y192-R256 PolarHBondContact OH-O 3.22Å; Y192-H257 HydrophobicContact CD1-CB 4.46Å; Y192-H257 HydrophobicContact CD2-CB 3.8Å; Y192-H257 HydrophobicContact CE1-CB 4.2Å; Y192-H257 HydrophobicContact CE2-CB 3.5Å; Y192-H257 VanDerWaalsContact CE2-CB 3.5Å; Y192-H257 HydrophobicContact CG-CB 4.29Å; Y192-H257 VanDerWaalsContact CZ-CA 3.46Å; Y192-H257 PolarHBondContact OH-N 2.83Å; Y192-Q260 PolarHBondContact O-NE2 3.49Å; Y192-V326 HydrophobicContact CD1-CG1 4.44Å; Y192-V326 HydrophobicContact CE1-CG2 4.36Å; Y192-A448 HydrophobicContact CD1-CB 3.51Å; Y192-A448 HydrophobicContact CE1-CB 3.68Å
193	R	94.9	Very high	95.1	Very high	131 Å²	131	43.8 Å²	43.8	49%	0.494	22%	0.224	S	C	.	.	S	Bend	trans	-96.1	57.2	179.7	-60.7	-175.8	173.8	-135.4	-7	111.2	T186	T186-R193 HydrophobicContact CG2-CB 4.47Å; T186-R193 PolarHBondContact O-N 2.7Å; T186-R193 PolarHBondContact OG1-N 2.7Å
194	F	95.1	Very high	94.8	Very high	40 Å²	40	44.5 Å²	44.5	18%	0.175	23%	0.232	C	C	.	.	S	Bend	trans	-147.7	160.9	175.3	-161.5	-111.6	0	0	0	109.9	T162 L165 L174 Y179 N182 V183 Y192	T162-F194 HydrophobicContact CG2-CE1 4.23Å; T162-F194 HydrophobicContact CG2-CZ 4.41Å; L165-F194 VanDerWaalsContact CD2-O 3.29Å; L165-F194 WeakPolarHBondContact CD2-O 3.45Å; L174-F194 HydrophobicContact CD1-CE1 4.33Å; L174-F194 HydrophobicContact CD1-CZ 4.32Å; Y179-F194 HydrophobicContact CD2-CD1 4.05Å; Y179-F194 AromaticContact CD2-CE1 3.73Å; Y179-F194 HydrophobicContact CD2-CE1 3.73Å; Y179-F194 AromaticContact CE2-CD1 3.86Å; Y179-F194 HydrophobicContact CE2-CD1 3.86Å; Y179-F194 AromaticContact CE2-CE1 3.93Å; Y179-F194 HydrophobicContact CE2-CE1 3.93Å; N182-F194 HydrophobicContact CB-CD1 3.81Å; N182-F194 HydrophobicContact CB-CD2 3.92Å; N182-F194 HydrophobicContact CB-CE1 3.87Å; N182-F194 HydrophobicContact CB-CE2 3.99Å; N182-F194 HydrophobicContact CB-CG 3.85Å; N182-F194 HydrophobicContact CB-CZ 3.97Å; N182-F194 VanDerWaalsContact ND2-CZ 3.31Å; N182-F194 WeakPolarHBondContact ND2-CZ 3.24Å; V183-F194 HydrophobicContact CG2-CD1 4.49Å; Y192-F194 VanDerWaalsContact C-N 3.32Å; Y192-F194 HydrophobicContact CD2-CB 3.95Å; Y192-F194 VanDerWaalsContact CD2-O 3.29Å; Y192-F194 WeakPolarHBondContact CD2-O 3.37Å; Y192-F194 HydrophobicContact CE2-CB 4.42Å; Y192-F194 WeakPolarHBondContact CE2-O 3.33Å; Y192-F194 PolarHBondContact O-N 3.37Å
195	G	95.6	Very high	94.2	Very high	2 Å²	2	45.1 Å²	45.1	2%	0.021	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-57.7	159.1	-177	0	0	0	0	0	115.6	T162 N163 Y179 Y192	T162-G195 VanDerWaalsContact OG1-CA 3.32Å; T162-G195 WeakPolarHBondContact OG1-CA 3.46Å; N163-G195 WeakPolarHBondContact O-CA 3.35Å; Y179-G195 WeakPolarHBondContact CE2-O 3.43Å; Y179-G195 PolarHBondContact OH-O 2.93Å; Y192-G195 WeakPolarHBondContact CE2-O 3.33Å
196	P	97.3	Very high	93.4	Very high	8 Å²	8	40 Å²	40	5%	0.052	22%	0.218	C	C	.	.	P	Polyproline II helix	trans	-65.8	152.4	173.7	32	-36	0	0	0	110.8	T162 N163 S255	T162-P196 WeakPolarHBondContact CA-O 3.26Å; T162-P196 VanDerWaalsContact CB-O 3.31Å; T162-P196 WeakPolarHBondContact CB-O 3.04Å; T162-P196 PolarHBondContact OG1-O 2.79Å; N163-P196 VanDerWaalsContact OD1-CG 3.28Å; N163-P196 WeakPolarHBondContact OD1-CG 3.4Å; P196-S255 CarbonylContact C-O 3.52Å; P196-S255 VanDerWaalsContact CA-O 3.31Å; P196-S255 WeakPolarHBondContact CA-O 3.21Å; P196-S255 WeakPolarHBondContact CB-O 3.34Å
197	L	97.4	Very high	92.5	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.005	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	118.8	164.3	177.3	62	0	0	0	106.6	L148 V160 Y179 L200 L253 W254 S255	L148-L197 HydrophobicContact CD2-CD2 3.88Å; V160-L197 HydrophobicContact CB-CD1 3.59Å; V160-L197 HydrophobicContact CG1-CD1 3.94Å; V160-L197 HydrophobicContact CG2-CD1 3.93Å; Y179-L197 HydrophobicContact CD1-CD1 4.47Å; Y179-L197 HydrophobicContact CE1-CB 3.79Å; Y179-L197 HydrophobicContact CE1-CD1 4.46Å; Y179-L197 HydrophobicContact CE1-CD2 4.5Å; Y179-L197 HydrophobicContact CE1-CG 4.48Å; Y179-L197 HydrophobicContact CE2-CB 4.24Å; Y179-L197 PolarHBondContact OH-N 3.31Å; L197-L200 HydrophobicContact CD1-CD1 4.28Å; L197-L200 HydrophobicContact CD2-CD1 4.06Å; L197-L200 HydrophobicContact CG-CD1 4.42Å; L197-L253 HydrophobicContact CD2-CD2 4.09Å; L197-W254 WeakPolarHBondContact O-CB 3.29Å; L197-S255 PolarHBondContact N-O 3.28Å; L197-S255 PolarHBondContact O-N 2.79Å
198	H	95.7	Very high	91.6	Very high	63 Å²	63	49.2 Å²	49.2	29%	0.292	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	159.5	172.9	-64.8	-179.6	0	0	0	110.5	S161 N163 L200	S161-H198 WeakPolarHBondContact CB-ND1 3.47Å; S161-H198 PolarHBondContact O-N 3.42Å; N163-H198 PolarHBondContact OD1-NE2 3.1Å; H198-L200 PolarHBondContact O-N 3.26Å
199	A	95.2	Very high	91	Very high	51 Å²	51	51.7 Å²	51.7	42%	0.421	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	137.5	-173	0	0	0	0	0	112.9	I252 L253 W254	A199-I252 HydrophobicContact CB-CD1 4.22Å; A199-L253 CarbonylContact C-O 3.58Å; A199-L253 WeakPolarHBondContact CA-O 3.47Å; A199-W254 HydrophobicContact CB-CB 4.44Å
200	L	95.8	Very high	90.8	Very high	1 Å²	1	47.2 Å²	47.2	1%	0.005	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	124.2	174.8	-56.7	177.7	0	0	0	108.6	L158 V160 L197 H198 R210 F212 I252 L253	L158-L200 HydrophobicContact CD2-CD1 4.05Å; V160-L200 HydrophobicContact CG1-CD1 3.97Å; V160-L200 HydrophobicContact CG1-CD2 4.08Å; L197-L200 HydrophobicContact CD1-CD1 4.28Å; L197-L200 HydrophobicContact CD2-CD1 4.06Å; L197-L200 HydrophobicContact CG-CD1 4.42Å; H198-L200 PolarHBondContact O-N 3.26Å; L200-R210 CarbonylContact C-O 2.96Å; L200-R210 VanDerWaalsContact CA-O 3.29Å; L200-R210 WeakPolarHBondContact CA-O 3.2Å; L200-R210 HydrophobicContact CD2-CB 3.83Å; L200-F212 HydrophobicContact CB-CE1 4.11Å; L200-F212 HydrophobicContact CD1-CE1 4.03Å; L200-I252 CarbonylContact O-C 3.51Å; L200-I252 VanDerWaalsContact O-CA 3.31Å; L200-I252 WeakPolarHBondContact O-CA 3.25Å; L200-L253 PolarHBondContact N-O 3.43Å; L200-L253 PolarHBondContact O-N 3.18Å
201	S	96.1	Very high	90.5	Very high	5 Å²	5	47.6 Å²	47.6	4%	0.035	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	132.4	169.8	174.2	0	0	0	0	110.8	V203 G204 R210 G211 F212	S201-V203 VanDerWaalsContact OG-CG2 3.26Å; S201-V203 WeakPolarHBondContact OG-CG2 3.22Å; S201-V203 PolarHBondContact OG-N 3.48Å; S201-G204 WeakPolarHBondContact CB-O 3.47Å; S201-G204 PolarHBondContact OG-O 2.93Å; S201-R210 PolarHBondContact N-O 3.01Å; S201-G211 CarbonylContact O-C 3.51Å; S201-G211 WeakPolarHBondContact O-CA 3.4Å; S201-F212 PolarHBondContact O-N 2.94Å
202	I	94.5	Very high	90.3	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.25	C	S	.	.	S	Bend	trans	-91.6	-11.1	175.3	-68.7	161.8	0	0	0	111.6	F212 F213 D214 L217 I218 P251 L253 I452	I202-F212 CarbonylContact C-O 3.24Å; I202-F212 VanDerWaalsContact CA-O 3.3Å; I202-F212 WeakPolarHBondContact CA-O 3.46Å; I202-F212 HydrophobicContact CG1-CE2 4.28Å; I202-F212 HydrophobicContact CG1-CZ 4.12Å; I202-F213 WeakPolarHBondContact O-CA 3.37Å; I202-D214 HydrophobicContact CG2-CB 4.03Å; I202-D214 PolarHBondContact O-N 2.78Å; I202-D214 VanDerWaalsContact O-N 3.08Å; I202-L217 HydrophobicContact CD1-CD2 3.51Å; I202-L217 HydrophobicContact CG1-CD2 4.08Å; I202-L217 HydrophobicContact CG2-CB 4.49Å; I202-L217 HydrophobicContact CG2-CD2 4.15Å; I202-I218 HydrophobicContact CG2-CG1 4.19Å; I202-P251 PolarHBondContact N-O 2.74Å; I202-L253 HydrophobicContact CD1-CB 3.63Å; I202-L253 HydrophobicContact CD1-CD1 4.02Å; I202-L253 HydrophobicContact CG1-CB 4.12Å; I202-I452 HydrophobicContact CD1-CD1 4Å; I202-I452 HydrophobicContact CD1-CG1 4.14Å; I202-I452 HydrophobicContact CD1-CG2 3.99Å
203	V	94.5	Very high	90.2	Very high	6 Å²	6	49.3 Å²	49.3	4%	0.036	26%	0.263	C	S	.	.	B	Isolated β-bridge	trans	-97.6	5.5	-179.5	-69.3	0	0	0	0	113.2	S201 I218 W233 P244 R245	S201-V203 VanDerWaalsContact OG-CG2 3.26Å; S201-V203 WeakPolarHBondContact OG-CG2 3.22Å; S201-V203 PolarHBondContact OG-N 3.48Å; V203-I218 HydrophobicContact CG1-CD1 4.36Å; V203-W233 HydrophobicContact CG1-CH2 3.8Å; V203-W233 HydrophobicContact CG1-CZ3 4.03Å; V203-P244 VanDerWaalsContact CB-O 3.23Å; V203-P244 WeakPolarHBondContact CB-O 3.4Å; V203-P244 HydrophobicContact CG1-CB 4.31Å; V203-P244 WeakPolarHBondContact CG1-O 3.42Å; V203-R245 WeakPolarHBondContact O-CA 3.38Å
204	G	89.9	Confident	90.1	Very high	16 Å²	16	43.2 Å²	43.2	17%	0.165	24%	0.241	C	C	.	.			trans	107.6	171.2	-176.9	0	0	0	0	0	112.8	S201 F212	S201-G204 WeakPolarHBondContact CB-O 3.47Å; S201-G204 PolarHBondContact OG-O 2.93Å; G204-F212 PolarHBondContact N-O 3.04Å; G204-F212 VanDerWaalsContact N-O 3.08Å
205	V	81.7	Confident	90.1	Very high	85 Å²	85	47.5 Å²	47.5	52%	0.515	26%	0.259	S	S	.	.			trans	-89.8	129.2	-174.7	173.9	0	0	0	0	110.5	E209 G211	V205-E209 WeakPolarHBondContact CG1-O 3.48Å; V205-G211 WeakPolarHBondContact CG2-O 3.29Å
206	K	77.3	Confident	90.1	Very high	70 Å²	70	49.8 Å²	49.8	30%	0.304	28%	0.275	S	S	.	.			trans	-125.7	127.8	169.8	-70.4	-180	172.7	176.3	0	109.6	E208 E209 R245 E246 S247 N248	K206-E208 PolarHBondContact O-N 2.87Å; K206-E209 WeakPolarHBondContact O-CB 3.45Å; K206-E209 PolarHBondContact O-N 3.11Å; K206-R245 WeakPolarHBondContact CE-O 3.18Å; K206-E246 PolarHBondContact NZ-O 3Å; K206-S247 PolarHBondContact NZ-O 3.38Å; K206-N248 VanDerWaalsContact CD-OD1 3.29Å; K206-N248 WeakPolarHBondContact CD-OD1 3.47Å; K206-N248 PolarHBondContact NZ-OD1 3.3Å
207	G	76.6	Confident	89.9	Confident	80 Å²	80	49.4 Å²	49.4	83%	0.825	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.4	-128.6	-179	0	0	0	0	0	112.8	E209	G207-E209 VanDerWaalsContact C-N 3.35Å
208	E	76	Confident	89.9	Confident	203 Å²	203	49.8 Å²	49.8	95%	0.949	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-3.5	-177	-60.1	-173.4	167.2	0	0	113.9	K206	K206-E208 PolarHBondContact O-N 2.87Å
209	E	80.1	Confident	89.8	Confident	108 Å²	108	50 Å²	50	51%	0.505	28%	0.276	S	S	.	.			trans	-64.2	154.2	179.6	-63.3	-172.1	158.8	0	0	111.7	V205 K206 G207	V205-E209 WeakPolarHBondContact CG1-O 3.48Å; K206-E209 WeakPolarHBondContact O-CB 3.45Å; K206-E209 PolarHBondContact O-N 3.11Å; G207-E209 VanDerWaalsContact C-N 3.35Å
210	R	86.4	Confident	89.8	Confident	77 Å²	77	48.5 Å²	48.5	29%	0.291	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	151.4	168.2	-62.1	-166.9	-179.8	-180	8.2	108.9	N159 V160 S161 T173 L200 S201	N159-R210 WeakPolarHBondContact O-CD 3.24Å; N159-R210 PolarHBondContact O-NH1 3.3Å; V160-R210 PolarHBondContact O-NH1 2.91Å; S161-R210 PolarHBondContact OG-NE 3.1Å; S161-R210 PolarHBondContact OG-NH1 2.96Å; S161-R210 VanDerWaalsContact OG-NH1 3.09Å; S161-R210 PolarHBondContact OG-NH2 3.25Å; T173-R210 VanDerWaalsContact CG2-NH1 3.28Å; T173-R210 PolarHBondContact OG1-NH1 3.02Å; T173-R210 PolarHBondContact OG1-NH2 2.87Å; L200-R210 CarbonylContact C-O 2.96Å; L200-R210 VanDerWaalsContact CA-O 3.29Å; L200-R210 WeakPolarHBondContact CA-O 3.2Å; L200-R210 HydrophobicContact CD2-CB 3.83Å; S201-R210 PolarHBondContact N-O 3.01Å
211	G	88.6	Confident	89.9	Confident	9 Å²	9	48.6 Å²	48.6	9%	0.093	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	169.7	-174.1	-176.5	0	0	0	0	0	113.3	S201 V205	S201-G211 CarbonylContact O-C 3.51Å; S201-G211 WeakPolarHBondContact O-CA 3.4Å; V205-G211 WeakPolarHBondContact CG2-O 3.29Å
212	F	91.3	Very high	89.9	Confident	17 Å²	17	52 Å²	52	8%	0.075	28%	0.276	C	S	.	.			trans	-156.3	161.1	-179.9	49.2	-83.1	0	0	0	106.9	L151 Y155 L158 L200 S201 I202 G204 D214	L151-F212 HydrophobicContact CD1-CZ 4.14Å; L151-F212 HydrophobicContact CD2-CE1 4.19Å; L151-F212 HydrophobicContact CD2-CE2 3.66Å; L151-F212 HydrophobicContact CD2-CZ 3.29Å; L151-F212 HydrophobicContact CG-CZ 4.34Å; Y155-F212 AromaticContact CD2-CD2 3.97Å; Y155-F212 HydrophobicContact CD2-CD2 3.97Å; Y155-F212 HydrophobicContact CD2-CE2 4.1Å; Y155-F212 HydrophobicContact CD2-CG 4.26Å; Y155-F212 HydrophobicContact CE1-CB 4.38Å; Y155-F212 HydrophobicContact CE1-CD2 4.3Å; Y155-F212 AromaticContact CE2-CD2 3.45Å; Y155-F212 HydrophobicContact CE2-CD2 3.45Å; Y155-F212 VanDerWaalsContact CE2-CD2 3.45Å; Y155-F212 AromaticContact CE2-CE2 3.62Å; Y155-F212 HydrophobicContact CE2-CE2 3.62Å; Y155-F212 HydrophobicContact CE2-CG 4.14Å; Y155-F212 HydrophobicContact CE2-CZ 4.44Å; Y155-F212 AromaticContact CZ-CD2 3.64Å; L158-F212 HydrophobicContact CD2-CD1 3.45Å; L158-F212 VanDerWaalsContact CD2-CD1 3.45Å; L158-F212 HydrophobicContact CD2-CE1 3.81Å; L158-F212 HydrophobicContact CD2-CG 4.49Å; L200-F212 HydrophobicContact CB-CE1 4.11Å; L200-F212 HydrophobicContact CD1-CE1 4.03Å; S201-F212 PolarHBondContact O-N 2.94Å; I202-F212 CarbonylContact C-O 3.24Å; I202-F212 VanDerWaalsContact CA-O 3.3Å; I202-F212 WeakPolarHBondContact CA-O 3.46Å; I202-F212 HydrophobicContact CG1-CE2 4.28Å; I202-F212 HydrophobicContact CG1-CZ 4.12Å; G204-F212 PolarHBondContact N-O 3.04Å; G204-F212 VanDerWaalsContact N-O 3.08Å; F212-D214 HydrophobicContact CD2-CB 3.75Å; F212-D214 HydrophobicContact CE2-CB 3.66Å
213	F	93.9	Very high	89.8	Confident	62 Å²	62	57.9 Å²	57.9	27%	0.272	30%	0.302	S	S	.	.	B	Isolated β-bridge	trans	-98.1	109.4	170.9	178.5	-101.5	0	0	0	108.9	I202 K215 I218 P244 R245	I202-F213 WeakPolarHBondContact O-CA 3.37Å; F213-K215 HydrophobicContact CE1-CB 3.96Å; F213-K215 HydrophobicContact CZ-CB 4.48Å; F213-I218 HydrophobicContact CD2-CD1 4.33Å; F213-I218 HydrophobicContact CE2-CD1 3.72Å; F213-I218 HydrophobicContact CZ-CD1 4.2Å; F213-P244 HydrophobicContact CE2-CB 4.2Å; F213-R245 HydrophobicContact CD2-CG 3.49Å; F213-R245 VanDerWaalsContact CD2-CG 3.49Å; F213-R245 VanDerWaalsContact CE1-NH2 3.33Å; F213-R245 HydrophobicContact CE2-CG 3.38Å; F213-R245 HydrophobicContact CG-CG 4.22Å; F213-R245 HydrophobicContact CZ-CG 4.04Å
214	D	94	Very high	89.9	Confident	4 Å²	4	57.8 Å²	57.8	2%	0.021	30%	0.301	C	S	.	.			trans	-109.5	96.3	178.2	-160.5	-44.4	0	0	0	112.4	Y150 Y155 I202 F212 S216 L217 I218	Y150-D214 WeakPolarHBondContact CE1-OD2 3.35Å; Y150-D214 PolarHBondContact OH-OD1 3.06Å; Y150-D214 PolarHBondContact OH-OD2 2.94Å; Y150-D214 VanDerWaalsContact OH-OD2 3.08Å; Y155-D214 WeakPolarHBondContact CE2-OD2 3.38Å; Y155-D214 VanDerWaalsContact OH-CG 3.23Å; Y155-D214 PolarHBondContact OH-OD2 2.91Å; I202-D214 HydrophobicContact CG2-CB 4.03Å; I202-D214 PolarHBondContact O-N 2.78Å; I202-D214 VanDerWaalsContact O-N 3.08Å; F212-D214 HydrophobicContact CD2-CB 3.75Å; F212-D214 HydrophobicContact CE2-CB 3.66Å; D214-S216 VanDerWaalsContact C-N 3.29Å; D214-S216 PolarHBondContact O-N 2.83Å; D214-S216 WeakPolarHBondContact OD1-CA 3.36Å; D214-S216 WeakPolarHBondContact OD1-CB 2.95Å; D214-S216 PolarHBondContact OD1-N 3.38Å; D214-L217 HydrophobicContact CB-CB 3.96Å; D214-L217 PolarHBondContact OD1-N 2.78Å; D214-I218 WeakPolarHBondContact O-CD1 3.39Å; D214-I218 VanDerWaalsContact O-CG1 3.28Å; D214-I218 WeakPolarHBondContact O-CG1 3.43Å; D214-I218 PolarHBondContact O-N 2.93Å; D214-I218 VanDerWaalsContact O-N 3.11Å
215	K	94.6	Very high	90.2	Very high	129 Å²	129	57.5 Å²	57.5	56%	0.561	30%	0.296	S	S	*	.	H	α-helix	trans	-62.3	-37.6	176.4	-165.9	-175.3	-178.1	-155.7	0	112.3	F213 I218 E219	F213-K215 HydrophobicContact CE1-CB 3.96Å; F213-K215 HydrophobicContact CZ-CB 4.48Å; K215-I218 PolarHBondContact O-N 3.23Å; K215-E219 WeakPolarHBondContact CE-OE1 3.27Å; K215-E219 HydrophobicContact CG-CG 4.36Å; K215-E219 IonicContact NZ-OE1 2.89Å; K215-E219 PolarHBondContact NZ-OE1 2.86Å; K215-E219 WeakPolarHBondContact O-CB 3.07Å; K215-E219 VanDerWaalsContact O-CG 3.29Å; K215-E219 WeakPolarHBondContact O-CG 3.32Å; K215-E219 PolarHBondContact O-N 2.97Å
216	S	94.3	Very high	91	Very high	51 Å²	51	53.4 Å²	53.4	36%	0.357	27%	0.271	S	S	.	.	H	α-helix	trans	-67.9	-41.9	-175.5	-174.9	0	0	0	0	111.1	Y150 D214 E219 M220	Y150-S216 WeakPolarHBondContact OH-CB 3.23Å; D214-S216 VanDerWaalsContact C-N 3.29Å; D214-S216 PolarHBondContact O-N 2.83Å; D214-S216 WeakPolarHBondContact OD1-CA 3.36Å; D214-S216 WeakPolarHBondContact OD1-CB 2.95Å; D214-S216 PolarHBondContact OD1-N 3.38Å; S216-E219 PolarHBondContact O-N 3.16Å; S216-M220 WeakPolarHBondContact O-CB 3.4Å; S216-M220 WeakPolarHBondContact O-CG 3.38Å; S216-M220 PolarHBondContact O-N 3.34Å; S216-M220 WeakPolarHBondContact OG-CE 3.31Å
217	L	94.4	Very high	92	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-68.3	-38.9	176.2	-168.1	60.2	0	0	0	111.8	M144 L147 Y150 I202 D214 M220 I221 L253 I452	M144-L217 HydrophobicContact SD-CD1 4.45Å; L147-L217 HydrophobicContact CD2-CD1 4.1Å; Y150-L217 HydrophobicContact CE1-CB 4.49Å; I202-L217 HydrophobicContact CD1-CD2 3.51Å; I202-L217 HydrophobicContact CG1-CD2 4.08Å; I202-L217 HydrophobicContact CG2-CB 4.49Å; I202-L217 HydrophobicContact CG2-CD2 4.15Å; D214-L217 HydrophobicContact CB-CB 3.96Å; D214-L217 PolarHBondContact OD1-N 2.78Å; L217-M220 WeakPolarHBondContact O-CB 3.44Å; L217-M220 PolarHBondContact O-N 2.93Å; L217-I221 WeakPolarHBondContact O-CG1 3.33Å; L217-I221 PolarHBondContact O-N 3.43Å; L217-L253 HydrophobicContact CD2-CD1 4.36Å; L217-I452 HydrophobicContact CD1-CD1 4.28Å; L217-I452 HydrophobicContact CD2-CD1 3.97Å; L217-I452 HydrophobicContact CG-CD1 4.29Å
218	I	96	Very high	93	Very high	8 Å²	8	50.6 Å²	50.6	4%	0.041	24%	0.236	C	C	.	.	H	α-helix	trans	-60.9	-49.7	172.4	-69.6	165.3	0	0	0	110.8	I202 V203 F213 D214 K215 M220 I221 E222 W233 P244	I202-I218 HydrophobicContact CG2-CG1 4.19Å; V203-I218 HydrophobicContact CG1-CD1 4.36Å; F213-I218 HydrophobicContact CD2-CD1 4.33Å; F213-I218 HydrophobicContact CE2-CD1 3.72Å; F213-I218 HydrophobicContact CZ-CD1 4.2Å; D214-I218 WeakPolarHBondContact O-CD1 3.39Å; D214-I218 VanDerWaalsContact O-CG1 3.28Å; D214-I218 WeakPolarHBondContact O-CG1 3.43Å; D214-I218 PolarHBondContact O-N 2.93Å; D214-I218 VanDerWaalsContact O-N 3.11Å; K215-I218 PolarHBondContact O-N 3.23Å; I218-M220 PolarHBondContact O-N 2.77Å; I218-I221 WeakPolarHBondContact O-CB 3.23Å; I218-I221 PolarHBondContact O-N 3.47Å; I218-E222 HydrophobicContact CG2-CG 4.33Å; I218-E222 WeakPolarHBondContact O-CG 3.23Å; I218-E222 PolarHBondContact O-N 3.06Å; I218-W233 HydrophobicContact CG2-CZ2 3.92Å; I218-P244 HydrophobicContact CD1-CB 4Å
219	E	95.6	Very high	94.1	Very high	68 Å²	68	41.1 Å²	41.1	32%	0.318	19%	0.192	S	C	.	.	H	α-helix	trans	-59.5	-34.5	177.1	-75.6	174.5	-173.7	0	0	111.8	K215 S216 K223	K215-E219 WeakPolarHBondContact CE-OE1 3.27Å; K215-E219 HydrophobicContact CG-CG 4.36Å; K215-E219 IonicContact NZ-OE1 2.89Å; K215-E219 PolarHBondContact NZ-OE1 2.86Å; K215-E219 WeakPolarHBondContact O-CB 3.07Å; K215-E219 VanDerWaalsContact O-CG 3.29Å; K215-E219 WeakPolarHBondContact O-CG 3.32Å; K215-E219 PolarHBondContact O-N 2.97Å; S216-E219 PolarHBondContact O-N 3.16Å; E219-K223 WeakPolarHBondContact O-CB 3.34Å; E219-K223 WeakPolarHBondContact O-CD 3.19Å; E219-K223 WeakPolarHBondContact O-CG 3.48Å; E219-K223 PolarHBondContact O-N 2.99Å
220	M	94.7	Very high	94.9	Very high	20 Å²	20	36 Å²	36	10%	0.099	17%	0.168	C	C	.	.	H	α-helix	trans	-65.4	-44.1	174.4	-85.9	-170.8	-105.6	0	0	112	M144 P145 Y150 S216 L217 I218 K223	M144-M220 HydrophobicContact CE-CB 3.56Å; M144-M220 HydrophobicContact CE-CG 4.22Å; M144-M220 WeakPolarHBondContact CE-O 3.42Å; M144-M220 HydrophobicContact CE-SD 4.44Å; M144-M220 HydrophobicContact SD-CB 3.78Å; P145-M220 HydrophobicContact CG-SD 4.39Å; Y150-M220 HydrophobicContact CE2-CE 4.19Å; S216-M220 WeakPolarHBondContact O-CB 3.4Å; S216-M220 WeakPolarHBondContact O-CG 3.38Å; S216-M220 PolarHBondContact O-N 3.34Å; S216-M220 WeakPolarHBondContact OG-CE 3.31Å; L217-M220 WeakPolarHBondContact O-CB 3.44Å; L217-M220 PolarHBondContact O-N 2.93Å; I218-M220 PolarHBondContact O-N 2.77Å; M220-K223 PolarHBondContact O-N 3.24Å
221	I	96.7	Very high	95.5	Very high	3 Å²	3	32.4 Å²	32.4	2%	0.015	16%	0.155	C	C	.	.	H	α-helix	trans	-61.4	-47.2	173.9	-68.8	167.3	0	0	0	110.5	L217 I218 K223 D224 L227 T231 P251 I452 W454	L217-I221 WeakPolarHBondContact O-CG1 3.33Å; L217-I221 PolarHBondContact O-N 3.43Å; I218-I221 WeakPolarHBondContact O-CB 3.23Å; I218-I221 PolarHBondContact O-N 3.47Å; I221-K223 VanDerWaalsContact C-N 3.26Å; I221-K223 PolarHBondContact O-N 3.11Å; I221-D224 WeakPolarHBondContact O-CB 3.14Å; I221-D224 PolarHBondContact O-N 3.26Å; I221-D224 VanDerWaalsContact O-N 3.08Å; I221-L227 HydrophobicContact CG2-CB 3.89Å; I221-L227 HydrophobicContact CG2-CD1 4.12Å; I221-T231 HydrophobicContact CG2-CG2 3.88Å; I221-P251 HydrophobicContact CD1-CG 4.47Å; I221-I452 HydrophobicContact CD1-CG2 4.36Å; I221-W454 HydrophobicContact CD1-CH2 4.41Å; I221-W454 HydrophobicContact CD1-CZ3 4.18Å; I221-W454 HydrophobicContact CG2-CH2 3.73Å; I221-W454 HydrophobicContact CG2-CZ2 4.11Å; I221-W454 HydrophobicContact CG2-CZ3 4.49Å
222	E	95.8	Very high	95.9	Very high	75 Å²	75	32 Å²	32	35%	0.35	15%	0.15	S	C	.	.	H	α-helix	trans	-70.4	-18.4	-178.1	-68.2	179.2	155.3	0	0	114.1	I218 D224 K228 T231 W233	I218-E222 HydrophobicContact CG2-CG 4.33Å; I218-E222 WeakPolarHBondContact O-CG 3.23Å; I218-E222 PolarHBondContact O-N 3.06Å; E222-D224 VanDerWaalsContact C-N 3.27Å; E222-K228 WeakPolarHBondContact O-CB 3.35Å; E222-T231 HydrophobicContact CG-CG2 4.39Å; E222-W233 PolarHBondContact OE1-NE1 3.39Å
223	K	94.3	Very high	96.2	Very high	125 Å²	125	32.1 Å²	32.1	54%	0.543	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-15.3	171.6	-79.9	168.6	-173	171	0	112.7	R143 E219 M220 I221	R143-K223 PolarHBondContact NH2-O 2.96Å; E219-K223 WeakPolarHBondContact O-CB 3.34Å; E219-K223 WeakPolarHBondContact O-CD 3.19Å; E219-K223 WeakPolarHBondContact O-CG 3.48Å; E219-K223 PolarHBondContact O-N 2.99Å; M220-K223 PolarHBondContact O-N 3.24Å; I221-K223 VanDerWaalsContact C-N 3.26Å; I221-K223 PolarHBondContact O-N 3.11Å
224	D	96.2	Very high	96.4	Very high	4 Å²	4	29.4 Å²	29.4	2%	0.021	14%	0.14	C	C	.	.	S	Bend	trans	-80.3	130.9	176.5	-178.1	-84.7	0	0	0	111.1	I221 E222 F226 L227 K228 Y361	I221-D224 WeakPolarHBondContact O-CB 3.14Å; I221-D224 PolarHBondContact O-N 3.26Å; I221-D224 VanDerWaalsContact O-N 3.08Å; E222-D224 VanDerWaalsContact C-N 3.27Å; D224-F226 VanDerWaalsContact C-N 3.27Å; D224-F226 PolarHBondContact O-N 2.88Å; D224-F226 WeakPolarHBondContact OD1-CA 3.08Å; D224-F226 WeakPolarHBondContact OD1-CB 3.3Å; D224-F226 PolarHBondContact OD1-N 2.97Å; D224-L227 HydrophobicContact CB-CB 4.03Å; D224-L227 HydrophobicContact CB-CD1 3.88Å; D224-L227 HydrophobicContact CB-CG 4.01Å; D224-L227 PolarHBondContact OD1-N 2.76Å; D224-K228 VanDerWaalsContact O-CB 3.3Å; D224-K228 WeakPolarHBondContact O-CB 3.34Å; D224-K228 VanDerWaalsContact O-CG 3.3Å; D224-K228 WeakPolarHBondContact O-CG 3.47Å; D224-K228 PolarHBondContact O-N 2.72Å; D224-K228 VanDerWaalsContact O-N 3.11Å; D224-Y361 PolarHBondContact OD1-OH 2.78Å; D224-Y361 WeakPolarHBondContact OD2-CE1 3.29Å; D224-Y361 PolarHBondContact OD2-OH 2.96Å
225	P	96.4	Very high	96.5	Very high	9 Å²	9	32.6 Å²	32.6	6%	0.058	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-25.1	-173	23.2	-33.4	0	0	0	114.2	L105 P360 Y361	L105-P225 HydrophobicContact CD1-CG 4.49Å; L105-P225 HydrophobicContact CD2-CB 4.3Å; L105-P225 HydrophobicContact CD2-CG 3.62Å; L105-P225 HydrophobicContact CG-CB 4.08Å; L105-P225 HydrophobicContact CG-CG 3.79Å; P225-P360 HydrophobicContact CG-CG 4.09Å; P225-Y361 HydrophobicContact CG-CE2 4Å; P225-Y361 WeakPolarHBondContact CG-OH 3.34Å
226	F	98.4	Very high	96.6	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-55.3	174.1	-68.8	-100.8	0	0	0	110.3	L97 L105 L108 A109 Y112 F113 V137 D224 K228 L229 Y361 I432 F434	L97-F226 HydrophobicContact CD1-CE2 3.79Å; L97-F226 HydrophobicContact CD1-CZ 3.81Å; L105-F226 HydrophobicContact CD1-CE2 4.18Å; L108-F226 HydrophobicContact CD2-CE1 4.18Å; L108-F226 HydrophobicContact CD2-CZ 3.57Å; A109-F226 HydrophobicContact CB-CD1 3.86Å; A109-F226 HydrophobicContact CB-CD2 4.21Å; A109-F226 HydrophobicContact CB-CE1 3.99Å; A109-F226 HydrophobicContact CB-CE2 4.31Å; A109-F226 HydrophobicContact CB-CG 3.99Å; A109-F226 HydrophobicContact CB-CZ 4.23Å; Y112-F226 HydrophobicContact CD1-CD1 4.22Å; Y112-F226 HydrophobicContact CD1-CE1 4.02Å; Y112-F226 HydrophobicContact CD2-CE1 4.16Å; Y112-F226 HydrophobicContact CG-CD1 4.38Å; Y112-F226 AromaticContact CG-CE1 3.75Å; Y112-F226 HydrophobicContact CG-CE1 3.75Å; F113-F226 HydrophobicContact CE2-CB 4.13Å; F113-F226 HydrophobicContact CE2-CD1 4.18Å; F113-F226 VanDerWaalsContact CE2-O 3.31Å; F113-F226 WeakPolarHBondContact CE2-O 3.3Å; F113-F226 HydrophobicContact CZ-CB 4.06Å; F113-F226 HydrophobicContact CZ-CD1 4.22Å; V137-F226 HydrophobicContact CG1-CD2 4.43Å; V137-F226 HydrophobicContact CG1-CE2 4.05Å; V137-F226 HydrophobicContact CG1-CZ 4.14Å; V137-F226 HydrophobicContact CG2-CD1 3.77Å; V137-F226 HydrophobicContact CG2-CD2 4.49Å; V137-F226 HydrophobicContact CG2-CE1 3.61Å; V137-F226 HydrophobicContact CG2-CE2 4.37Å; V137-F226 HydrophobicContact CG2-CG 4.21Å; V137-F226 HydrophobicContact CG2-CZ 3.93Å; D224-F226 VanDerWaalsContact C-N 3.27Å; D224-F226 PolarHBondContact O-N 2.88Å; D224-F226 WeakPolarHBondContact OD1-CA 3.08Å; D224-F226 WeakPolarHBondContact OD1-CB 3.3Å; D224-F226 PolarHBondContact OD1-N 2.97Å; F226-K228 VanDerWaalsContact C-N 3.3Å; F226-K228 PolarHBondContact O-N 3.19Å; F226-L229 WeakPolarHBondContact O-CB 3.41Å; F226-L229 PolarHBondContact O-N 3.17Å; F226-Y361 HydrophobicContact CD2-CE2 4.36Å; F226-Y361 WeakPolarHBondContact CD2-OH 3.31Å; F226-Y361 HydrophobicContact CE2-CE2 4.05Å; F226-I432 HydrophobicContact CB-CD1 3.88Å; F226-I432 HydrophobicContact CG-CD1 4.43Å; F226-F434 HydrophobicContact CB-CZ 4.03Å
227	L	98.4	Very high	96.8	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.005	13%	0.128	C	C	.	.	G	3₁₀ helix	trans	-60.3	-38.3	-171.7	-59.5	174.1	0	0	0	112.7	I221 D224 L229 V230 T231 V320 L322 I432 F434 W454	I221-L227 HydrophobicContact CG2-CB 3.89Å; I221-L227 HydrophobicContact CG2-CD1 4.12Å; D224-L227 HydrophobicContact CB-CB 4.03Å; D224-L227 HydrophobicContact CB-CD1 3.88Å; D224-L227 HydrophobicContact CB-CG 4.01Å; D224-L227 PolarHBondContact OD1-N 2.76Å; L227-L229 PolarHBondContact O-N 3.33Å; L227-V230 CarbonylContact O-C 3.58Å; L227-V230 PolarHBondContact O-N 2.9Å; L227-T231 PolarHBondContact O-N 2.92Å; L227-V320 HydrophobicContact CD2-CG1 3.88Å; L227-L322 HydrophobicContact CD1-CD1 3.7Å; L227-I432 HydrophobicContact CD1-CG2 4.21Å; L227-I432 HydrophobicContact CD2-CB 4.11Å; L227-I432 HydrophobicContact CD2-CD1 3.9Å; L227-I432 HydrophobicContact CD2-CG2 4.05Å; L227-I432 HydrophobicContact CG-CD1 4.05Å; L227-I432 HydrophobicContact CG-CG2 4.42Å; L227-F434 HydrophobicContact CD2-CE1 4.15Å; L227-F434 HydrophobicContact CD2-CZ 4.33Å; L227-W454 HydrophobicContact CB-CZ2 4.39Å; L227-W454 HydrophobicContact CD1-CH2 4.37Å; L227-W454 HydrophobicContact CD2-CH2 3.86Å; L227-W454 HydrophobicContact CD2-CZ2 3.94Å; L227-W454 HydrophobicContact CG-CH2 4.48Å
228	K	97.3	Very high	96.8	Very high	89 Å²	89	29 Å²	29	39%	0.387	15%	0.146	S	C	.	.	G	3₁₀ helix	trans	-57	-25.6	178.4	77.3	-176	-176.8	179.5	0	114.3	E222 D224 F226 V230	E222-K228 WeakPolarHBondContact O-CB 3.35Å; D224-K228 VanDerWaalsContact O-CB 3.3Å; D224-K228 WeakPolarHBondContact O-CB 3.34Å; D224-K228 VanDerWaalsContact O-CG 3.3Å; D224-K228 WeakPolarHBondContact O-CG 3.47Å; D224-K228 PolarHBondContact O-N 2.72Å; D224-K228 VanDerWaalsContact O-N 3.11Å; F226-K228 VanDerWaalsContact C-N 3.3Å; F226-K228 PolarHBondContact O-N 3.19Å; K228-V230 VanDerWaalsContact C-N 3.33Å
229	L	98.2	Very high	96.7	Very high	5 Å²	5	30.9 Å²	30.9	3%	0.026	16%	0.156	C	C	.	.	G	3₁₀ helix	trans	-77.1	-26.4	179.6	-61.3	177.9	0	0	0	111.5	A109 R110 F113 F226 L227 V235 L236	A109-L229 HydrophobicContact CB-CD1 3.92Å; R110-L229 HydrophobicContact CG-CD1 3.99Å; F113-L229 HydrophobicContact CD2-CB 4.11Å; F113-L229 HydrophobicContact CD2-CD1 3.75Å; F113-L229 HydrophobicContact CE2-CB 3.93Å; F113-L229 HydrophobicContact CE2-CD1 3.91Å; F113-L229 HydrophobicContact CE2-CG 4.44Å; F226-L229 WeakPolarHBondContact O-CB 3.41Å; F226-L229 PolarHBondContact O-N 3.17Å; L227-L229 PolarHBondContact O-N 3.33Å; L229-V235 HydrophobicContact CD2-CG2 3.57Å; L229-L236 HydrophobicContact CB-CD1 3.96Å; L229-L236 HydrophobicContact CB-CG 4.18Å; L229-L236 VanDerWaalsContact O-CB 3.25Å; L229-L236 WeakPolarHBondContact O-CB 3.41Å; L229-L236 WeakPolarHBondContact O-CG 3.44Å; L229-L236 PolarHBondContact O-N 3.38Å; L229-L236 VanDerWaalsContact O-N 3.11Å
230	V	98.3	Very high	96.8	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.158	C	C	.	.	S	Bend	trans	-126.5	19.6	-167	-63.6	0	0	0	0	113.5	F113 F117 L227 K228 L236 V320 F434 W454 V456	F113-V230 HydrophobicContact CD1-CG1 4.13Å; F113-V230 HydrophobicContact CD2-CG1 4.14Å; F113-V230 HydrophobicContact CE1-CG1 3.8Å; F113-V230 HydrophobicContact CE1-CG2 4.35Å; F113-V230 HydrophobicContact CE2-CG1 3.82Å; F113-V230 HydrophobicContact CE2-CG2 4.38Å; F113-V230 HydrophobicContact CG-CG1 4.28Å; F113-V230 HydrophobicContact CZ-CB 4.39Å; F113-V230 HydrophobicContact CZ-CG1 3.63Å; F113-V230 HydrophobicContact CZ-CG2 3.78Å; F117-V230 HydrophobicContact CE2-CG1 4.14Å; L227-V230 CarbonylContact O-C 3.58Å; L227-V230 PolarHBondContact O-N 2.9Å; K228-V230 VanDerWaalsContact C-N 3.33Å; V230-L236 HydrophobicContact CG1-CD1 3.87Å; V230-V320 HydrophobicContact CB-CG2 4.14Å; V230-V320 HydrophobicContact CG2-CG1 4.32Å; V230-V320 HydrophobicContact CG2-CG2 3.91Å; V230-F434 HydrophobicContact CG2-CD1 4.18Å; V230-F434 HydrophobicContact CG2-CE1 3.69Å; V230-W454 PolarHBondContact O-NE1 3.49Å; V230-V456 HydrophobicContact CB-CG1 4.48Å; V230-V456 HydrophobicContact CB-CG2 4.34Å
231	T	98.1	Very high	96.7	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.006	19%	0.188	C	C	.	.	S	Bend	trans	-62.3	161.7	161.6	56.3	0	0	0	0	109.8	I221 E222 L227 W233 G234	I221-T231 HydrophobicContact CG2-CG2 3.88Å; E222-T231 HydrophobicContact CG-CG2 4.39Å; L227-T231 PolarHBondContact O-N 2.92Å; T231-W233 PolarHBondContact O-N 2.61Å; T231-W233 VanDerWaalsContact O-N 3.1Å; T231-G234 WeakPolarHBondContact O-CA 3.26Å; T231-G234 PolarHBondContact O-N 2.83Å; T231-G234 VanDerWaalsContact OG1-CA 3.23Å; T231-G234 WeakPolarHBondContact OG1-CA 3.39Å; T231-G234 PolarHBondContact OG1-N 2.94Å
232	P	97.4	Very high	96.7	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-29.4	178.1	-26.1	35.6	0	0	0	113.4	S237 L239 D249 W454	P232-S237 WeakPolarHBondContact O-CB 3.38Å; P232-S237 PolarHBondContact O-OG 3.47Å; P232-L239 WeakPolarHBondContact O-CB 3.49Å; P232-D249 HydrophobicContact CB-CB 4.08Å; P232-D249 HydrophobicContact CG-CB 4.17Å; P232-W454 HydrophobicContact CG-CB 4.11Å; P232-W454 HydrophobicContact CG-CG 4.2Å
233	W	97.5	Very high	96.7	Very high	21 Å²	21	34.7 Å²	34.7	8%	0.08	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.9	9.4	175.3	49.8	86.8	0	0	0	113.5	V203 I218 E222 T231 L239 S240 G241 M242 P244 P251	V203-W233 HydrophobicContact CG1-CH2 3.8Å; V203-W233 HydrophobicContact CG1-CZ3 4.03Å; I218-W233 HydrophobicContact CG2-CZ2 3.92Å; E222-W233 PolarHBondContact OE1-NE1 3.39Å; T231-W233 PolarHBondContact O-N 2.61Å; T231-W233 VanDerWaalsContact O-N 3.1Å; W233-L239 WeakPolarHBondContact CA-O 3.43Å; W233-S240 WeakPolarHBondContact O-CA 3.2Å; W233-G241 PolarHBondContact O-N 3.44Å; W233-G241 VanDerWaalsContact O-N 3.11Å; W233-M242 HydrophobicContact CB-CB 4.12Å; W233-M242 VanDerWaalsContact CB-O 3.32Å; W233-M242 WeakPolarHBondContact CB-O 3.44Å; W233-P244 HydrophobicContact CD2-CB 4.32Å; W233-P244 HydrophobicContact CD2-CG 3.97Å; W233-P244 HydrophobicContact CE3-CB 4.12Å; W233-P244 HydrophobicContact CE3-CG 4.27Å; W233-P244 HydrophobicContact CH2-CB 3.53Å; W233-P244 HydrophobicContact CH2-CG 4.02Å; W233-P244 HydrophobicContact CZ2-CB 3.73Å; W233-P244 HydrophobicContact CZ2-CG 3.69Å; W233-P244 HydrophobicContact CZ3-CB 3.75Å; W233-P244 HydrophobicContact CZ3-CG 4.3Å; W233-P251 HydrophobicContact CH2-CG 4.48Å
234	G	97.1	Very high	96.7	Very high	5 Å²	5	29.9 Å²	29.9	5%	0.052	18%	0.183	C	C	.	.	S	Bend	trans	-68.1	164.8	-178.9	0	0	0	0	0	112.3	T231 L236 S237 S240	T231-G234 WeakPolarHBondContact O-CA 3.26Å; T231-G234 PolarHBondContact O-N 2.83Å; T231-G234 VanDerWaalsContact OG1-CA 3.23Å; T231-G234 WeakPolarHBondContact OG1-CA 3.39Å; T231-G234 PolarHBondContact OG1-N 2.94Å; G234-L236 PolarHBondContact O-N 3.3Å; G234-L236 VanDerWaalsContact O-N 3.14Å; G234-S237 WeakPolarHBondContact O-CB 3.45Å; G234-S237 PolarHBondContact O-N 3.13Å; G234-S240 WeakPolarHBondContact O-CB 3.39Å; G234-S240 PolarHBondContact O-OG 3.32Å
235	V	97.2	Very high	96.6	Very high	70 Å²	70	36.5 Å²	36.5	42%	0.424	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-24.6	-173.6	-63.6	0	0	0	0	114.3	L229 K459	L229-V235 HydrophobicContact CD2-CG2 3.57Å; V235-K459 WeakPolarHBondContact O-CE 3.49Å; V235-K459 PolarHBondContact O-NZ 2.73Å
236	L	97.2	Very high	96.4	Very high	50 Å²	50	42.1 Å²	42.1	26%	0.262	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85	-15.3	176.2	-58.5	-177.5	0	0	0	113.2	F113 L229 V230 G234 L458 K459	F113-L236 HydrophobicContact CB-CD1 3.91Å; F113-L236 HydrophobicContact CD2-CD1 3.95Å; F113-L236 HydrophobicContact CG-CD1 4.06Å; L229-L236 HydrophobicContact CB-CD1 3.96Å; L229-L236 HydrophobicContact CB-CG 4.18Å; L229-L236 VanDerWaalsContact O-CB 3.25Å; L229-L236 WeakPolarHBondContact O-CB 3.41Å; L229-L236 WeakPolarHBondContact O-CG 3.44Å; L229-L236 PolarHBondContact O-N 3.38Å; L229-L236 VanDerWaalsContact O-N 3.11Å; V230-L236 HydrophobicContact CG1-CD1 3.87Å; G234-L236 PolarHBondContact O-N 3.3Å; G234-L236 VanDerWaalsContact O-N 3.14Å; L236-L458 HydrophobicContact CB-CD2 3.85Å; L236-L458 WeakPolarHBondContact O-CA 3.47Å; L236-K459 PolarHBondContact O-N 3.49Å
237	S	96.7	Very high	96.1	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.234	C	C	.	.	B	Isolated β-bridge	trans	-81.1	142.7	179.8	-176.7	0	0	0	0	112.1	P232 G234 L239 S240 R457 K459	P232-S237 WeakPolarHBondContact O-CB 3.38Å; P232-S237 PolarHBondContact O-OG 3.47Å; G234-S237 WeakPolarHBondContact O-CB 3.45Å; G234-S237 PolarHBondContact O-N 3.13Å; S237-L239 PolarHBondContact O-N 2.73Å; S237-L239 PolarHBondContact OG-N 3.18Å; S237-S240 VanDerWaalsContact O-CB 3.29Å; S237-S240 WeakPolarHBondContact O-CB 3.31Å; S237-S240 PolarHBondContact O-N 2.9Å; S237-S240 VanDerWaalsContact O-N 3.08Å; S237-R457 CarbonylContact C-O 3.57Å; S237-R457 WeakPolarHBondContact CA-O 3.31Å; S237-K459 WeakPolarHBondContact O-CE 3.48Å; S237-K459 WeakPolarHBondContact O-CG 3.47Å
238	S	95.3	Very high	95.8	Very high	55 Å²	55	48.2 Å²	48.2	39%	0.385	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-23.2	171.2	61.3	0	0	0	0	112.6	S240 R457	S238-S240 VanDerWaalsContact C-N 3.28Å; S238-S240 PolarHBondContact O-N 2.9Å; S238-R457 PolarHBondContact N-O 2.92Å; S238-R457 VanDerWaalsContact OG-CB 3.31Å; S238-R457 WeakPolarHBondContact OG-CB 3.49Å; S238-R457 PolarHBondContact OG-O 2.88Å
239	L	94.8	Very high	95.6	Very high	47 Å²	47	44.4 Å²	44.4	25%	0.246	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	24	175.8	-52.4	177.1	0	0	0	112.7	P232 W233 S237 G241 M242	P232-L239 WeakPolarHBondContact O-CB 3.49Å; W233-L239 WeakPolarHBondContact CA-O 3.43Å; S237-L239 PolarHBondContact O-N 2.73Å; S237-L239 PolarHBondContact OG-N 3.18Å; L239-G241 PolarHBondContact O-N 3.11Å; L239-M242 HydrophobicContact CB-CB 4.41Å; L239-M242 HydrophobicContact CB-CE 3.98Å; L239-M242 HydrophobicContact CB-SD 4.34Å; L239-M242 HydrophobicContact CD1-CE 3.79Å; L239-M242 HydrophobicContact CD1-SD 4.22Å; L239-M242 HydrophobicContact CD2-CE 3.97Å; L239-M242 HydrophobicContact CG-CE 4.13Å; L239-M242 WeakPolarHBondContact O-CB 3.38Å; L239-M242 PolarHBondContact O-N 3.37Å; L239-M242 VanDerWaalsContact O-N 3.1Å
240	S	96	Very high	95.4	Very high	51 Å²	51	44.5 Å²	44.5	36%	0.357	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	127.1	-177.8	-174	0	0	0	0	112	W233 G234 S237 S238	W233-S240 WeakPolarHBondContact O-CA 3.2Å; G234-S240 WeakPolarHBondContact O-CB 3.39Å; G234-S240 PolarHBondContact O-OG 3.32Å; S237-S240 VanDerWaalsContact O-CB 3.29Å; S237-S240 WeakPolarHBondContact O-CB 3.31Å; S237-S240 PolarHBondContact O-N 2.9Å; S237-S240 VanDerWaalsContact O-N 3.08Å; S238-S240 VanDerWaalsContact C-N 3.28Å; S238-S240 PolarHBondContact O-N 2.9Å
241	G	94.3	Very high	95.3	Very high	71 Å²	71	44.5 Å²	44.5	73%	0.732	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.7	-0.3	-179.4	0	0	0	0	0	115.7	W233 L239	W233-G241 PolarHBondContact O-N 3.44Å; W233-G241 VanDerWaalsContact O-N 3.11Å; L239-G241 PolarHBondContact O-N 3.11Å
242	M	95.5	Very high	95.2	Very high	53 Å²	53	47.1 Å²	47.1	26%	0.261	27%	0.265	S	S	.	.			trans	-57.8	145.3	170.3	171.3	-178.3	-76.2	0	0	111.7	W233 L239 E246	W233-M242 HydrophobicContact CB-CB 4.12Å; W233-M242 VanDerWaalsContact CB-O 3.32Å; W233-M242 WeakPolarHBondContact CB-O 3.44Å; L239-M242 HydrophobicContact CB-CB 4.41Å; L239-M242 HydrophobicContact CB-CE 3.98Å; L239-M242 HydrophobicContact CB-SD 4.34Å; L239-M242 HydrophobicContact CD1-CE 3.79Å; L239-M242 HydrophobicContact CD1-SD 4.22Å; L239-M242 HydrophobicContact CD2-CE 3.97Å; L239-M242 HydrophobicContact CG-CE 4.13Å; L239-M242 WeakPolarHBondContact O-CB 3.38Å; L239-M242 PolarHBondContact O-N 3.37Å; L239-M242 VanDerWaalsContact O-N 3.1Å; M242-E246 HydrophobicContact CG-CB 4.2Å
243	D	95.4	Very high	95.2	Very high	71 Å²	71	47.1 Å²	47.1	38%	0.38	27%	0.265	S	S	.	.			trans	-65.5	126.6	169.1	-176.3	-28.9	0	0	0	108.9	R245 E246	D243-R245 PolarHBondContact O-N 3.33Å; D243-R245 WeakPolarHBondContact OD1-CB 3.22Å; D243-R245 WeakPolarHBondContact OD1-CG 3.49Å; D243-R245 PolarHBondContact OD1-N 2.85Å; D243-E246 HydrophobicContact CB-CG 4.19Å; D243-E246 WeakPolarHBondContact O-CB 3.44Å; D243-E246 PolarHBondContact O-N 2.87Å
244	P	95.6	Very high	95.2	Very high	24 Å²	24	48.6 Å²	48.6	16%	0.156	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-45	-37.7	175.7	-31.1	35.4	0	0	0	114.7	V203 F213 I218 W233 E246 S247	V203-P244 VanDerWaalsContact CB-O 3.23Å; V203-P244 WeakPolarHBondContact CB-O 3.4Å; V203-P244 HydrophobicContact CG1-CB 4.31Å; V203-P244 WeakPolarHBondContact CG1-O 3.42Å; F213-P244 HydrophobicContact CE2-CB 4.2Å; I218-P244 HydrophobicContact CD1-CB 4Å; W233-P244 HydrophobicContact CD2-CB 4.32Å; W233-P244 HydrophobicContact CD2-CG 3.97Å; W233-P244 HydrophobicContact CE3-CB 4.12Å; W233-P244 HydrophobicContact CE3-CG 4.27Å; W233-P244 HydrophobicContact CH2-CB 3.53Å; W233-P244 HydrophobicContact CH2-CG 4.02Å; W233-P244 HydrophobicContact CZ2-CB 3.73Å; W233-P244 HydrophobicContact CZ2-CG 3.69Å; W233-P244 HydrophobicContact CZ3-CB 3.75Å; W233-P244 HydrophobicContact CZ3-CG 4.3Å; P244-E246 PolarHBondContact O-N 3.35Å; P244-S247 VanDerWaalsContact O-CB 3.24Å; P244-S247 WeakPolarHBondContact O-CB 3.36Å; P244-S247 PolarHBondContact O-N 3.26Å; P244-S247 VanDerWaalsContact O-N 3.11Å
245	R	93.8	Very high	95.3	Very high	144 Å²	144	48.4 Å²	48.4	54%	0.543	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-63.8	-23.1	-179.2	-64.1	171.8	-178.8	-171.3	2.5	114	V203 K206 F213 D243	V203-R245 WeakPolarHBondContact O-CA 3.38Å; K206-R245 WeakPolarHBondContact CE-O 3.18Å; F213-R245 HydrophobicContact CD2-CG 3.49Å; F213-R245 VanDerWaalsContact CD2-CG 3.49Å; F213-R245 VanDerWaalsContact CE1-NH2 3.33Å; F213-R245 HydrophobicContact CE2-CG 3.38Å; F213-R245 HydrophobicContact CG-CG 4.22Å; F213-R245 HydrophobicContact CZ-CG 4.04Å; D243-R245 PolarHBondContact O-N 3.33Å; D243-R245 WeakPolarHBondContact OD1-CB 3.22Å; D243-R245 WeakPolarHBondContact OD1-CG 3.49Å; D243-R245 PolarHBondContact OD1-N 2.85Å
246	E	92.3	Very high	95.3	Very high	127 Å²	127	47.6 Å²	47.6	59%	0.593	26%	0.258	S	S	*	.	G	3₁₀ helix	trans	-90.9	-6.5	-179.4	-62.1	-176.6	163.4	0	0	112.3	K206 M242 D243 P244 N248	K206-E246 PolarHBondContact NZ-O 3Å; M242-E246 HydrophobicContact CG-CB 4.2Å; D243-E246 HydrophobicContact CB-CG 4.19Å; D243-E246 WeakPolarHBondContact O-CB 3.44Å; D243-E246 PolarHBondContact O-N 2.87Å; P244-E246 PolarHBondContact O-N 3.35Å; E246-N248 PolarHBondContact O-N 2.99Å
247	S	92.7	Very high	95.3	Very high	3 Å²	3	45.5 Å²	45.5	2%	0.021	25%	0.247	C	C	.	.			trans	-66.9	130.4	-179.8	-178.9	0	0	0	0	112.7	K206 P244 D249 G250	K206-S247 PolarHBondContact NZ-O 3.38Å; P244-S247 VanDerWaalsContact O-CB 3.24Å; P244-S247 WeakPolarHBondContact O-CB 3.36Å; P244-S247 PolarHBondContact O-N 3.26Å; P244-S247 VanDerWaalsContact O-N 3.11Å; S247-D249 PolarHBondContact OG-N 3.42Å; S247-G250 WeakPolarHBondContact CB-O 3.45Å; S247-G250 PolarHBondContact OG-O 2.97Å
248	N	90.9	Very high	95.4	Very high	126 Å²	126	45.5 Å²	45.5	67%	0.674	25%	0.247	S	C	*	.	S	Bend	trans	-96.3	-7.5	166	-69	-27.1	0	0	0	112	K206 E246 G250	K206-N248 VanDerWaalsContact CD-OD1 3.29Å; K206-N248 WeakPolarHBondContact CD-OD1 3.47Å; K206-N248 PolarHBondContact NZ-OD1 3.3Å; E246-N248 PolarHBondContact O-N 2.99Å; N248-G250 VanDerWaalsContact C-N 3.28Å; N248-G250 PolarHBondContact O-N 3.4Å
249	D	93.9	Very high	95.4	Very high	8 Å²	8	44.9 Å²	44.9	4%	0.043	24%	0.238	C	C	.	.	S	Bend	trans	-92.7	11.8	-172.3	-65	-15.2	0	0	0	111.3	P232 S247 W454 H455 R457	P232-D249 HydrophobicContact CB-CB 4.08Å; P232-D249 HydrophobicContact CG-CB 4.17Å; S247-D249 PolarHBondContact OG-N 3.42Å; D249-W454 CarbonylContact O-C 3.53Å; D249-W454 WeakPolarHBondContact O-CA 3.28Å; D249-W454 WeakPolarHBondContact O-CB 3.19Å; D249-H455 HydrophobicContact CB-CB 4.02Å; D249-H455 PolarHBondContact O-N 3.26Å; D249-R457 IonicContact OD1-CZ 3.26Å; D249-R457 IonicContact OD1-NE 3.92Å; D249-R457 PolarHBondContact OD1-NE 3.06Å; D249-R457 IonicContact OD1-NH2 3.01Å; D249-R457 PolarHBondContact OD1-NH2 2.89Å; D249-R457 IonicContact OD2-CZ 2.79Å; D249-R457 IonicContact OD2-NE 3.18Å; D249-R457 PolarHBondContact OD2-NE 3.07Å; D249-R457 IonicContact OD2-NH2 3.67Å
250	G	92.9	Very high	95.4	Very high	7 Å²	7	43.3 Å²	43.3	7%	0.072	23%	0.229	C	C	.	.			trans	89.5	-160	-171.7	0	0	0	0	0	113.1	S247 N248	S247-G250 WeakPolarHBondContact CB-O 3.45Å; S247-G250 PolarHBondContact OG-O 2.97Å; N248-G250 VanDerWaalsContact C-N 3.28Å; N248-G250 PolarHBondContact O-N 3.4Å
251	P	97	Very high	95.3	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.006	23%	0.229	C	C	.	.			cis	-68.9	144.2	3.9	-25	36.4	0	0	0	117.3	I202 I221 W233 I452 A453 W454	I202-P251 PolarHBondContact N-O 2.74Å; I221-P251 HydrophobicContact CD1-CG 4.47Å; W233-P251 HydrophobicContact CH2-CG 4.48Å; P251-I452 HydrophobicContact CB-CG2 3.68Å; P251-A453 WeakPolarHBondContact CA-O 3.43Å; P251-W454 HydrophobicContact CB-CB 4.37Å; P251-W454 HydrophobicContact CB-CD2 4.39Å; P251-W454 HydrophobicContact CB-CE3 3.73Å; P251-W454 HydrophobicContact CB-CZ3 4.4Å; P251-W454 HydrophobicContact CG-CB 4.18Å; P251-W454 HydrophobicContact CG-CD2 3.94Å; P251-W454 HydrophobicContact CG-CE3 3.65Å; P251-W454 HydrophobicContact CG-CG 4.22Å; P251-W454 HydrophobicContact CG-CZ3 4.29Å
252	I	96.2	Very high	94.9	Very high	56 Å²	56	41.2 Å²	41.2	29%	0.287	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	149.2	170.5	66.2	175.6	0	0	0	110.8	A199 L200 W254 I452 A453	A199-I252 HydrophobicContact CB-CD1 4.22Å; L200-I252 CarbonylContact O-C 3.51Å; L200-I252 VanDerWaalsContact O-CA 3.31Å; L200-I252 WeakPolarHBondContact O-CA 3.25Å; I252-W254 HydrophobicContact CD1-CE3 4.33Å; I252-W254 HydrophobicContact CD1-CZ3 4.1Å; I252-W254 HydrophobicContact CG1-CE3 4.03Å; I252-W254 HydrophobicContact CG1-CZ3 3.76Å; I252-I452 CarbonylContact O-C 3.55Å; I252-I452 VanDerWaalsContact O-CA 3.23Å; I252-I452 WeakPolarHBondContact O-CA 3.48Å; I252-A453 PolarHBondContact N-O 3.44Å; I252-A453 PolarHBondContact O-N 3.1Å
253	L	97.5	Very high	94.3	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	135.2	-179.8	-179.1	157.1	0	0	0	111.4	L147 L151 L197 A199 L200 I202 L217 S451 I452	L147-L253 HydrophobicContact CB-CD1 4.17Å; L147-L253 HydrophobicContact CD1-CD1 3.96Å; L147-L253 HydrophobicContact CD1-CG 4.48Å; L147-L253 HydrophobicContact CD2-CD1 4.24Å; L147-L253 HydrophobicContact CG-CD1 4.35Å; L151-L253 HydrophobicContact CD1-CD1 3.69Å; L151-L253 HydrophobicContact CD1-CD2 3.54Å; L151-L253 HydrophobicContact CD1-CG 4.27Å; L151-L253 HydrophobicContact CG-CD1 4.44Å; L197-L253 HydrophobicContact CD2-CD2 4.09Å; A199-L253 CarbonylContact C-O 3.58Å; A199-L253 WeakPolarHBondContact CA-O 3.47Å; L200-L253 PolarHBondContact N-O 3.43Å; L200-L253 PolarHBondContact O-N 3.18Å; I202-L253 HydrophobicContact CD1-CB 3.63Å; I202-L253 HydrophobicContact CD1-CD1 4.02Å; I202-L253 HydrophobicContact CG1-CB 4.12Å; L217-L253 HydrophobicContact CD2-CD1 4.36Å; L253-S451 VanDerWaalsContact CA-O 3.27Å; L253-S451 WeakPolarHBondContact CA-O 2.78Å; L253-I452 HydrophobicContact CB-CG1 4.17Å; L253-I452 HydrophobicContact CD1-CD1 4.12Å; L253-I452 HydrophobicContact CD1-CG1 3.88Å; L253-I452 HydrophobicContact CG-CG1 4.11Å
254	W	97.9	Very high	93.3	Very high	52 Å²	52	41.2 Å²	41.2	20%	0.197	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	166.6	174.7	68.7	100.2	0	0	0	111	L197 A199 I252 S450 S451 A453	L197-W254 WeakPolarHBondContact O-CB 3.29Å; A199-W254 HydrophobicContact CB-CB 4.44Å; I252-W254 HydrophobicContact CD1-CE3 4.33Å; I252-W254 HydrophobicContact CD1-CZ3 4.1Å; I252-W254 HydrophobicContact CG1-CE3 4.03Å; I252-W254 HydrophobicContact CG1-CZ3 3.76Å; W254-S450 CarbonylContact O-C 3.56Å; W254-S450 VanDerWaalsContact O-CA 3.23Å; W254-S450 WeakPolarHBondContact O-CA 3.24Å; W254-S451 VanDerWaalsContact CZ2-CB 3.5Å; W254-S451 PolarHBondContact N-O 3.32Å; W254-S451 PolarHBondContact O-N 3.04Å; W254-A453 HydrophobicContact CH2-CB 3.45Å; W254-A453 VanDerWaalsContact CH2-CB 3.45Å; W254-A453 HydrophobicContact CZ3-CB 3.62Å
255	S	98.1	Very high	91.8	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	138.6	177.3	-173.6	0	0	0	0	111.9	Y192 P196 L197 V449 S450	Y192-S255 PolarHBondContact OH-OG 3.23Å; P196-S255 CarbonylContact C-O 3.52Å; P196-S255 VanDerWaalsContact CA-O 3.31Å; P196-S255 WeakPolarHBondContact CA-O 3.21Å; P196-S255 WeakPolarHBondContact CB-O 3.34Å; L197-S255 PolarHBondContact N-O 3.28Å; L197-S255 PolarHBondContact O-N 2.79Å; S255-V449 CarbonylContact C-O 3.55Å; S255-V449 WeakPolarHBondContact CA-O 3.43Å; S255-V449 PolarHBondContact OG-O 2.65Å; S255-S450 PolarHBondContact OG-OG 3.37Å
256	R	98.1	Very high	90	Very high	53 Å²	53	45.1 Å²	45.1	20%	0.2	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	142.9	-177.6	-62.4	-64.6	-75.5	-152.7	-16.4	109.1	Y192 D299 R300 S445 A448 V449	Y192-R256 WeakPolarHBondContact CE1-O 3.35Å; Y192-R256 VanDerWaalsContact OH-C 3.27Å; Y192-R256 PolarHBondContact OH-O 3.22Å; R256-D299 WeakPolarHBondContact CB-OD2 3.32Å; R256-D299 IonicContact CZ-OD1 3.74Å; R256-D299 IonicContact NE-OD1 3.16Å; R256-D299 PolarHBondContact NE-OD1 3Å; R256-D299 IonicContact NE-OD2 3.97Å; R256-D299 IonicContact NH2-OD1 2.72Å; R256-D299 PolarHBondContact NH2-OD1 3.35Å; R256-R300 PolarHBondContact NH2-O 3.42Å; R256-R300 VanDerWaalsContact NH2-O 3.14Å; R256-S445 WeakPolarHBondContact CB-OG 3.35Å; R256-A448 CarbonylContact O-C 3.54Å; R256-A448 WeakPolarHBondContact O-CA 3.49Å; R256-V449 HydrophobicContact CB-CG1 4.23Å; R256-V449 PolarHBondContact N-O 2.85Å; R256-V449 PolarHBondContact O-N 3.43Å
257	H	97.3	Very high	88	Confident	7 Å²	7	44 Å²	44	3%	0.032	24%	0.235	C	C	.	.			trans	-81.4	-20.1	-173.2	61.4	-38	0	0	0	115.5	L165 I191 Y192 Q260 I297 D299	L165-H257 WeakPolarHBondContact CD2-CD2 3.31Å; L165-H257 VanDerWaalsContact CD2-NE2 3.34Å; L165-H257 WeakPolarHBondContact CD2-NE2 3.44Å; I191-H257 WeakPolarHBondContact CA-O 3.32Å; I191-H257 WeakPolarHBondContact CB-O 3.39Å; Y192-H257 HydrophobicContact CD1-CB 4.46Å; Y192-H257 HydrophobicContact CD2-CB 3.8Å; Y192-H257 HydrophobicContact CE1-CB 4.2Å; Y192-H257 HydrophobicContact CE2-CB 3.5Å; Y192-H257 VanDerWaalsContact CE2-CB 3.5Å; Y192-H257 HydrophobicContact CG-CB 4.29Å; Y192-H257 VanDerWaalsContact CZ-CA 3.46Å; Y192-H257 PolarHBondContact OH-N 2.83Å; H257-Q260 PolarHBondContact CD2-NE2 3.37Å; H257-I297 VanDerWaalsContact NE2-CG2 3.26Å; H257-I297 WeakPolarHBondContact NE2-CG2 3.05Å; H257-D299 IonicContact CE1-OD2 3.39Å; H257-D299 PolarHBondContact CE1-OD2 2.88Å; H257-D299 IonicContact CG-OD2 3.25Å; H257-D299 PolarHBondContact N-OD2 3Å; H257-D299 IonicContact ND1-OD2 3.75Å; H257-D299 PolarHBondContact ND1-OD2 3.38Å
258	G	97.2	Very high	85.8	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.261	C	S	.	.			trans	87.2	137.3	-170.6	0	0	0	0	0	112.3	Q260 D299 S445	G258-Q260 PolarHBondContact O-N 3.34Å; G258-Q260 PolarHBondContact O-NE2 3.08Å; G258-D299 PolarHBondContact N-OD2 3.12Å; G258-S445 WeakPolarHBondContact CA-O 3.33Å
259	E	96.2	Very high	83.5	Confident	41 Å²	41	49 Å²	49	19%	0.192	26%	0.261	C	S	.	.	S	Bend	trans	-58	129.3	177.6	-179.8	164.1	113.2	0	0	110.4	H298 D299 R300 K444 S445	E259-H298 IonicContact OE2-CG 3.73Å; E259-H298 IonicContact OE2-ND1 3.11Å; E259-H298 PolarHBondContact OE2-ND1 3.35Å; E259-D299 HydrophobicContact CB-CB 4.19Å; E259-R300 IonicContact OE1-NH2 3.06Å; E259-R300 PolarHBondContact OE1-NH2 3.29Å; E259-R300 IonicContact OE2-CZ 3.11Å; E259-R300 IonicContact OE2-NE 3.37Å; E259-R300 PolarHBondContact OE2-NE 2.89Å; E259-R300 IonicContact OE2-NH2 2.65Å; E259-R300 PolarHBondContact OE2-NH2 3.16Å; E259-R300 VanDerWaalsContact OE2-NH2 3.08Å; E259-K444 WeakPolarHBondContact OE1-CE 3.23Å; E259-K444 IonicContact OE1-NZ 2.83Å; E259-K444 PolarHBondContact OE1-NZ 3.44Å; E259-S445 PolarHBondContact N-O 2.85Å
260	Q	95.7	Very high	81.1	Confident	14 Å²	14	59.2 Å²	59.2	7%	0.065	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	170.7	-170.1	65.2	-172.7	-79.4	0	0	112	I191 Y192 H257 G258 I297	I191-Q260 HydrophobicContact CD1-CB 3.86Å; Y192-Q260 PolarHBondContact O-NE2 3.49Å; H257-Q260 PolarHBondContact CD2-NE2 3.37Å; G258-Q260 PolarHBondContact O-N 3.34Å; G258-Q260 PolarHBondContact O-NE2 3.08Å; Q260-I297 HydrophobicContact CG-CB 4.31Å; Q260-I297 PolarHBondContact N-O 2.9Å; Q260-I297 PolarHBondContact O-N 3.47Å
261	T	93	Very high	78.7	Confident	59 Å²	59	62.4 Å²	62.4	36%	0.362	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	139.9	170.1	59.8	0	0	0	0	111.4	Q294 I295	T261-Q294 VanDerWaalsContact CB-OE1 3.29Å; T261-Q294 PolarHBondContact OG1-OE1 3.28Å; T261-I295 CarbonylContact C-O 3.45Å; T261-I295 VanDerWaalsContact CA-O 3.25Å; T261-I295 WeakPolarHBondContact CA-O 3.23Å
262	I	86.4	Confident	76.3	Confident	19 Å²	19	71.2 Å²	71.2	10%	0.097	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	130.2	176.4	-58.7	-178.9	0	0	0	108.8	L165 E166 Q294 I295 I297	L165-I262 HydrophobicContact CB-CD1 3.67Å; L165-I262 HydrophobicContact CD1-CD1 3.63Å; L165-I262 HydrophobicContact CG-CD1 4.29Å; E166-I262 HydrophobicContact CG-CD1 4.5Å; E166-I262 WeakPolarHBondContact OE1-CD1 3.31Å; I262-Q294 CarbonylContact O-C 3.52Å; I262-Q294 VanDerWaalsContact O-CA 3.23Å; I262-Q294 WeakPolarHBondContact O-CA 3.5Å; I262-I295 HydrophobicContact CB-CG1 4.11Å; I262-I295 PolarHBondContact N-O 2.83Å; I262-I295 PolarHBondContact O-N 2.71Å; I262-I297 HydrophobicContact CB-CG1 4.48Å; I262-I297 HydrophobicContact CD1-CD1 4.11Å; I262-I297 HydrophobicContact CD1-CG1 3.51Å; I262-I297 HydrophobicContact CG1-CG1 3.73Å
263	P	83.1	Confident	73.8	Confident	40 Å²	40	79.2 Å²	79.2	26%	0.26	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	134.6	174.5	29.5	-34	0	0	0	110.8	F265 Q294	P263-F265 PolarHBondContact O-N 2.97Å; P263-Q294 HydrophobicContact CB-CG 4.36Å
264	L	73.2	Confident	71.2	Confident	84 Å²	84	89.3 Å²	89.3	44%	0.44	42%	0.418	S	S	.	.	S	Bend	trans	-66.7	-20.9	177.7	-73.8	-176.9	0	0	0	113.4	R293 I295	L264-R293 HydrophobicContact CB-CB 4.27Å; L264-R293 HydrophobicContact CD1-CB 3.65Å; L264-R293 HydrophobicContact CG-CB 4.2Å; L264-R293 PolarHBondContact N-O 2.89Å; L264-I295 HydrophobicContact CD1-CG2 4.43Å; L264-I295 HydrophobicContact CD2-CB 4.48Å; L264-I295 HydrophobicContact CD2-CD1 4.36Å; L264-I295 HydrophobicContact CD2-CG1 4.29Å; L264-I295 HydrophobicContact CD2-CG2 3.5Å; L264-I295 VanDerWaalsContact CD2-CG2 3.5Å; L264-I295 HydrophobicContact CG-CG2 4.08Å
265	F	65.4	Low	68.8	Low	137 Å²	137	91.3 Å²	91.3	60%	0.601	44%	0.436	S	S	*	.	S	Bend	trans	-124.9	130	176.6	-57.5	-76.1	0	0	0	109.4	P263 T267	P263-F265 PolarHBondContact O-N 2.97Å; F265-T267 PolarHBondContact O-N 3.14Å
266	P	54.8	Low	66.5	Low	113 Å²	113	98.1 Å²	98.1	73%	0.734	47%	0.471	S	S	*	.			trans	-63.4	106.6	173.6	23.9	-30.3	0	0	0	108.5	T268	P266-T268 PolarHBondContact O-N 2.58Å
267	T	50	Low	63.7	Low	105 Å²	105	102.9 Å²	102.9	64%	0.644	50%	0.5	S	S	*	.			trans	-69.5	80.8	171.4	54.8	0	0	0	0	108.1	F265 M269	F265-T267 PolarHBondContact O-N 3.14Å; T267-M269 PolarHBondContact O-N 3.06Å
268	T	46.2	Very low	60.8	Low	92 Å²	92	106.1 Å²	106.1	56%	0.564	54%	0.536	S	S	*	.			trans	-62.8	125.1	163.4	59.6	0	0	0	0	106.6	P266 R270 S271	P266-T268 PolarHBondContact O-N 2.58Å; T268-R270 PolarHBondContact O-N 2.86Å; T268-S271 PolarHBondContact O-N 2.87Å
269	M	44.4	Very low	57.9	Low	140 Å²	140	109.8 Å²	109.8	69%	0.69	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.5	-12.5	178.1	-72.9	-70	-174.6	0	0	113.2	T267 S271	T267-M269 PolarHBondContact O-N 3.06Å; M269-S271 VanDerWaalsContact C-N 3.32Å; M269-S271 PolarHBondContact O-N 3.29Å
270	R	43	Very low	55.8	Low	224 Å²	224	115.4 Å²	115.4	85%	0.845	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.1	-22.9	172.8	-81.5	-174.5	173.2	179.5	-1.8	114.4	T268	T268-R270 PolarHBondContact O-N 2.86Å
271	S	43.2	Very low	53.4	Low	74 Å²	74	119.1 Å²	119.1	52%	0.517	61%	0.614	S	S	.	*	S	Bend	trans	-85.6	-20.1	-179.8	-147	0	0	0	0	113.9	T268 M269 R273	T268-S271 PolarHBondContact O-N 2.87Å; M269-S271 VanDerWaalsContact C-N 3.32Å; M269-S271 PolarHBondContact O-N 3.29Å; S271-R273 VanDerWaalsContact C-N 3.32Å; S271-R273 PolarHBondContact O-N 3.11Å
272	R	45.2	Very low	51.1	Low	186 Å²	186	120.2 Å²	120.2	70%	0.702	62%	0.618	S	S	*	*	G	3₁₀ helix	trans	-71.6	-21.1	177.9	-97.2	-176	-178.8	164.3	0.4	114
273	R	43.2	Very low	49.3	Very low	224 Å²	224	124.2 Å²	124.2	85%	0.845	64%	0.643	S	S	*	*	G	3₁₀ helix	trans	-81	-8.6	179.6	-80.1	-171.5	-170	163.5	3.5	114.9	S271	S271-R273 VanDerWaalsContact C-N 3.32Å; S271-R273 PolarHBondContact O-N 3.11Å
274	R	44.4	Very low	47.7	Very low	211 Å²	211	128.4 Å²	128.4	80%	0.796	67%	0.667	S	S	*	*	G	3₁₀ helix	trans	-95.1	-3.9	-179.9	-99.5	-168.4	-74.6	172.4	-2.8	115.2
275	V	46.9	Very low	46.3	Very low	94 Å²	94	132.6 Å²	132.6	57%	0.57	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.6	19.1	-173.8	-167.4	0	0	0	0	112.5
276	I	49.1	Very low	45.2	Very low	143 Å²	143	126.3 Å²	126.3	73%	0.733	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.8	-6.5	179	-64.5	175.6	0	0	0	112.2
277	N	39.6	Very low	44.7	Very low	153 Å²	153	131.1 Å²	131.1	82%	0.818	66%	0.664	S	S	*	*	S	Bend	trans	-118.9	96.9	-178.9	-74.9	1.1	0	0	0	112.1
278	G	35.8	Very low	44.7	Very low	75 Å²	75	138 Å²	138	77%	0.773	68%	0.678	S	S	*	*	S	Bend	trans	87.6	94.4	151.4	0	0	0	0	0	116.7
279	C	37.1	Very low	44.9	Very low	78 Å²	78	137.5 Å²	137.5	53%	0.527	68%	0.683	S	S	.	*				174.6	128.7	119	-162.3	0	0	0	0	108.8	T281 D282	C279-T281 WeakPolarHBondContact CB-OG1 3.35Å; C279-T281 PolarHBondContact O-N 2.75Å; C279-T281 PolarHBondContact SG-OG1 2.84Å; C279-D282 PolarHBondContact O-N 2.9Å
280	I	52.3	Low	45.2	Very low	159 Å²	159	136.5 Å²	136.5	82%	0.815	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.5	-9.5	175	-76.1	168	0	0	0	112.1
281	T	45.4	Very low	45.5	Very low	92 Å²	92	128 Å²	128	56%	0.564	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.3	-17.9	177.8	60.6	0	0	0	0	114.8	C279 V283 M285	C279-T281 WeakPolarHBondContact CB-OG1 3.35Å; C279-T281 PolarHBondContact O-N 2.75Å; C279-T281 PolarHBondContact SG-OG1 2.84Å; T281-V283 VanDerWaalsContact C-N 3.3Å; T281-V283 PolarHBondContact O-N 2.87Å; T281-M285 PolarHBondContact O-N 3.01Å
282	D	43.9	Very low	46.4	Very low	82 Å²	82	126.7 Å²	126.7	44%	0.439	66%	0.66	S	S	.	*	H	α-helix	trans	-73.9	-19.3	-179.9	-87.2	-21.4	0	0	0	113.6	C279 V284 G286	C279-D282 PolarHBondContact O-N 2.9Å; D282-V284 VanDerWaalsContact C-N 3.33Å; D282-G286 VanDerWaalsContact O-CA 3.24Å; D282-G286 WeakPolarHBondContact O-CA 3.09Å; D282-G286 PolarHBondContact O-N 3.2Å
283	V	48.7	Very low	48	Very low	102 Å²	102	126 Å²	126	62%	0.618	66%	0.658	S	S	*	*	H	α-helix	trans	-74.5	-27.1	-179.5	-176.8	0	0	0	0	111.7	T281	T281-V283 VanDerWaalsContact C-N 3.3Å; T281-V283 PolarHBondContact O-N 2.87Å
284	V	49.7	Very low	50	Low	128 Å²	128	120.8 Å²	120.8	78%	0.776	64%	0.643	S	S	*	*	H	α-helix	trans	-105.1	-27	-171.1	-174.4	0	0	0	0	112.7	D282	D282-V284 VanDerWaalsContact C-N 3.33Å
285	M	43.8	Very low	52.1	Low	172 Å²	172	113.5 Å²	113.5	85%	0.847	62%	0.619	S	S	*	*	H	α-helix	trans	-114.5	-10.3	176.1	-67	-161.6	176.5	0	0	114.8	T281	T281-M285 PolarHBondContact O-N 3.01Å
286	G	42.5	Very low	54.3	Low	5 Å²	5	112.5 Å²	112.5	5%	0.052	61%	0.613	C	S	.	*	S	Bend	trans	-93	-16.8	-167.7	0	0	0	0	0	117.2	D282 R288 L290	D282-G286 VanDerWaalsContact O-CA 3.24Å; D282-G286 WeakPolarHBondContact O-CA 3.09Å; D282-G286 PolarHBondContact O-N 3.2Å; G286-R288 PolarHBondContact O-N 2.65Å; G286-L290 WeakPolarHBondContact O-CB 3.16Å; G286-L290 WeakPolarHBondContact O-CD1 3.25Å; G286-L290 VanDerWaalsContact O-CG 3.22Å; G286-L290 WeakPolarHBondContact O-CG 3.37Å; G286-L290 PolarHBondContact O-N 2.77Å
287	R	44.2	Very low	56.5	Low	214 Å²	214	106.3 Å²	106.3	81%	0.808	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.4	-25.3	-173.8	-71.6	-173.6	178	-123.4	1.1	115
288	R	50.6	Low	59.1	Low	250 Å²	250	102.6 Å²	102.6	94%	0.943	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.6	-22.9	177.1	-80.1	-175.3	-95.5	-158.7	-4.8	113.7	G286	G286-R288 PolarHBondContact O-N 2.65Å
289	A	49.1	Very low	62	Low	81 Å²	81	99 Å²	99	67%	0.669	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	-25	179.7	0	0	0	0	0	113.7
290	L	51	Low	64.7	Low	120 Å²	120	98.3 Å²	98.3	63%	0.628	51%	0.508	S	S	*	.	S	Bend	trans	-92.7	-3.2	179.5	-64.3	168.2	0	0	0	114.2	G286 G292	G286-L290 WeakPolarHBondContact O-CB 3.16Å; G286-L290 WeakPolarHBondContact O-CD1 3.25Å; G286-L290 VanDerWaalsContact O-CG 3.22Å; G286-L290 WeakPolarHBondContact O-CG 3.37Å; G286-L290 PolarHBondContact O-N 2.77Å; L290-G292 PolarHBondContact O-N 2.65Å; L290-G292 VanDerWaalsContact O-N 3.09Å
291	G	50.7	Low	66.8	Low	45 Å²	45	93 Å²	93	46%	0.464	48%	0.484	S	S	.	.	S	Bend	trans	-65.5	108.4	167.2	0	0	0	0	0	108.3	R293	G291-R293 PolarHBondContact O-N 3.12Å
292	G	62.2	Low	69.2	Low	46 Å²	46	90.9 Å²	90.9	47%	0.474	47%	0.469	S	S	.	.			trans	-54	103.6	179.7	0	0	0	0	0	109.5	L290 Q294	L290-G292 PolarHBondContact O-N 2.65Å; L290-G292 VanDerWaalsContact O-N 3.09Å; G292-Q294 PolarHBondContact O-N 2.83Å
293	R	77.1	Confident	71.7	Confident	173 Å²	173	87 Å²	87	65%	0.653	45%	0.448	S	S	*	.			trans	-56.8	135	-179	-65.6	-177.5	-179.2	-176.8	-0.6	108.4	L264 G291	L264-R293 HydrophobicContact CB-CB 4.27Å; L264-R293 HydrophobicContact CD1-CB 3.65Å; L264-R293 HydrophobicContact CG-CB 4.2Å; L264-R293 PolarHBondContact N-O 2.89Å; G291-R293 PolarHBondContact O-N 3.12Å
294	Q	86	Confident	74	Confident	114 Å²	114	82.7 Å²	82.7	53%	0.533	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	149.7	-178.9	-74.2	167.4	53.3	0	0	109.3	T261 I262 P263 G292	T261-Q294 VanDerWaalsContact CB-OE1 3.29Å; T261-Q294 PolarHBondContact OG1-OE1 3.28Å; I262-Q294 CarbonylContact O-C 3.52Å; I262-Q294 VanDerWaalsContact O-CA 3.23Å; I262-Q294 WeakPolarHBondContact O-CA 3.5Å; P263-Q294 HydrophobicContact CB-CG 4.36Å; G292-Q294 PolarHBondContact O-N 2.83Å
295	I	89.1	Confident	76.2	Confident	57 Å²	57	76.6 Å²	76.6	29%	0.292	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	139.6	168.1	54.3	173	0	0	0	108.8	E166 T261 I262 L264 I297	E166-I295 HydrophobicContact CB-CD1 4.29Å; E166-I295 HydrophobicContact CG-CD1 3.61Å; T261-I295 CarbonylContact C-O 3.45Å; T261-I295 VanDerWaalsContact CA-O 3.25Å; T261-I295 WeakPolarHBondContact CA-O 3.23Å; I262-I295 HydrophobicContact CB-CG1 4.11Å; I262-I295 PolarHBondContact N-O 2.83Å; I262-I295 PolarHBondContact O-N 2.71Å; L264-I295 HydrophobicContact CD1-CG2 4.43Å; L264-I295 HydrophobicContact CD2-CB 4.48Å; L264-I295 HydrophobicContact CD2-CD1 4.36Å; L264-I295 HydrophobicContact CD2-CG1 4.29Å; L264-I295 HydrophobicContact CD2-CG2 3.5Å; L264-I295 VanDerWaalsContact CD2-CG2 3.5Å; L264-I295 HydrophobicContact CG-CG2 4.08Å; I295-I297 HydrophobicContact CD1-CD1 3.78Å; I295-I297 HydrophobicContact CG1-CD1 4.05Å
296	T	92.8	Very high	78.7	Confident	74 Å²	74	69.4 Å²	69.4	45%	0.454	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	122.6	173	-55.2	0	0	0	0	108.9	H298	T296-H298 WeakPolarHBondContact CG2-CE1 3.13Å
297	I	94.7	Very high	81.2	Confident	12 Å²	12	69.9 Å²	69.9	6%	0.062	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	100.9	172.9	-53	-54.3	0	0	0	108	L165 E166 H257 Q260 I262 I295 D299	L165-I297 HydrophobicContact CB-CG2 4.38Å; E166-I297 HydrophobicContact CG-CD1 4.46Å; H257-I297 VanDerWaalsContact NE2-CG2 3.26Å; H257-I297 WeakPolarHBondContact NE2-CG2 3.05Å; Q260-I297 HydrophobicContact CG-CB 4.31Å; Q260-I297 PolarHBondContact N-O 2.9Å; Q260-I297 PolarHBondContact O-N 3.47Å; I262-I297 HydrophobicContact CB-CG1 4.48Å; I262-I297 HydrophobicContact CD1-CD1 4.11Å; I262-I297 HydrophobicContact CD1-CG1 3.51Å; I262-I297 HydrophobicContact CG1-CG1 3.73Å; I295-I297 HydrophobicContact CD1-CD1 3.78Å; I295-I297 HydrophobicContact CG1-CD1 4.05Å; I297-D299 PolarHBondContact O-N 2.74Å
298	H	94.6	Very high	83.4	Confident	75 Å²	75	60 Å²	60	35%	0.347	31%	0.314	S	S	.	.			trans	-73.1	124.6	176.9	-64.1	-55.2	0	0	0	111.5	K168 E259 T296 R300	K168-H298 PolarHBondContact NZ-O 2.89Å; E259-H298 IonicContact OE2-CG 3.73Å; E259-H298 IonicContact OE2-ND1 3.11Å; E259-H298 PolarHBondContact OE2-ND1 3.35Å; T296-H298 WeakPolarHBondContact CG2-CE1 3.13Å; H298-R300 HydrophobicContact CB-CG 4.28Å; H298-R300 PolarHBondContact CE1-NH2 3.4Å; H298-R300 VanDerWaalsContact CE1-NH2 3.33Å; H298-R300 VanDerWaalsContact ND1-CZ 3.29Å; H298-R300 PolarHBondContact ND1-NE 3.24Å; H298-R300 PolarHBondContact ND1-NH2 2.89Å
299	D	95.8	Very high	85.1	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	28%	0.284	C	S	.	.			trans	-108.9	83.2	174.9	-170.4	-27.3	0	0	0	109.5	R256 H257 G258 E259 I297 S445	R256-D299 WeakPolarHBondContact CB-OD2 3.32Å; R256-D299 IonicContact CZ-OD1 3.74Å; R256-D299 IonicContact NE-OD1 3.16Å; R256-D299 PolarHBondContact NE-OD1 3Å; R256-D299 IonicContact NE-OD2 3.97Å; R256-D299 IonicContact NH2-OD1 2.72Å; R256-D299 PolarHBondContact NH2-OD1 3.35Å; H257-D299 IonicContact CE1-OD2 3.39Å; H257-D299 PolarHBondContact CE1-OD2 2.88Å; H257-D299 IonicContact CG-OD2 3.25Å; H257-D299 PolarHBondContact N-OD2 3Å; H257-D299 IonicContact ND1-OD2 3.75Å; H257-D299 PolarHBondContact ND1-OD2 3.38Å; G258-D299 PolarHBondContact N-OD2 3.12Å; E259-D299 HydrophobicContact CB-CB 4.19Å; I297-D299 PolarHBondContact O-N 2.74Å; D299-S445 PolarHBondContact O-N 3.11Å; D299-S445 WeakPolarHBondContact OD1-CB 3.45Å; D299-S445 PolarHBondContact OD1-OG 3.02Å; D299-S445 WeakPolarHBondContact OD2-CB 3.4Å
300	R	95.4	Very high	86.7	Confident	63 Å²	63	53.1 Å²	53.1	24%	0.238	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	152.8	-168.9	-60.9	177.7	-169.4	-173.3	-1.8	111.6	R256 E259 H298 W406 F443 K444	R256-R300 PolarHBondContact NH2-O 3.42Å; R256-R300 VanDerWaalsContact NH2-O 3.14Å; E259-R300 IonicContact OE1-NH2 3.06Å; E259-R300 PolarHBondContact OE1-NH2 3.29Å; E259-R300 IonicContact OE2-CZ 3.11Å; E259-R300 IonicContact OE2-NE 3.37Å; E259-R300 PolarHBondContact OE2-NE 2.89Å; E259-R300 IonicContact OE2-NH2 2.65Å; E259-R300 PolarHBondContact OE2-NH2 3.16Å; E259-R300 VanDerWaalsContact OE2-NH2 3.08Å; H298-R300 HydrophobicContact CB-CG 4.28Å; H298-R300 PolarHBondContact CE1-NH2 3.4Å; H298-R300 VanDerWaalsContact CE1-NH2 3.33Å; H298-R300 VanDerWaalsContact ND1-CZ 3.29Å; H298-R300 PolarHBondContact ND1-NE 3.24Å; H298-R300 PolarHBondContact ND1-NH2 2.89Å; R300-W406 HydrophobicContact CB-CE3 4.1Å; R300-W406 HydrophobicContact CB-CH2 3.99Å; R300-W406 HydrophobicContact CB-CZ3 3.61Å; R300-W406 HydrophobicContact CG-CE3 4.32Å; R300-W406 HydrophobicContact CG-CH2 3.84Å; R300-W406 HydrophobicContact CG-CZ2 4.2Å; R300-W406 HydrophobicContact CG-CZ3 3.91Å; R300-F443 CarbonylContact C-O 3.59Å; R300-F443 WeakPolarHBondContact CA-O 3.34Å; R300-K444 HydrophobicContact CG-CG 4.45Å
301	T	95.1	Very high	88.2	Confident	48 Å²	48	49.5 Å²	49.5	29%	0.294	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	118.4	163.3	-56.4	0	0	0	0	106.4	Q442 F443	T301-Q442 WeakPolarHBondContact O-CB 3.42Å; T301-F443 PolarHBondContact N-O 3.36Å; T301-F443 PolarHBondContact O-N 3.46Å
302	N	95.9	Very high	89.8	Confident	47 Å²	47	56.4 Å²	56.4	25%	0.251	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	173.6	-174.5	-66.3	-4.2	0	0	0	111.9	H304 C402 G403	N302-H304 PolarHBondContact O-N 2.81Å; N302-H304 PolarHBondContact O-ND1 3.45Å; N302-C402 HydrophobicContact CB-CB 4.28Å; N302-G403 PolarHBondContact ND2-O 3.46Å
303	C	96.4	Very high	90.9	Very high	0 Å²	0	58 Å²	58	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.3	129.9	177.5	-69	0	0	0	0	111.5	L390 L392 C402 V440 H441 Q442	C303-L390 HydrophobicContact CB-CD1 4.28Å; C303-L392 HydrophobicContact CB-CD2 4.4Å; C303-C402 HydrophobicContact CB-CB 4.3Å; C303-C402 WeakPolarHBondContact O-CB 3.23Å; C303-V440 HydrophobicContact CB-CG1 3.95Å; C303-H441 CarbonylContact C-O 3.56Å; C303-H441 VanDerWaalsContact CA-O 3.29Å; C303-H441 WeakPolarHBondContact CA-O 3.25Å; C303-Q442 PolarHBondContact SG-OE1 3.01Å
304	H	97.1	Very high	91.5	Very high	12 Å²	12	52.1 Å²	52.1	6%	0.056	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	165	174.9	60	-75.1	0	0	0	110	N302 P398 Q401 V440 H441	N302-H304 PolarHBondContact O-N 2.81Å; N302-H304 PolarHBondContact O-ND1 3.45Å; H304-P398 HydrophobicContact CB-CB 4.23Å; H304-P398 WeakPolarHBondContact CB-O 3.44Å; H304-Q401 VanDerWaalsContact CA-OE1 3.27Å; H304-Q401 HydrophobicContact CB-CB 4.32Å; H304-Q401 HydrophobicContact CB-CG 4.43Å; H304-Q401 VanDerWaalsContact CB-OE1 3.28Å; H304-V440 CarbonylContact O-C 3.47Å; H304-V440 VanDerWaalsContact O-CA 3.26Å; H304-V440 WeakPolarHBondContact O-CA 3.37Å; H304-H441 AromaticContact CD2-CE1 3.99Å; H304-H441 AromaticContact CD2-NE2 3.73Å; H304-H441 AromaticContact CE1-CD2 3.68Å; H304-H441 AromaticContact CE1-NE2 3.56Å; H304-H441 PolarHBondContact N-O 2.89Å; H304-H441 PolarHBondContact ND1-O 2.8Å; H304-H441 AromaticContact NE2-CD2 3.75Å; H304-H441 AromaticContact NE2-CE1 3.85Å; H304-H441 AromaticContact NE2-NE2 3.13Å; H304-H441 PolarHBondContact NE2-NE2 2.8Å; H304-H441 VanDerWaalsContact NE2-NE2 3.13Å; H304-H441 PolarHBondContact O-N 3.15Å; H304-H441 PolarHBondContact O-ND1 2.81Å
305	A	96.6	Very high	91.7	Very high	1 Å²	1	49 Å²	49	1%	0.008	27%	0.268	C	S	.	.			trans	-117.5	144	163.1	0	0	0	0	0	108.9	H307 Y383 Q401 V440	A305-H307 PolarHBondContact O-CE1 2.86Å; A305-H307 PolarHBondContact O-ND1 2.77Å; A305-Y383 HydrophobicContact CB-CD2 4.49Å; A305-Y383 HydrophobicContact CB-CE2 3.67Å; A305-Q401 PolarHBondContact O-NE2 2.93Å; A305-Q401 VanDerWaalsContact O-NE2 3.16Å; A305-Q401 PolarHBondContact O-OE1 3.34Å; A305-V440 HydrophobicContact CB-CG2 4.41Å
306	D	96	Very high	92	Very high	20 Å²	20	46.9 Å²	46.9	11%	0.107	26%	0.258	C	S	.	.			trans	-77.6	132.3	177.1	-76.5	-60.6	0	0	0	110.9	T316 T317 A319 H441 H455	D306-T316 CarbonylContact O-C 3.58Å; D306-T316 VanDerWaalsContact O-CA 3.28Å; D306-T316 WeakPolarHBondContact O-CA 3.23Å; D306-T317 HydrophobicContact CB-CG2 4.08Å; D306-T317 PolarHBondContact O-N 2.83Å; D306-A319 HydrophobicContact CB-CB 4.27Å; D306-A319 WeakPolarHBondContact OD2-CB 3.49Å; D306-H441 IonicContact OD2-CE1 3.73Å; D306-H441 PolarHBondContact OD2-CE1 3.32Å; D306-H441 IonicContact OD2-NE2 2.78Å; D306-H455 WeakPolarHBondContact CB-NE2 3.36Å; D306-H455 VanDerWaalsContact CG-NE2 3.32Å; D306-H455 IonicContact OD1-CD2 3.82Å; D306-H455 IonicContact OD1-CE1 3.73Å; D306-H455 IonicContact OD1-NE2 2.84Å; D306-H455 PolarHBondContact OD1-NE2 3.03Å
307	H	94	Very high	92.1	Very high	16 Å²	16	43.5 Å²	43.5	7%	0.074	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	151	175.7	-56.8	91.2	0	0	0	110.3	A305 R314 H315 Y383 Q401 H455	A305-H307 PolarHBondContact O-CE1 2.86Å; A305-H307 PolarHBondContact O-ND1 2.77Å; H307-R314 HydrophobicContact CB-CG 3.79Å; H307-H315 CarbonylContact C-O 3.51Å; H307-H315 WeakPolarHBondContact CA-O 3.46Å; H307-H315 WeakPolarHBondContact CB-O 3.22Å; H307-Y383 PolarHBondContact NE2-OH 2.98Å; H307-Y383 VanDerWaalsContact NE2-OH 3.09Å; H307-Q401 PolarHBondContact CE1-NE2 3.36Å; H307-Q401 VanDerWaalsContact CE1-NE2 3.33Å; H307-Q401 PolarHBondContact ND1-NE2 2.83Å; H307-H455 PolarHBondContact O-CE1 3.35Å
308	A	91.2	Very high	92.3	Very high	5 Å²	5	42.9 Å²	42.9	4%	0.041	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	163.2	164.5	0	0	0	0	0	109.4	R314 H315 T317	A308-R314 WeakPolarHBondContact O-CA 3.26Å; A308-H315 PolarHBondContact N-O 2.89Å; A308-H315 PolarHBondContact O-N 3.14Å; A308-H315 VanDerWaalsContact O-N 3.09Å; A308-T317 HydrophobicContact CB-CG2 4.14Å
309	D	86.7	Confident	92.5	Very high	60 Å²	60	39.7 Å²	39.7	32%	0.321	22%	0.221	S	C	.	.	S	Bend	trans	61.3	169.9	-174.9	-57.1	-34.2	0	0	0	114	H315 R457	D309-H315 IonicContact OD2-CD2 3.3Å; D309-H315 IonicContact OD2-NE2 2.64Å; D309-H315 PolarHBondContact OD2-NE2 2.9Å; D309-R457 IonicContact OD1-CZ 2.96Å; D309-R457 IonicContact OD1-NH1 3.73Å; D309-R457 PolarHBondContact OD1-NH1 2.71Å; D309-R457 IonicContact OD1-NH2 2.87Å; D309-R457 PolarHBondContact OD1-NH2 3.22Å; D309-R457 IonicContact OD2-CZ 2.63Å; D309-R457 IonicContact OD2-NH1 3.67Å; D309-R457 PolarHBondContact OD2-NH1 3.44Å
310	D	81.6	Confident	92.6	Very high	127 Å²	127	39.8 Å²	39.8	68%	0.679	22%	0.221	S	C	*	.			trans	-115.4	166.5	-174.3	-64.4	-48.1	0	0	0	111.8	L312 S313 R314	D310-L312 PolarHBondContact O-N 2.94Å; D310-S313 PolarHBondContact O-N 2.91Å; D310-S313 PolarHBondContact O-OG 3.49Å; D310-R314 PolarHBondContact O-N 3.34Å
311	G	84.2	Confident	92.7	Very high	44 Å²	44	36.8 Å²	36.8	45%	0.454	21%	0.21	S	C	.	.	G	3₁₀ helix	trans	53.8	-133.5	172.5	0	0	0	0	0	113.4	S313 R314 M395	G311-S313 VanDerWaalsContact C-N 3.27Å; G311-S313 PolarHBondContact O-N 3Å; G311-R314 WeakPolarHBondContact O-CB 3.23Å; G311-R314 PolarHBondContact O-N 3.22Å; G311-M395 WeakPolarHBondContact O-CE 3.34Å
312	L	84.3	Confident	92.9	Very high	191 Å²	191	34.5 Å²	34.5	100%	1	20%	0.196	S	C	*	.	G	3₁₀ helix	trans	-70.9	-19.1	-177.1	-63.8	174.7	0	0	0	113.9	D310 R314	D310-L312 PolarHBondContact O-N 2.94Å; L312-R314 VanDerWaalsContact C-N 3.3Å
313	S	85.3	Confident	93	Very high	78 Å²	78	32.2 Å²	32.2	55%	0.545	18%	0.184	S	C	.	.	G	3₁₀ helix	trans	-83	-7.5	175.6	39.3	0	0	0	0	113.5	D310 G311 H315	D310-S313 PolarHBondContact O-N 2.91Å; D310-S313 PolarHBondContact O-OG 3.49Å; G311-S313 VanDerWaalsContact C-N 3.27Å; G311-S313 PolarHBondContact O-N 3Å; S313-H315 PolarHBondContact O-CD2 3.07Å; S313-H315 PolarHBondContact O-N 3.17Å
314	R	88.5	Confident	93	Very high	51 Å²	51	32.4 Å²	32.4	19%	0.192	19%	0.185	C	C	.	.			trans	-60.3	125.6	-175	-172.6	170.2	-179.6	134.3	-3.7	111.3	H307 A308 D310 G311 L312 I394 M395 E396	H307-R314 HydrophobicContact CB-CG 3.79Å; A308-R314 WeakPolarHBondContact O-CA 3.26Å; D310-R314 PolarHBondContact O-N 3.34Å; G311-R314 WeakPolarHBondContact O-CB 3.23Å; G311-R314 PolarHBondContact O-N 3.22Å; L312-R314 VanDerWaalsContact C-N 3.3Å; R314-I394 WeakPolarHBondContact CD-O 3.22Å; R314-I394 VanDerWaalsContact CZ-O 3.27Å; R314-I394 PolarHBondContact NE-O 2.82Å; R314-I394 PolarHBondContact NH2-O 3.21Å; R314-M395 PolarHBondContact NH1-O 2.82Å; R314-E396 PolarHBondContact NH2-O 3.13Å
315	H	91.4	Very high	93	Very high	47 Å²	47	31.9 Å²	31.9	22%	0.218	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	156.2	-178.9	68.4	67.6	0	0	0	110.6	H307 A308 D309 S313 Y462	H307-H315 CarbonylContact C-O 3.51Å; H307-H315 WeakPolarHBondContact CA-O 3.46Å; H307-H315 WeakPolarHBondContact CB-O 3.22Å; A308-H315 PolarHBondContact N-O 2.89Å; A308-H315 PolarHBondContact O-N 3.14Å; A308-H315 VanDerWaalsContact O-N 3.09Å; D309-H315 IonicContact OD2-CD2 3.3Å; D309-H315 IonicContact OD2-NE2 2.64Å; D309-H315 PolarHBondContact OD2-NE2 2.9Å; S313-H315 PolarHBondContact O-CD2 3.07Å; S313-H315 PolarHBondContact O-N 3.17Å; H315-Y462 AromaticContact CE1-CE1 3.74Å; H315-Y462 AromaticContact CE1-CZ 3.73Å; H315-Y462 PolarHBondContact CE1-OH 2.93Å; H315-Y462 AromaticContact NE2-CE1 3.75Å; H315-Y462 PolarHBondContact NE2-OH 2.88Å
316	T	94.1	Very high	92.9	Very high	13 Å²	13	31.9 Å²	31.9	8%	0.08	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	147.2	174.7	51.9	0	0	0	0	111	D306 Y383 N438	D306-T316 CarbonylContact O-C 3.58Å; D306-T316 VanDerWaalsContact O-CA 3.28Å; D306-T316 WeakPolarHBondContact O-CA 3.23Å; T316-Y383 HydrophobicContact CG2-CE1 3.92Å; T316-Y383 HydrophobicContact CG2-CE2 3.83Å; T316-Y383 WeakPolarHBondContact CG2-OH 3.44Å; T316-N438 WeakPolarHBondContact CB-OD1 3.2Å; T316-N438 WeakPolarHBondContact CG2-OD1 3.28Å; T316-N438 PolarHBondContact OG1-OD1 3.24Å
317	T	96.1	Very high	92.6	Very high	3 Å²	3	32.4 Å²	32.4	2%	0.018	18%	0.183	C	C	.	.			trans	-134.7	160.7	-178.5	-167.3	0	0	0	0	110.4	D306 A308 R437 H455 V456	D306-T317 HydrophobicContact CB-CG2 4.08Å; D306-T317 PolarHBondContact O-N 2.83Å; A308-T317 HydrophobicContact CB-CG2 4.14Å; T317-R437 WeakPolarHBondContact O-CA 3.47Å; T317-H455 HydrophobicContact CG2-CB 3.61Å; T317-V456 PolarHBondContact OG1-O 3.32Å
318	A	97.8	Very high	91.9	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	150.9	171.2	0	0	0	0	0	109.6	F117 I435 H455 V456 L458 Y461	F117-A318 HydrophobicContact CE1-CB 4.1Å; F117-A318 HydrophobicContact CZ-CB 4.43Å; A318-I435 CarbonylContact C-O 3.11Å; A318-I435 WeakPolarHBondContact CA-O 3.31Å; A318-I435 WeakPolarHBondContact CB-O 3.01Å; A318-H455 CarbonylContact O-C 3.59Å; A318-H455 WeakPolarHBondContact O-CA 3.05Å; A318-V456 HydrophobicContact CB-CG1 3.68Å; A318-V456 PolarHBondContact N-O 3.47Å; A318-V456 PolarHBondContact O-N 3.27Å; A318-L458 HydrophobicContact CB-CD1 3.92Å; A318-L458 HydrophobicContact CB-CG 4.34Å; A318-Y461 HydrophobicContact CB-CE2 4.18Å
319	A	98.1	Very high	91.1	Very high	8 Å²	8	36.3 Å²	36.3	7%	0.066	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	148.1	179.3	0	0	0	0	0	111.6	D306 F434 I435	D306-A319 HydrophobicContact CB-CB 4.27Å; D306-A319 WeakPolarHBondContact OD2-CB 3.49Å; A319-F434 CarbonylContact O-C 3.53Å; A319-F434 WeakPolarHBondContact O-CA 3.48Å; A319-I435 HydrophobicContact CB-CB 4.39Å; A319-I435 PolarHBondContact N-O 3.46Å; A319-I435 PolarHBondContact O-N 2.82Å
320	V	98.7	Very high	89.8	Confident	1 Å²	1	40.6 Å²	40.6	1%	0.006	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	138.3	178.4	-174	0	0	0	0	108.2	L227 V230 Y433 F434 A453 W454 V456	L227-V320 HydrophobicContact CD2-CG1 3.88Å; V230-V320 HydrophobicContact CB-CG2 4.14Å; V230-V320 HydrophobicContact CG2-CG1 4.32Å; V230-V320 HydrophobicContact CG2-CG2 3.91Å; V320-Y433 WeakPolarHBondContact CA-O 3.46Å; V320-F434 HydrophobicContact CB-CD1 4.32Å; V320-F434 HydrophobicContact CG1-CD1 3.74Å; V320-F434 HydrophobicContact CG1-CE1 3.63Å; V320-F434 HydrophobicContact CG2-CD1 4.03Å; V320-F434 HydrophobicContact CG2-CE1 4.48Å; V320-A453 WeakPolarHBondContact O-CA 3.32Å; V320-A453 VanDerWaalsContact O-CB 3.23Å; V320-A453 WeakPolarHBondContact O-CB 3.37Å; V320-W454 HydrophobicContact CB-CD2 4.02Å; V320-W454 HydrophobicContact CB-CG 4.3Å; V320-W454 HydrophobicContact CB-CZ2 3.92Å; V320-W454 HydrophobicContact CG1-CD2 4.36Å; V320-W454 HydrophobicContact CG1-CH2 3.96Å; V320-W454 HydrophobicContact CG1-CZ2 3.42Å; V320-W454 VanDerWaalsContact CG1-CZ2 3.42Å; V320-W454 PolarHBondContact N-O 3.14Å; V320-W454 PolarHBondContact O-N 3.02Å; V320-V456 HydrophobicContact CG2-CB 4.47Å; V320-V456 HydrophobicContact CG2-CG1 3.93Å
321	G	98.5	Very high	88.3	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	148.3	173.5	0	0	0	0	0	113.3	I432 Y433 I452	G321-I432 CarbonylContact O-C 3.57Å; G321-I432 VanDerWaalsContact O-CA 3.23Å; G321-I432 WeakPolarHBondContact O-CA 3.34Å; G321-Y433 PolarHBondContact N-O 2.9Å; G321-Y433 WeakPolarHBondContact O-CD1 3.36Å; G321-Y433 PolarHBondContact O-N 2.94Å; G321-I452 CarbonylContact C-O 3.55Å; G321-I452 WeakPolarHBondContact CA-O 3.48Å
322	L	98.2	Very high	86.8	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	132.1	178.6	179.5	153.7	0	0	0	108.8	A141 M144 L227 K324 I432 S451 I452	A141-L322 HydrophobicContact CB-CD1 3.77Å; A141-L322 HydrophobicContact CB-CD2 4.04Å; A141-L322 HydrophobicContact CB-CG 3.61Å; M144-L322 HydrophobicContact CG-CD1 3.68Å; M144-L322 HydrophobicContact CG-CD2 4.07Å; M144-L322 HydrophobicContact CG-CG 4.46Å; M144-L322 HydrophobicContact SD-CD1 4.38Å; L227-L322 HydrophobicContact CD1-CD1 3.7Å; L322-K324 HydrophobicContact CD2-CG 3.89Å; L322-I432 HydrophobicContact CB-CG2 4.22Å; L322-I432 HydrophobicContact CD1-CG2 4.2Å; L322-I432 HydrophobicContact CG-CG2 4.07Å; L322-S451 WeakPolarHBondContact O-CA 3.31Å; L322-I452 HydrophobicContact CB-CB 4.31Å; L322-I452 HydrophobicContact CD2-CD1 4.4Å; L322-I452 PolarHBondContact N-O 2.73Å; L322-I452 PolarHBondContact O-N 3.08Å
323	L	98.3	Very high	85.1	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	128.6	-173.5	-59.1	179.3	0	0	0	112.6	V372 K373 L427 N430 D431 Y433 V449 S451	L323-V372 HydrophobicContact CB-CG2 4.2Å; L323-V372 HydrophobicContact CD1-CG2 3.79Å; L323-K373 HydrophobicContact CD1-CD 4.37Å; L323-K373 HydrophobicContact CD1-CG 4.48Å; L323-K373 HydrophobicContact CD2-CD 4.1Å; L323-K373 VanDerWaalsContact CD2-CE 3.47Å; L323-L427 HydrophobicContact CD1-CB 3.51Å; L323-L427 HydrophobicContact CD1-CD1 3.79Å; L323-L427 HydrophobicContact CD1-CG 4.28Å; L323-N430 WeakPolarHBondContact O-CA 3.47Å; L323-N430 PolarHBondContact O-N 3.4Å; L323-D431 PolarHBondContact N-O 3.5Å; L323-Y433 HydrophobicContact CD1-CD1 4.13Å; L323-Y433 HydrophobicContact CD1-CE1 4.05Å; L323-Y433 HydrophobicContact CD2-CE1 3.88Å; L323-Y433 HydrophobicContact CG-CD1 4.17Å; L323-Y433 HydrophobicContact CG-CE1 3.87Å; L323-V449 HydrophobicContact CB-CG2 4.33Å; L323-V449 HydrophobicContact CD2-CG2 4.16Å; L323-S451 WeakPolarHBondContact CD2-OG 3.28Å
324	K	96.6	Very high	83	Confident	4 Å²	4	39.9 Å²	39.9	2%	0.017	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	115	170.7	-68	-58.7	-62.5	131.6	0	110.3	M144 P145 L147 L322 D429 N430 V449 S450	M144-K324 HydrophobicContact CB-CD 4Å; M144-K324 HydrophobicContact CB-CG 4.22Å; M144-K324 WeakPolarHBondContact O-CE 3.18Å; P145-K324 WeakPolarHBondContact O-CE 3.46Å; L147-K324 HydrophobicContact CD1-CB 3.98Å; L147-K324 HydrophobicContact CD1-CG 3.99Å; L147-K324 HydrophobicContact CG-CB 4.04Å; L147-K324 HydrophobicContact CG-CG 3.98Å; L322-K324 HydrophobicContact CD2-CG 3.89Å; K324-D429 WeakPolarHBondContact CA-OD1 3.45Å; K324-D429 IonicContact NZ-OD1 3.5Å; K324-D429 PolarHBondContact NZ-OD1 2.9Å; K324-D429 IonicContact NZ-OD2 3.95Å; K324-D429 PolarHBondContact NZ-OD2 3.24Å; K324-N430 PolarHBondContact NZ-OD1 2.84Å; K324-V449 CarbonylContact O-C 3.53Å; K324-V449 WeakPolarHBondContact O-CA 3.37Å; K324-S450 PolarHBondContact N-O 2.97Å; K324-S450 PolarHBondContact O-N 3.11Å
325	A	96	Very high	80.7	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	142.3	170.9	0	0	0	0	0	110.3	Y327 V372 D429	A325-Y327 HydrophobicContact CB-CD2 4.08Å; A325-Y327 HydrophobicContact CB-CE2 3.37Å; A325-Y327 VanDerWaalsContact O-CD2 3.24Å; A325-Y327 WeakPolarHBondContact O-CD2 3.25Å; A325-Y327 PolarHBondContact O-N 2.78Å; A325-V372 HydrophobicContact CB-CG1 3.8Å; A325-D429 HydrophobicContact CB-CB 3.59Å; A325-D429 PolarHBondContact N-OD1 3.24Å
326	V	95.1	Very high	78.1	Confident	1 Å²	1	47.9 Å²	47.9	1%	0.006	27%	0.267	C	S	.	.			trans	-75.9	123.9	176.2	174.8	0	0	0	0	108.8	L148 V183 Y187 Y192 P328 R370 A448	L148-V326 HydrophobicContact CD1-CG1 4Å; L148-V326 HydrophobicContact CD1-CG2 3.85Å; L148-V326 HydrophobicContact CG-CG2 4.48Å; V183-V326 HydrophobicContact CG1-CG1 4.01Å; Y187-V326 HydrophobicContact CD2-CG1 4.31Å; Y187-V326 HydrophobicContact CE2-CG1 4.33Å; Y187-V326 VanDerWaalsContact CE2-O 3.31Å; Y187-V326 WeakPolarHBondContact CE2-O 3.45Å; Y187-V326 PolarHBondContact OH-O 2.89Å; Y187-V326 VanDerWaalsContact OH-O 3.1Å; Y192-V326 HydrophobicContact CD1-CG1 4.44Å; Y192-V326 HydrophobicContact CE1-CG2 4.36Å; V326-P328 HydrophobicContact CG1-CG 4.12Å; V326-R370 PolarHBondContact O-NH2 3.45Å; V326-R370 VanDerWaalsContact O-NH2 3.14Å; V326-A448 HydrophobicContact CB-CB 3.87Å; V326-A448 HydrophobicContact CG2-CB 4.19Å; V326-A448 PolarHBondContact N-O 2.9Å
327	Y	89.9	Confident	75.5	Confident	32 Å²	32	49 Å²	49	13%	0.125	27%	0.272	C	S	.	.			trans	-132.9	85.4	175.6	-64.8	-76.7	0	0	0	110	A325 H329 Y339	A325-Y327 HydrophobicContact CB-CD2 4.08Å; A325-Y327 HydrophobicContact CB-CE2 3.37Å; A325-Y327 VanDerWaalsContact O-CD2 3.24Å; A325-Y327 WeakPolarHBondContact O-CD2 3.25Å; A325-Y327 PolarHBondContact O-N 2.78Å; Y327-H329 PolarHBondContact O-N 3.48Å; Y327-Y339 HydrophobicContact CD1-CD2 4.12Å; Y327-Y339 HydrophobicContact CD1-CG 4.3Å; Y327-Y339 HydrophobicContact CD2-CD1 4.41Å; Y327-Y339 HydrophobicContact CD2-CG 4.03Å; Y327-Y339 HydrophobicContact CE1-CD1 4.34Å; Y327-Y339 AromaticContact CE1-CD2 3.75Å; Y327-Y339 HydrophobicContact CE1-CD2 3.75Å; Y327-Y339 AromaticContact CE1-CE2 3.98Å; Y327-Y339 HydrophobicContact CE1-CE2 3.98Å; Y327-Y339 AromaticContact CE1-CG 3.95Å; Y327-Y339 HydrophobicContact CE1-CG 3.95Å; Y327-Y339 AromaticContact CE2-CD1 3.63Å; Y327-Y339 HydrophobicContact CE2-CD1 3.63Å; Y327-Y339 HydrophobicContact CE2-CD2 4.31Å; Y327-Y339 HydrophobicContact CE2-CE1 4.28Å; Y327-Y339 AromaticContact CE2-CG 3.65Å; Y327-Y339 HydrophobicContact CE2-CG 3.65Å; Y327-Y339 HydrophobicContact CG-CG 4.34Å; Y327-Y339 AromaticContact CZ-CD1 3.6Å; Y327-Y339 AromaticContact CZ-CD2 3.87Å; Y327-Y339 AromaticContact CZ-CE1 3.83Å; Y327-Y339 AromaticContact CZ-CG 3.63Å; Y327-Y339 WeakPolarHBondContact OH-CE1 3.46Å
328	P	79.6	Confident	72.9	Confident	18 Å²	18	50.6 Å²	50.6	12%	0.117	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-51.3	126	175.7	-37.8	47.5	0	0	0	112.8	Q184 Y187 V326 R330	Q184-P328 HydrophobicContact CB-CB 4.11Å; Q184-P328 HydrophobicContact CG-CB 3.8Å; Q184-P328 HydrophobicContact CG-CG 4.31Å; Y187-P328 HydrophobicContact CD1-CG 3.85Å; Y187-P328 HydrophobicContact CD2-CG 3.81Å; Y187-P328 HydrophobicContact CE1-CG 4.43Å; Y187-P328 HydrophobicContact CE2-CG 4.39Å; Y187-P328 HydrophobicContact CG-CG 3.51Å; V326-P328 HydrophobicContact CG1-CG 4.12Å; P328-R330 PolarHBondContact O-N 2.84Å
329	H	74.1	Confident	70.4	Confident	84 Å²	84	53 Å²	53	39%	0.389	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-62.3	124.6	166.7	-172.2	66	0	0	0	109.3	Y327 E333	Y327-H329 PolarHBondContact O-N 3.48Å; H329-E333 PolarHBondContact CE1-O 2.89Å
330	R	58.5	Low	67.5	Low	150 Å²	150	55.1 Å²	55.1	57%	0.566	31%	0.307	S	S	*	.	P	Polyproline II helix	trans	-87.6	123.3	172.9	-70.8	179.9	178.4	164.9	0.1	108.8	P328 G332 E333	P328-R330 PolarHBondContact O-N 2.84Å; R330-G332 PolarHBondContact O-N 2.92Å; R330-G332 VanDerWaalsContact O-N 3.09Å; R330-E333 HydrophobicContact CB-CG 4.3Å; R330-E333 VanDerWaalsContact CD-OE1 3.32Å; R330-E333 WeakPolarHBondContact CD-OE1 3.29Å; R330-E333 IonicContact NH1-OE1 3.21Å; R330-E333 PolarHBondContact NH1-OE1 3.08Å; R330-E333 VanDerWaalsContact NH1-OE1 3.08Å; R330-E333 PolarHBondContact O-N 2.78Å
331	P	50.8	Low	64.5	Low	126 Å²	126	57.8 Å²	57.8	82%	0.818	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	118.9	174.7	-20.8	30.5	0	0	0	110.3
332	G	52	Low	61.3	Low	80 Å²	80	62.1 Å²	62.1	83%	0.825	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	102.1	-6.6	177.5	0	0	0	0	0	116.1	R330	R330-G332 PolarHBondContact O-N 2.92Å; R330-G332 VanDerWaalsContact O-N 3.09Å
333	E	49.2	Very low	58.4	Low	74 Å²	74	64.7 Å²	64.7	35%	0.346	37%	0.373	S	S	.	.	S	Bend	trans	-81.7	112.7	161.9	-78.2	173.2	-176.4	0	0	107.5	H329 R330 S335 L337	H329-E333 PolarHBondContact CE1-O 2.89Å; R330-E333 HydrophobicContact CB-CG 4.3Å; R330-E333 VanDerWaalsContact CD-OE1 3.32Å; R330-E333 WeakPolarHBondContact CD-OE1 3.29Å; R330-E333 IonicContact NH1-OE1 3.21Å; R330-E333 PolarHBondContact NH1-OE1 3.08Å; R330-E333 VanDerWaalsContact NH1-OE1 3.08Å; R330-E333 PolarHBondContact O-N 2.78Å; E333-S335 PolarHBondContact O-N 2.77Å; E333-L337 WeakPolarHBondContact OE2-CD2 3.35Å
334	N	41.4	Very low	55.2	Low	145 Å²	145	67.9 Å²	67.9	78%	0.775	39%	0.394	S	S	*	.			trans	-48.3	141.5	164	-73.6	-21.9	0	0	0	107.4	E336	N334-E336 PolarHBondContact O-N 3.21Å
335	S	40.8	Very low	52.4	Low	91 Å²	91	74.1 Å²	74.1	64%	0.636	43%	0.427	S	S	*	.	S	Bend	trans	-66.6	40.2	-170.6	75.5	0	0	0	0	115	E333 L337	E333-S335 PolarHBondContact O-N 2.77Å; S335-L337 PolarHBondContact O-N 3.4Å
336	E	36.4	Very low	49.3	Very low	176 Å²	176	80.8 Å²	80.8	82%	0.822	46%	0.458	S	S	*	.			trans	-84.1	28	160.4	-63.2	-170.5	167.7	0	0	110.7	N334 P338	N334-E336 PolarHBondContact O-N 3.21Å; E336-P338 WeakPolarHBondContact O-CD 3.49Å; E336-P338 VanDerWaalsContact O-N 3.15Å
337	L	39.8	Very low	46.3	Very low	35 Å²	35	87.5 Å²	87.5	18%	0.183	49%	0.487	C	S	.	.			trans	-62.9	119.1	165.5	-79.5	174.8	0	0	0	106.7	E333 S335 Y339 S340 S341	E333-L337 WeakPolarHBondContact OE2-CD2 3.35Å; S335-L337 PolarHBondContact O-N 3.4Å; L337-Y339 PolarHBondContact O-N 2.81Å; L337-S340 CarbonylContact O-C 3.51Å; L337-S340 VanDerWaalsContact O-C 3.24Å; L337-S340 WeakPolarHBondContact O-CA 3.48Å; L337-S340 PolarHBondContact O-N 3.09Å; L337-S341 PolarHBondContact O-N 2.98Å
338	P	39.9	Very low	43.4	Very low	38 Å²	38	94 Å²	94	25%	0.247	52%	0.518	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-7.7	-173.4	21.7	-29.2	0	0	0	113.7	E336 Q367	E336-P338 WeakPolarHBondContact O-CD 3.49Å; E336-P338 VanDerWaalsContact O-N 3.15Å; P338-Q367 HydrophobicContact CB-CG 4.01Å; P338-Q367 VanDerWaalsContact CG-CD 3.42Å; P338-Q367 HydrophobicContact CG-CG 4.33Å
339	Y	45.5	Very low	40.9	Very low	50 Å²	50	96.5 Å²	96.5	20%	0.196	55%	0.548	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.1	-5.6	175.7	-62.2	-84	0	0	0	113.5	Y327 L337 Q367 P368	Y327-Y339 HydrophobicContact CD1-CD2 4.12Å; Y327-Y339 HydrophobicContact CD1-CG 4.3Å; Y327-Y339 HydrophobicContact CD2-CD1 4.41Å; Y327-Y339 HydrophobicContact CD2-CG 4.03Å; Y327-Y339 HydrophobicContact CE1-CD1 4.34Å; Y327-Y339 AromaticContact CE1-CD2 3.75Å; Y327-Y339 HydrophobicContact CE1-CD2 3.75Å; Y327-Y339 AromaticContact CE1-CE2 3.98Å; Y327-Y339 HydrophobicContact CE1-CE2 3.98Å; Y327-Y339 AromaticContact CE1-CG 3.95Å; Y327-Y339 HydrophobicContact CE1-CG 3.95Å; Y327-Y339 AromaticContact CE2-CD1 3.63Å; Y327-Y339 HydrophobicContact CE2-CD1 3.63Å; Y327-Y339 HydrophobicContact CE2-CD2 4.31Å; Y327-Y339 HydrophobicContact CE2-CE1 4.28Å; Y327-Y339 AromaticContact CE2-CG 3.65Å; Y327-Y339 HydrophobicContact CE2-CG 3.65Å; Y327-Y339 HydrophobicContact CG-CG 4.34Å; Y327-Y339 AromaticContact CZ-CD1 3.6Å; Y327-Y339 AromaticContact CZ-CD2 3.87Å; Y327-Y339 AromaticContact CZ-CE1 3.83Å; Y327-Y339 AromaticContact CZ-CG 3.63Å; Y327-Y339 WeakPolarHBondContact OH-CE1 3.46Å; L337-Y339 PolarHBondContact O-N 2.81Å; Y339-Q367 HydrophobicContact CE2-CB 4.37Å; Y339-Q367 VanDerWaalsContact CE2-OE1 3.24Å; Y339-Q367 WeakPolarHBondContact OH-CB 3.3Å; Y339-Q367 PolarHBondContact OH-OE1 3.06Å; Y339-P368 PolarHBondContact OH-O 3.23Å; Y339-P368 VanDerWaalsContact OH-O 3.04Å
340	S	37.1	Very low	38.8	Very low	52 Å²	52	95.4 Å²	95.4	36%	0.364	55%	0.553	S	S	.	*	S	Bend	trans	-120.5	45.5	166	-55.8	0	0	0	0	108.5	L337 S342	L337-S340 CarbonylContact O-C 3.51Å; L337-S340 VanDerWaalsContact O-C 3.24Å; L337-S340 WeakPolarHBondContact O-CA 3.48Å; L337-S340 PolarHBondContact O-N 3.09Å; S340-S342 PolarHBondContact O-N 3.47Å
341	S	35.7	Very low	37.4	Very low	57 Å²	57	97.3 Å²	97.3	40%	0.399	58%	0.575	S	S	.	*			trans	-67.5	93.3	165.7	179.5	0	0	0	0	106.4	L337 C343	L337-S341 PolarHBondContact O-N 2.98Å; S341-C343 VanDerWaalsContact C-N 3.27Å; S341-C343 PolarHBondContact O-N 2.78Å
342	S	32.7	Very low	36.5	Very low	92 Å²	92	93.5 Å²	93.5	64%	0.643	56%	0.558	S	S	*	*			trans	27.2	64.8	140.5	49.8	0	0	0	0	113.6	S340 P344	S340-S342 PolarHBondContact O-N 3.47Å; S342-P344 VanDerWaalsContact C-N 3.3Å; S342-P344 WeakPolarHBondContact O-CD 3.46Å
343	C	36.4	Very low	35.7	Very low	54 Å²	54	97.4 Å²	97.4	37%	0.365	56%	0.56	S	S	.	*			trans	-64.6	111.4	139.7	-95.6	0	0	0	0	102.4	S341 L345	S341-C343 VanDerWaalsContact C-N 3.27Å; S341-C343 PolarHBondContact O-N 2.78Å; C343-L345 PolarHBondContact O-N 3.5Å
344	P	30.7	Very low	35.6	Very low	66 Å²	66	100.3 Å²	100.3	43%	0.429	58%	0.577	S	S	.	*			trans	-68.6	94.4	177.5	-5.3	23.7	0	0	0	104.8	S342 H346 F347	S342-P344 VanDerWaalsContact C-N 3.3Å; S342-P344 WeakPolarHBondContact O-CD 3.46Å; P344-H346 VanDerWaalsContact CB-C 3.44Å; P344-H346 WeakPolarHBondContact CB-O 3.23Å; P344-H346 PolarHBondContact O-N 2.93Å; P344-F347 HydrophobicContact CB-CB 3.71Å; P344-F347 HydrophobicContact CB-CD2 3.49Å; P344-F347 VanDerWaalsContact CB-CD2 3.49Å; P344-F347 HydrophobicContact CB-CG 4.09Å; P344-F347 VanDerWaalsContact CB-N 3.3Å; P344-F347 HydrophobicContact CG-CB 4.12Å; P344-F347 HydrophobicContact CG-CD2 3.22Å; P344-F347 HydrophobicContact CG-CE2 3.9Å; P344-F347 HydrophobicContact CG-CG 4.07Å
345	L	38.6	Very low	35.8	Very low	136 Å²	136	96.6 Å²	96.6	71%	0.712	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.4	-14.4	160	-74.8	171.2	0	0	0	109.5	C343	C343-L345 PolarHBondContact O-N 3.5Å
346	H	30.4	Very low	36.7	Very low	140 Å²	140	98.6 Å²	98.6	65%	0.648	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.2	100.4	156	-79.9	-102.1	0	0	0	110.5	P344 E348	P344-H346 VanDerWaalsContact CB-C 3.44Å; P344-H346 WeakPolarHBondContact CB-O 3.23Å; P344-H346 PolarHBondContact O-N 2.93Å; H346-E348 HydrophobicContact CB-CB 4.36Å; H346-E348 HydrophobicContact CB-CG 4.22Å; H346-E348 IonicContact CE1-OE1 3.36Å; H346-E348 PolarHBondContact CE1-OE1 2.89Å; H346-E348 WeakPolarHBondContact ND1-CG 3.15Å; H346-E348 IonicContact ND1-OE1 3.08Å; H346-E348 PolarHBondContact ND1-OE1 3.2Å; H346-E348 IonicContact ND1-OE2 3.21Å; H346-E348 PolarHBondContact O-N 2.88Å
347	F	32.3	Very low	38.2	Very low	142 Å²	142	94.6 Å²	94.6	62%	0.623	56%	0.561	S	S	*	*			trans	-85.9	59.9	150.8	-139.3	-111.5	0	0	0	106	P344 G349	P344-F347 HydrophobicContact CB-CB 3.71Å; P344-F347 HydrophobicContact CB-CD2 3.49Å; P344-F347 VanDerWaalsContact CB-CD2 3.49Å; P344-F347 HydrophobicContact CB-CG 4.09Å; P344-F347 VanDerWaalsContact CB-N 3.3Å; P344-F347 HydrophobicContact CG-CB 4.12Å; P344-F347 HydrophobicContact CG-CD2 3.22Å; P344-F347 HydrophobicContact CG-CE2 3.9Å; P344-F347 HydrophobicContact CG-CG 4.07Å; F347-G349 PolarHBondContact O-N 3.18Å
348	E	29.6	Very low	40.3	Very low	168 Å²	168	96.9 Å²	96.9	79%	0.785	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	80.5	165.5	-83.6	-168.7	-170.1	0	0	107.4	H346	H346-E348 HydrophobicContact CB-CB 4.36Å; H346-E348 HydrophobicContact CB-CG 4.22Å; H346-E348 IonicContact CE1-OE1 3.36Å; H346-E348 PolarHBondContact CE1-OE1 2.89Å; H346-E348 WeakPolarHBondContact ND1-CG 3.15Å; H346-E348 IonicContact ND1-OE1 3.08Å; H346-E348 PolarHBondContact ND1-OE1 3.2Å; H346-E348 IonicContact ND1-OE2 3.21Å; H346-E348 PolarHBondContact O-N 2.88Å
349	G	27.6	Very low	42.7	Very low	71 Å²	71	95.7 Å²	95.7	73%	0.732	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-168.9	-11	-176.5	0	0	0	0	0	114.6	F347	F347-G349 PolarHBondContact O-N 3.18Å
350	A	28.5	Very low	44.8	Very low	61 Å²	61	94.2 Å²	94.2	50%	0.504	56%	0.564	S	S	.	*			trans	-140.1	126.2	163.1	0	0	0	0	0	107.8	G352	A350-G352 PolarHBondContact O-N 2.88Å
351	N	29	Very low	47.3	Very low	190 Å²	190	91.7 Å²	91.7	100%	1.016	55%	0.547	S	S	*	.			trans	-65	49.3	166.8	-74.8	-30.3	0	0	0	111.5
352	G	31.7	Very low	49.7	Very low	46 Å²	46	91.9 Å²	91.9	47%	0.474	55%	0.552	S	S	.	*			trans	-122.6	111.4	176.5	0	0	0	0	0	108.1	A350 L354	A350-G352 PolarHBondContact O-N 2.88Å; G352-L354 PolarHBondContact O-N 2.84Å
353	D	35.4	Very low	52	Low	161 Å²	161	90.6 Å²	90.6	86%	0.861	53%	0.533	S	S	*	.			trans	-33.2	113.8	156.4	-101.2	-34.2	0	0	0	108.6	S355	D353-S355 PolarHBondContact O-N 2.8Å
354	L	47.1	Very low	53.6	Low	135 Å²	135	95.7 Å²	95.7	71%	0.707	55%	0.549	S	S	*	.			trans	-64.6	90.2	155.4	-103.7	87	0	0	0	104.5	G352 S356	G352-L354 PolarHBondContact O-N 2.84Å; L354-S356 PolarHBondContact O-N 3.05Å
355	S	47.6	Very low	55.6	Low	68 Å²	68	94.3 Å²	94.3	48%	0.476	54%	0.538	S	S	.	.			trans	-49.8	139.5	177.2	70.3	0	0	0	0	107.8	D353 N357 T358	D353-S355 PolarHBondContact O-N 2.8Å; S355-N357 PolarHBondContact O-N 3.07Å; S355-T358 PolarHBondContact O-N 3.44Å
356	S	59.5	Low	56.5	Low	132 Å²	132	94.2 Å²	94.2	92%	0.923	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-0.4	177.6	58.7	0	0	0	0	114.5	L354	L354-S356 PolarHBondContact O-N 3.05Å
357	N	68	Low	58	Low	93 Å²	93	91.8 Å²	91.8	50%	0.497	53%	0.527	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	0.8	-172.8	-145	11.7	0	0	0	114.2	A102 S355	A102-N357 VanDerWaalsContact CB-O 3.28Å; A102-N357 WeakPolarHBondContact CB-O 3.31Å; A102-N357 WeakPolarHBondContact CB-OD1 3.11Å; S355-N357 PolarHBondContact O-N 3.07Å
358	T	83.1	Confident	59.8	Low	82 Å²	82	90.3 Å²	90.3	50%	0.503	53%	0.532	S	S	.	.	S	Bend	trans	-80.6	130.7	177.1	-54.2	0	0	0	0	111	S355 P360	S355-T358 PolarHBondContact O-N 3.44Å; T358-P360 WeakPolarHBondContact O-CD 3.3Å
359	N	89.6	Confident	62.5	Low	13 Å²	13	83.2 Å²	83.2	7%	0.07	50%	0.502	C	S	.	.			trans	-60.4	120.4	175.3	-179.3	-25.1	0	0	0	110.6	L97 A98 L100 L105 Y361 A362	L97-N359 PolarHBondContact O-ND2 3.42Å; A98-N359 PolarHBondContact O-ND2 3.41Å; L100-N359 WeakPolarHBondContact O-CB 3.23Å; L100-N359 PolarHBondContact O-ND2 3Å; L105-N359 WeakPolarHBondContact CD2-OD1 3.44Å; N359-Y361 PolarHBondContact O-N 3.25Å; N359-Y361 VanDerWaalsContact O-N 3.17Å; N359-Y361 WeakPolarHBondContact OD1-CB 3.49Å; N359-Y361 PolarHBondContact OD1-N 2.77Å; N359-A362 HydrophobicContact CB-CB 4.44Å; N359-A362 VanDerWaalsContact O-CB 3.29Å; N359-A362 WeakPolarHBondContact O-CB 3.39Å; N359-A362 PolarHBondContact O-N 3.01Å
360	P	89.3	Confident	65.6	Low	19 Å²	19	82.2 Å²	82.2	12%	0.123	48%	0.476	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-13.1	-175.9	27.5	-34.7	0	0	0	114.7	L105 R143 P225 T358 Y363	L105-P360 HydrophobicContact CD2-CG 4.31Å; R143-P360 VanDerWaalsContact NE-CB 3.28Å; R143-P360 VanDerWaalsContact NH2-CB 3.34Å; P225-P360 HydrophobicContact CG-CG 4.09Å; T358-P360 WeakPolarHBondContact O-CD 3.3Å; P360-Y363 WeakPolarHBondContact O-CD1 3.38Å; P360-Y363 WeakPolarHBondContact O-CE1 3.2Å
361	Y	91.4	Very high	68.9	Low	0 Å²	0	82.2 Å²	82.2	0%	0	47%	0.467	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.3	-1	178.7	-50.9	-37.7	0	0	0	113.1	A94 L97 A98 L105 A140 D224 P225 F226 N359 Y363	A94-Y361 HydrophobicContact CB-CD1 4.1Å; A94-Y361 HydrophobicContact CB-CD2 4.23Å; A94-Y361 HydrophobicContact CB-CG 3.91Å; A94-Y361 WeakPolarHBondContact O-CB 3.13Å; L97-Y361 HydrophobicContact CB-CD2 3.95Å; L97-Y361 HydrophobicContact CD1-CD2 4.36Å; L97-Y361 HydrophobicContact CD1-CE2 4.18Å; A98-Y361 VanDerWaalsContact CB-O 3.25Å; A98-Y361 WeakPolarHBondContact CB-O 3.21Å; L105-Y361 HydrophobicContact CD1-CD2 4.19Å; L105-Y361 HydrophobicContact CD1-CE2 3.98Å; L105-Y361 HydrophobicContact CD2-CD2 3.83Å; L105-Y361 HydrophobicContact CD2-CE2 3.88Å; L105-Y361 HydrophobicContact CG-CE2 4.44Å; A140-Y361 HydrophobicContact CB-CE1 3.92Å; A140-Y361 WeakPolarHBondContact O-CE1 3.2Å; D224-Y361 PolarHBondContact OD1-OH 2.78Å; D224-Y361 WeakPolarHBondContact OD2-CE1 3.29Å; D224-Y361 PolarHBondContact OD2-OH 2.96Å; P225-Y361 HydrophobicContact CG-CE2 4Å; P225-Y361 WeakPolarHBondContact CG-OH 3.34Å; F226-Y361 HydrophobicContact CD2-CE2 4.36Å; F226-Y361 WeakPolarHBondContact CD2-OH 3.31Å; F226-Y361 HydrophobicContact CE2-CE2 4.05Å; N359-Y361 PolarHBondContact O-N 3.25Å; N359-Y361 VanDerWaalsContact O-N 3.17Å; N359-Y361 WeakPolarHBondContact OD1-CB 3.49Å; N359-Y361 PolarHBondContact OD1-N 2.77Å; Y361-Y363 PolarHBondContact O-N 3.5Å
362	A	85.9	Confident	72.2	Confident	60 Å²	60	73.1 Å²	73.1	50%	0.496	42%	0.419	S	S	.	.			trans	-62.2	-24	-175.4	0	0	0	0	0	114.2	N359	N359-A362 HydrophobicContact CB-CB 4.44Å; N359-A362 VanDerWaalsContact O-CB 3.29Å; N359-A362 WeakPolarHBondContact O-CB 3.39Å; N359-A362 PolarHBondContact O-N 3.01Å
363	Y	79.4	Confident	75.4	Confident	66 Å²	66	71.2 Å²	71.2	26%	0.259	40%	0.397	S	S	.	.	S	Bend	trans	-85.1	132.4	174.8	74.2	-83.5	0	0	0	110.7	R142 R143 P360 Y361	R142-Y363 HydrophobicContact CB-CE2 4.31Å; R142-Y363 WeakPolarHBondContact CB-OH 3.4Å; R142-Y363 HydrophobicContact CG-CE1 4.02Å; R142-Y363 HydrophobicContact CG-CE2 4.11Å; R142-Y363 VanDerWaalsContact CG-OH 3.23Å; R142-Y363 WeakPolarHBondContact CG-OH 3.32Å; R142-Y363 PolarHBondContact NH1-O 2.98Å; R142-Y363 PolarHBondContact O-OH 2.88Å; R143-Y363 WeakPolarHBondContact CA-OH 3.32Å; R143-Y363 HydrophobicContact CG-CE1 3.46Å; R143-Y363 VanDerWaalsContact CG-CE1 3.46Å; R143-Y363 WeakPolarHBondContact CG-OH 3.45Å; R143-Y363 PolarHBondContact N-OH 3.37Å; P360-Y363 WeakPolarHBondContact O-CD1 3.38Å; P360-Y363 WeakPolarHBondContact O-CE1 3.2Å; Y361-Y363 PolarHBondContact O-N 3.5Å
364	K	71.3	Confident	78.4	Confident	160 Å²	160	65 Å²	65	70%	0.696	36%	0.364	S	S	*	.	P	Polyproline II helix	trans	-84.9	136	-176.6	-163.9	175.2	-177.7	176.7	0	110.6
365	L	71.8	Confident	80.8	Confident	38 Å²	38	58.6 Å²	58.6	20%	0.199	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-77.4	131.8	165.8	-81.2	160.4	0	0	0	109.4	R142 Q367	R142-L365 HydrophobicContact CB-CD1 3.74Å; R142-L365 HydrophobicContact CB-CG 4.33Å; L365-Q367 VanDerWaalsContact C-N 3.3Å; L365-Q367 PolarHBondContact O-N 3.41Å
366	N	57.4	Low	83.2	Confident	133 Å²	133	55.6 Å²	55.6	71%	0.711	31%	0.309	S	S	*	.	S	Bend	trans	-81.4	-6.9	-176.8	-71.7	-27.2	0	0	0	113.7
367	Q	62.3	Low	85.1	Confident	90 Å²	90	49.3 Å²	49.3	42%	0.421	27%	0.265	S	S	.	.	S	Bend	trans	-141.5	149.5	-176.2	-66.9	-166.3	-2.2	0	0	113.1	P338 Y339 L365	P338-Q367 HydrophobicContact CB-CG 4.01Å; P338-Q367 VanDerWaalsContact CG-CD 3.42Å; P338-Q367 HydrophobicContact CG-CG 4.33Å; Y339-Q367 HydrophobicContact CE2-CB 4.37Å; Y339-Q367 VanDerWaalsContact CE2-OE1 3.24Å; Y339-Q367 WeakPolarHBondContact OH-CB 3.3Å; Y339-Q367 PolarHBondContact OH-OE1 3.06Å; L365-Q367 VanDerWaalsContact C-N 3.3Å; L365-Q367 PolarHBondContact O-N 3.41Å
368	P	70.7	Confident	86.6	Confident	110 Å²	110	44.9 Å²	44.9	71%	0.714	24%	0.241	S	C	*	.	P	Polyproline II helix	trans	-68	132.3	178.4	27.7	-34.3	0	0	0	111.6	Y339	Y339-P368 PolarHBondContact OH-O 3.23Å; Y339-P368 VanDerWaalsContact OH-O 3.04Å
369	A	86.3	Confident	87.3	Confident	20 Å²	20	41 Å²	41	17%	0.165	22%	0.218	C	C	.	.	P	Polyproline II helix	trans	-64.8	134.3	176.7	0	0	0	0	0	112.6	R428 D429	A369-R428 HydrophobicContact CB-CB 3.91Å; A369-R428 PolarHBondContact O-NH1 3.4Å; A369-D429 HydrophobicContact CB-CB 3.96Å; A369-D429 WeakPolarHBondContact CB-O 3.44Å
370	R	92.7	Very high	87.7	Confident	50 Å²	50	40.4 Å²	40.4	19%	0.189	22%	0.215	C	C	.	.	P	Polyproline II helix	trans	-66.5	141.7	175	-178.7	174.2	69.3	-132.7	8.5	110.3	Y187 V326 V372 R428 D429 S447 A448	Y187-R370 PolarHBondContact OH-NH1 3.06Å; V326-R370 PolarHBondContact O-NH2 3.45Å; V326-R370 VanDerWaalsContact O-NH2 3.14Å; R370-V372 PolarHBondContact O-N 2.85Å; R370-R428 CarbonylContact O-C 3.48Å; R370-R428 VanDerWaalsContact O-CA 3.25Å; R370-R428 WeakPolarHBondContact O-CA 3.44Å; R370-D429 PolarHBondContact O-N 2.64Å; R370-S447 WeakPolarHBondContact CD-OG 3.5Å; R370-S447 PolarHBondContact NE-OG 2.98Å; R370-A448 PolarHBondContact NH2-O 3.26Å
371	I	97.3	Very high	88	Confident	60 Å²	60	41.2 Å²	41.2	31%	0.308	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	126	168.8	-57.3	171.7	0	0	0	108.4	P426 R428 V446 S447	I371-P426 HydrophobicContact CD1-CB 3.94Å; I371-P426 HydrophobicContact CD1-CG 4.47Å; I371-P426 HydrophobicContact CG1-CB 4.16Å; I371-P426 HydrophobicContact CG2-CB 3.55Å; I371-R428 HydrophobicContact CG1-CG 4.07Å; I371-V446 HydrophobicContact CB-CG2 4.31Å; I371-V446 HydrophobicContact CG2-CG2 3.71Å; I371-V446 WeakPolarHBondContact O-CG2 3.22Å; I371-S447 PolarHBondContact O-OG 3.35Å
372	V	98.3	Very high	88.3	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	-31.7	-176.1	-71	0	0	0	0	112.9	L323 A325 R370 L427 S445 V446 S447 V449	L323-V372 HydrophobicContact CB-CG2 4.2Å; L323-V372 HydrophobicContact CD1-CG2 3.79Å; A325-V372 HydrophobicContact CB-CG1 3.8Å; R370-V372 PolarHBondContact O-N 2.85Å; V372-L427 VanDerWaalsContact CG2-O 3.29Å; V372-L427 WeakPolarHBondContact CG2-O 3.22Å; V372-L427 PolarHBondContact N-O 2.83Å; V372-S445 CarbonylContact O-C 3.58Å; V372-S445 WeakPolarHBondContact O-CA 3.32Å; V372-V446 PolarHBondContact O-N 3.06Å; V372-S447 WeakPolarHBondContact CA-OG 3.42Å; V372-S447 PolarHBondContact O-N 3.22Å; V372-V449 HydrophobicContact CB-CB 3.76Å; V372-V449 HydrophobicContact CB-CG1 4.3Å; V372-V449 HydrophobicContact CB-CG2 3.74Å; V372-V449 HydrophobicContact CG1-CB 3.95Å; V372-V449 HydrophobicContact CG1-CG2 3.98Å; V372-V449 HydrophobicContact CG2-CB 4.48Å; V372-V449 HydrophobicContact CG2-CG2 3.92Å
373	K	98.5	Very high	88.9	Confident	5 Å²	5	40.6 Å²	40.6	2%	0.022	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	146	175.9	-55.7	-170.4	-178.4	178.6	0	111.7	L323 V375 P426 L427 F443 K444 S451	L323-K373 HydrophobicContact CD1-CD 4.37Å; L323-K373 HydrophobicContact CD1-CG 4.48Å; L323-K373 HydrophobicContact CD2-CD 4.1Å; L323-K373 VanDerWaalsContact CD2-CE 3.47Å; K373-V375 HydrophobicContact CB-CG2 3.91Å; K373-P426 CarbonylContact O-C 3.57Å; K373-P426 WeakPolarHBondContact O-CA 3.26Å; K373-L427 HydrophobicContact CB-CB 4.27Å; K373-L427 PolarHBondContact N-O 3.09Å; K373-L427 VanDerWaalsContact N-O 3.15Å; K373-L427 PolarHBondContact O-N 2.82Å; K373-F443 HydrophobicContact CB-CD1 4.38Å; K373-F443 HydrophobicContact CD-CD1 3.51Å; K373-F443 HydrophobicContact CD-CE1 4.02Å; K373-F443 HydrophobicContact CD-CG 4.37Å; K373-K444 CarbonylContact C-O 3.44Å; K373-K444 WeakPolarHBondContact CA-O 3.25Å; K373-S451 VanDerWaalsContact CE-OG 3.32Å; K373-S451 WeakPolarHBondContact CE-OG 3.42Å; K373-S451 PolarHBondContact NZ-OG 2.72Å
374	D	98.3	Very high	89.7	Confident	32 Å²	32	39 Å²	39	17%	0.171	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	121.7	163.6	178.3	14.8	0	0	0	106.4	R424 K444 V446	D374-R424 WeakPolarHBondContact OD1-CG 3.4Å; D374-R424 IonicContact OD1-CZ 2.85Å; D374-R424 IonicContact OD1-NE 3.72Å; D374-R424 PolarHBondContact OD1-NE 2.85Å; D374-R424 IonicContact OD1-NH2 3.84Å; D374-R424 IonicContact OD2-CZ 2.65Å; D374-R424 IonicContact OD2-NE 3.2Å; D374-R424 PolarHBondContact OD2-NE 3.43Å; D374-R424 IonicContact OD2-NH2 2.65Å; D374-R424 PolarHBondContact OD2-NH2 2.87Å; D374-K444 HydrophobicContact CB-CB 4.34Å; D374-K444 PolarHBondContact N-O 3.32Å; D374-K444 PolarHBondContact O-N 2.84Å; D374-V446 HydrophobicContact CB-CG1 3.79Å
375	V	98.5	Very high	90.9	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	135.4	-165.2	-167.2	0	0	0	0	109.1	K373 V377 R424 L425 L427 Q442 F443	K373-V375 HydrophobicContact CB-CG2 3.91Å; V375-V377 HydrophobicContact CG1-CG2 3.58Å; V375-R424 CarbonylContact O-C 3.51Å; V375-R424 WeakPolarHBondContact O-CA 3.46Å; V375-L425 PolarHBondContact N-O 2.87Å; V375-L425 VanDerWaalsContact N-O 3.07Å; V375-L425 PolarHBondContact O-N 3.32Å; V375-L427 HydrophobicContact CG2-CD1 3.6Å; V375-L427 HydrophobicContact CG2-CG 3.76Å; V375-Q442 WeakPolarHBondContact CG1-O 3.43Å; V375-F443 HydrophobicContact CB-CD1 4.24Å; V375-F443 HydrophobicContact CB-CE1 4.24Å; V375-F443 HydrophobicContact CG1-CD1 3.79Å; V375-F443 HydrophobicContact CG1-CE1 3.57Å; V375-F443 HydrophobicContact CG1-CG 4.41Å; V375-F443 HydrophobicContact CG1-CZ 4.01Å; V375-F443 HydrophobicContact CG2-CD1 3.51Å; V375-F443 HydrophobicContact CG2-CE1 3.56Å
376	V	98.7	Very high	92.1	Very high	4 Å²	4	32.8 Å²	32.8	2%	0.024	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	130.4	169.3	175.2	0	0	0	0	107.9	F378 L412 Y422 V423 R424 H441 Q442	V376-F378 HydrophobicContact CG1-CE2 4.05Å; V376-F378 HydrophobicContact CG1-CZ 4.15Å; V376-L412 HydrophobicContact CG1-CD1 4.4Å; V376-L412 HydrophobicContact CG1-CD2 3.7Å; V376-L412 HydrophobicContact CG2-CD1 3.96Å; V376-Y422 HydrophobicContact CG1-CD2 4.12Å; V376-V423 WeakPolarHBondContact CA-O 3.49Å; V376-R424 HydrophobicContact CG2-CB 4.16Å; V376-R424 HydrophobicContact CG2-CG 3.94Å; V376-H441 CarbonylContact O-C 3.55Å; V376-H441 WeakPolarHBondContact O-CA 3.2Å; V376-H441 WeakPolarHBondContact O-CB 3.42Å; V376-Q442 HydrophobicContact CB-CG 3.72Å; V376-Q442 HydrophobicContact CG2-CG 4.29Å; V376-Q442 PolarHBondContact N-O 2.96Å; V376-Q442 PolarHBondContact O-N 2.87Å
377	V	98.7	Very high	93.9	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	116.8	-173.9	-167.1	0	0	0	0	109.2	C133 I134 V375 Y422 V423 V439 H441	C133-V377 HydrophobicContact CB-CB 4.08Å; C133-V377 HydrophobicContact CB-CG1 3.74Å; C133-V377 VanDerWaalsContact O-CG1 3.29Å; C133-V377 WeakPolarHBondContact O-CG1 3.48Å; I134-V377 HydrophobicContact CB-CG1 4.26Å; I134-V377 HydrophobicContact CB-CG2 4.27Å; I134-V377 HydrophobicContact CD1-CG2 4.05Å; I134-V377 HydrophobicContact CG2-CG2 4.29Å; V375-V377 HydrophobicContact CG1-CG2 3.58Å; V377-Y422 CarbonylContact O-C 3.58Å; V377-Y422 VanDerWaalsContact O-CA 3.26Å; V377-Y422 WeakPolarHBondContact O-CA 3.08Å; V377-V423 PolarHBondContact N-O 3.41Å; V377-V423 PolarHBondContact O-N 3.4Å; V377-V439 HydrophobicContact CG1-CG1 3.12Å; V377-H441 HydrophobicContact CB-CB 4.42Å; V377-H441 HydrophobicContact CG1-CB 4.17Å; V377-H441 HydrophobicContact CG2-CB 4.28Å
378	F	98.6	Very high	95.4	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	150.3	-178	-67.2	-85.1	0	0	0	112	V376 L386 A407 L412 L415 Y422 V440	V376-F378 HydrophobicContact CG1-CE2 4.05Å; V376-F378 HydrophobicContact CG1-CZ 4.15Å; F378-L386 HydrophobicContact CB-CD1 3.39Å; F378-L386 HydrophobicContact CD1-CD1 3.94Å; F378-L386 HydrophobicContact CD1-CD2 4.11Å; F378-L386 HydrophobicContact CD2-CD1 4.4Å; F378-L386 HydrophobicContact CE1-CD2 4.33Å; F378-L386 HydrophobicContact CG-CD1 3.67Å; F378-L386 HydrophobicContact CG-CD2 4.42Å; F378-A407 HydrophobicContact CZ-CB 4.28Å; F378-L412 HydrophobicContact CE1-CD2 4.12Å; F378-L412 HydrophobicContact CZ-CD2 3.85Å; F378-L415 HydrophobicContact CE1-CD1 3.8Å; F378-L415 HydrophobicContact CZ-CD1 3.79Å; F378-Y422 HydrophobicContact CE1-CD1 4.48Å; F378-Y422 HydrophobicContact CE1-CG 4.45Å; F378-V440 HydrophobicContact CB-CB 4.37Å; F378-V440 WeakPolarHBondContact CB-O 3.22Å; F378-V440 HydrophobicContact CD2-CB 4.09Å; F378-V440 HydrophobicContact CD2-CG1 4.01Å; F378-V440 WeakPolarHBondContact CD2-O 3.26Å; F378-V440 PolarHBondContact N-O 2.98Å
379	D	98.4	Very high	96.6	Very high	1 Å²	1	28.1 Å²	28.1	1%	0.005	13%	0.134	C	C	.	.			trans	-68.1	127.4	178.5	177.5	-25.6	0	0	0	110.6	C133 R381 H382 R421	C133-D379 VanDerWaalsContact SG-CA 3.54Å; D379-R381 VanDerWaalsContact CG-NE 3.33Å; D379-R381 PolarHBondContact O-N 3.46Å; D379-R381 VanDerWaalsContact OD1-CB 3.31Å; D379-R381 WeakPolarHBondContact OD1-CB 3.35Å; D379-R381 WeakPolarHBondContact OD1-CG 3.27Å; D379-R381 IonicContact OD1-CZ 3.71Å; D379-R381 PolarHBondContact OD1-N 3.36Å; D379-R381 IonicContact OD1-NE 3.67Å; D379-R381 PolarHBondContact OD1-NE 3.04Å; D379-R381 IonicContact OD1-NH2 3.83Å; D379-R381 IonicContact OD2-CZ 2.89Å; D379-R381 IonicContact OD2-NE 3.9Å; D379-R381 PolarHBondContact OD2-NE 2.82Å; D379-R381 IonicContact OD2-NH2 3.21Å; D379-R381 PolarHBondContact OD2-NH2 3.24Å; D379-H382 PolarHBondContact O-N 3.47Å; D379-R421 HydrophobicContact CB-CB 3.86Å; D379-R421 PolarHBondContact N-O 3.2Å; D379-R421 IonicContact OD2-CZ 2.71Å; D379-R421 IonicContact OD2-NE 2.82Å; D379-R421 PolarHBondContact OD2-NE 2.71Å; D379-R421 IonicContact OD2-NH2 2.98Å; D379-R421 PolarHBondContact OD2-NH2 2.61Å
380	P	97.8	Very high	97	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.006	13%	0.13	C	C	.	.	G	3₁₀ helix	trans	-62.6	-16.1	-172.9	22.7	-32.1	0	0	0	114	F129 S130 H382 Y383 N438 V439	F129-P380 HydrophobicContact CB-CB 4.1Å; F129-P380 HydrophobicContact CB-CG 4.07Å; S130-P380 WeakPolarHBondContact O-CG 3.4Å; P380-H382 PolarHBondContact O-N 3.25Å; P380-Y383 WeakPolarHBondContact O-CB 3.35Å; P380-Y383 PolarHBondContact O-N 3.29Å; P380-N438 WeakPolarHBondContact CA-O 3.45Å; P380-N438 HydrophobicContact CB-CB 4.15Å; P380-V439 HydrophobicContact CB-CG2 3.81Å; P380-V439 HydrophobicContact CG-CG2 4.01Å
381	R	96.8	Very high	97.1	Very high	35 Å²	35	36 Å²	36	13%	0.132	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-59.1	-27.7	171.6	-73.5	172	-90.7	-167.3	2	113.2	V125 F129 D379 R421	V125-R381 HydrophobicContact CG1-CB 4.21Å; V125-R381 HydrophobicContact CG1-CG 4.29Å; V125-R381 WeakPolarHBondContact CG1-O 3.16Å; V125-R381 HydrophobicContact CG2-CB 4.45Å; V125-R381 HydrophobicContact CG2-CG 4.37Å; F129-R381 HydrophobicContact CB-CG 3.95Å; F129-R381 HydrophobicContact CD1-CG 3.66Å; F129-R381 HydrophobicContact CD2-CG 3.22Å; F129-R381 HydrophobicContact CE1-CG 3.89Å; F129-R381 HydrophobicContact CE2-CG 3.5Å; F129-R381 HydrophobicContact CG-CB 4.49Å; F129-R381 HydrophobicContact CG-CG 3.32Å; F129-R381 HydrophobicContact CZ-CG 3.82Å; D379-R381 VanDerWaalsContact CG-NE 3.33Å; D379-R381 PolarHBondContact O-N 3.46Å; D379-R381 VanDerWaalsContact OD1-CB 3.31Å; D379-R381 WeakPolarHBondContact OD1-CB 3.35Å; D379-R381 WeakPolarHBondContact OD1-CG 3.27Å; D379-R381 IonicContact OD1-CZ 3.71Å; D379-R381 PolarHBondContact OD1-N 3.36Å; D379-R381 IonicContact OD1-NE 3.67Å; D379-R381 PolarHBondContact OD1-NE 3.04Å; D379-R381 IonicContact OD1-NH2 3.83Å; D379-R381 IonicContact OD2-CZ 2.89Å; D379-R381 IonicContact OD2-NE 3.9Å; D379-R381 PolarHBondContact OD2-NE 2.82Å; D379-R381 IonicContact OD2-NH2 3.21Å; D379-R381 PolarHBondContact OD2-NH2 3.24Å; R381-R421 VanDerWaalsContact NH2-CZ 3.28Å; R381-R421 VanDerWaalsContact NH2-NH2 3.17Å
382	H	97.2	Very high	96.9	Very high	30 Å²	30	33.7 Å²	33.7	14%	0.139	15%	0.149	C	C	.	.	G	3₁₀ helix	trans	-98.2	8	-176.7	-54.6	-70.3	0	0	0	113.2	D379 P380 V384 D385 L386 G419 F420 R421	D379-H382 PolarHBondContact O-N 3.47Å; P380-H382 PolarHBondContact O-N 3.25Å; H382-V384 PolarHBondContact O-N 3.34Å; H382-D385 PolarHBondContact O-N 3.04Å; H382-D385 VanDerWaalsContact O-N 3.13Å; H382-L386 HydrophobicContact CB-CD1 3.89Å; H382-L386 HydrophobicContact CB-CG 4.08Å; H382-L386 WeakPolarHBondContact O-CB 3.36Å; H382-L386 WeakPolarHBondContact O-CG 3.38Å; H382-L386 PolarHBondContact O-N 2.85Å; H382-G419 PolarHBondContact CE1-O 3.27Å; H382-G419 VanDerWaalsContact CE1-O 3.27Å; H382-F420 HydrophobicContact CB-CD1 3.67Å; H382-F420 HydrophobicContact CB-CE1 4.04Å; H382-F420 AromaticContact CG-CD1 3.88Å; H382-R421 PolarHBondContact CD2-N 3.09Å; H382-R421 PolarHBondContact NE2-N 3.38Å
383	Y	97.5	Very high	96.7	Very high	17 Å²	17	37.3 Å²	37.3	7%	0.067	17%	0.168	C	C	.	.	H	α-helix	trans	-47.8	-53.8	-172.7	176.4	-115.1	0	0	0	113.5	V127 A305 H307 T316 P380 L386 I387 N438 V440	V127-Y383 HydrophobicContact CG1-CD1 4.25Å; A305-Y383 HydrophobicContact CB-CD2 4.49Å; A305-Y383 HydrophobicContact CB-CE2 3.67Å; H307-Y383 PolarHBondContact NE2-OH 2.98Å; H307-Y383 VanDerWaalsContact NE2-OH 3.09Å; T316-Y383 HydrophobicContact CG2-CE1 3.92Å; T316-Y383 HydrophobicContact CG2-CE2 3.83Å; T316-Y383 WeakPolarHBondContact CG2-OH 3.44Å; P380-Y383 WeakPolarHBondContact O-CB 3.35Å; P380-Y383 PolarHBondContact O-N 3.29Å; Y383-L386 PolarHBondContact O-N 3.37Å; Y383-I387 HydrophobicContact CD1-CD1 3.9Å; Y383-I387 HydrophobicContact CD2-CD1 4.15Å; Y383-I387 HydrophobicContact CE1-CD1 3.42Å; Y383-I387 VanDerWaalsContact CE1-CD1 3.42Å; Y383-I387 HydrophobicContact CE2-CD1 3.69Å; Y383-I387 HydrophobicContact CE2-CG1 4.17Å; Y383-I387 HydrophobicContact CG-CD1 4.25Å; Y383-I387 WeakPolarHBondContact O-CG1 3.31Å; Y383-I387 PolarHBondContact O-N 2.71Å; Y383-N438 VanDerWaalsContact CB-O 3.31Å; Y383-N438 WeakPolarHBondContact CB-O 3.47Å; Y383-N438 HydrophobicContact CD1-CB 4.09Å; Y383-N438 HydrophobicContact CD2-CB 4.12Å; Y383-N438 VanDerWaalsContact CD2-O 3.31Å; Y383-N438 WeakPolarHBondContact CD2-O 3.22Å; Y383-N438 HydrophobicContact CG-CB 3.74Å; Y383-V440 HydrophobicContact CD2-CG2 4.13Å; Y383-V440 HydrophobicContact CE2-CG2 4.48Å
384	V	96.4	Very high	96.3	Very high	32 Å²	32	39.8 Å²	39.8	19%	0.194	18%	0.181	C	C	.	.	H	α-helix	trans	-69.1	-39	-175.6	-161.7	0	0	0	0	111.2	R126 V127 H382 L386 I387 E388	R126-V384 HydrophobicContact CB-CB 4.45Å; R126-V384 HydrophobicContact CB-CG2 3.82Å; R126-V384 VanDerWaalsContact NH2-CG1 3.26Å; V127-V384 HydrophobicContact CG1-CG2 3.7Å; H382-V384 PolarHBondContact O-N 3.34Å; V384-L386 VanDerWaalsContact C-N 3.34Å; V384-L386 PolarHBondContact O-N 3.33Å; V384-I387 PolarHBondContact O-N 2.84Å; V384-E388 PolarHBondContact O-N 3.06Å
385	D	96.6	Very high	96	Very high	68 Å²	68	43 Å²	43	36%	0.364	20%	0.196	S	C	.	.	H	α-helix	trans	-68.5	-35	178.6	-51.3	-34.2	0	0	0	111.3	R126 H382 R389 F420	R126-D385 IonicContact CZ-OD1 3.93Å; R126-D385 IonicContact NE-OD1 3.55Å; R126-D385 IonicContact NH2-OD1 2.77Å; R126-D385 PolarHBondContact NH2-OD1 3.13Å; H382-D385 PolarHBondContact O-N 3.04Å; H382-D385 VanDerWaalsContact O-N 3.13Å; D385-R389 WeakPolarHBondContact O-CB 3.49Å; D385-R389 PolarHBondContact O-N 3.14Å; D385-F420 HydrophobicContact CB-CE1 3.85Å; D385-F420 HydrophobicContact CB-CZ 4.25Å
386	L	96.4	Very high	95.5	Very high	1 Å²	1	47 Å²	47	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-69.9	-38.1	175.5	-79.1	167	0	0	0	112.4	F378 H382 Y383 V384 E388 R389 L390 F420 V440	F378-L386 HydrophobicContact CB-CD1 3.39Å; F378-L386 HydrophobicContact CD1-CD1 3.94Å; F378-L386 HydrophobicContact CD1-CD2 4.11Å; F378-L386 HydrophobicContact CD2-CD1 4.4Å; F378-L386 HydrophobicContact CE1-CD2 4.33Å; F378-L386 HydrophobicContact CG-CD1 3.67Å; F378-L386 HydrophobicContact CG-CD2 4.42Å; H382-L386 HydrophobicContact CB-CD1 3.89Å; H382-L386 HydrophobicContact CB-CG 4.08Å; H382-L386 WeakPolarHBondContact O-CB 3.36Å; H382-L386 WeakPolarHBondContact O-CG 3.38Å; H382-L386 PolarHBondContact O-N 2.85Å; Y383-L386 PolarHBondContact O-N 3.37Å; V384-L386 VanDerWaalsContact C-N 3.34Å; V384-L386 PolarHBondContact O-N 3.33Å; L386-E388 VanDerWaalsContact C-N 3.3Å; L386-E388 PolarHBondContact O-N 3.17Å; L386-R389 PolarHBondContact O-N 3.16Å; L386-L390 HydrophobicContact CD2-CD1 4.1Å; L386-L390 HydrophobicContact CD2-CG 4.27Å; L386-L390 VanDerWaalsContact O-CB 3.22Å; L386-L390 WeakPolarHBondContact O-CB 3.2Å; L386-L390 WeakPolarHBondContact O-CG 3.24Å; L386-L390 PolarHBondContact O-N 3.23Å; L386-F420 HydrophobicContact CD1-CD1 4.35Å; L386-F420 HydrophobicContact CD2-CD1 3.52Å; L386-F420 HydrophobicContact CD2-CE1 3.67Å; L386-F420 HydrophobicContact CD2-CG 4.06Å; L386-F420 HydrophobicContact CD2-CZ 4.31Å; L386-F420 HydrophobicContact CG-CD1 3.64Å; L386-F420 HydrophobicContact CG-CE1 3.63Å; L386-V440 HydrophobicContact CB-CG2 4.23Å; L386-V440 HydrophobicContact CD1-CB 4.33Å; L386-V440 HydrophobicContact CD1-CG2 4.38Å
387	I	95.3	Very high	94.9	Very high	27 Å²	27	50 Å²	50	14%	0.138	23%	0.234	C	C	.	.	H	α-helix	trans	-56.9	-49.2	174.2	-70.4	159.6	0	0	0	109.9	Y383 V384 R391 L392 I394	Y383-I387 HydrophobicContact CD1-CD1 3.9Å; Y383-I387 HydrophobicContact CD2-CD1 4.15Å; Y383-I387 HydrophobicContact CE1-CD1 3.42Å; Y383-I387 VanDerWaalsContact CE1-CD1 3.42Å; Y383-I387 HydrophobicContact CE2-CD1 3.69Å; Y383-I387 HydrophobicContact CE2-CG1 4.17Å; Y383-I387 HydrophobicContact CG-CD1 4.25Å; Y383-I387 WeakPolarHBondContact O-CG1 3.31Å; Y383-I387 PolarHBondContact O-N 2.71Å; V384-I387 PolarHBondContact O-N 2.84Å; I387-R391 CarbonylContact O-C 3.56Å; I387-R391 VanDerWaalsContact O-CA 3.23Å; I387-R391 WeakPolarHBondContact O-CA 3.27Å; I387-R391 PolarHBondContact O-N 3.27Å; I387-L392 HydrophobicContact CG1-CB 4.49Å; I387-L392 HydrophobicContact CG1-CD1 4.37Å; I387-L392 HydrophobicContact CG2-CB 4.36Å; I387-L392 PolarHBondContact O-N 3.16Å; I387-I394 HydrophobicContact CD1-CG2 3.88Å; I387-I394 HydrophobicContact CG1-CG2 3.87Å; I387-I394 HydrophobicContact CG2-CG2 4.13Å
388	E	95	Very high	94.3	Very high	120 Å²	120	52 Å²	52	56%	0.561	25%	0.247	S	C	*	.	H	α-helix	trans	-65.3	-47.9	178.7	-67.1	171.6	-154	0	0	111.1	R126 V384 L386 L390 R391	R126-E388 IonicContact CZ-OE1 2.84Å; R126-E388 IonicContact NH1-OE1 2.73Å; R126-E388 PolarHBondContact NH1-OE1 3.28Å; R126-E388 IonicContact NH2-OE1 3.59Å; R126-E388 PolarHBondContact NH2-OE1 3.09Å; R126-E388 IonicContact NH2-OE2 2.89Å; V384-E388 PolarHBondContact O-N 3.06Å; L386-E388 VanDerWaalsContact C-N 3.3Å; L386-E388 PolarHBondContact O-N 3.17Å; E388-L390 PolarHBondContact O-N 3.22Å; E388-R391 PolarHBondContact O-N 3.04Å
389	R	95.4	Very high	93.6	Very high	88 Å²	88	56 Å²	56	33%	0.332	28%	0.28	S	S	.	.	H	α-helix	trans	-66.8	-37.9	-175.9	177.7	56.6	179.7	78.1	3.3	113.8	D385 L386 L415 E418 F420	D385-R389 WeakPolarHBondContact O-CB 3.49Å; D385-R389 PolarHBondContact O-N 3.14Å; L386-R389 PolarHBondContact O-N 3.16Å; R389-L415 HydrophobicContact CG-CD2 3.96Å; R389-E418 IonicContact CZ-OE1 3.67Å; R389-E418 IonicContact CZ-OE2 3.52Å; R389-E418 IonicContact NE-OE1 3.54Å; R389-E418 IonicContact NE-OE2 2.74Å; R389-E418 PolarHBondContact NE-OE2 3.28Å; R389-E418 IonicContact NH2-OE1 2.9Å; R389-E418 PolarHBondContact NH2-OE1 3.36Å; R389-E418 IonicContact NH2-OE2 3.47Å; R389-E418 PolarHBondContact NH2-OE2 3.09Å; R389-F420 HydrophobicContact CB-CE2 4.37Å; R389-F420 HydrophobicContact CB-CZ 3.92Å; R389-F420 HydrophobicContact CG-CE2 3.89Å; R389-F420 HydrophobicContact CG-CZ 3.96Å
390	L	95.1	Very high	93.1	Very high	14 Å²	14	59.1 Å²	59.1	7%	0.073	30%	0.302	C	S	.	.	H	α-helix	trans	-94.5	-3.8	179.8	-57	-175.9	0	0	0	112.5	C303 L386 E388 L392 F405 L415 V440	C303-L390 HydrophobicContact CB-CD1 4.28Å; L386-L390 HydrophobicContact CD2-CD1 4.1Å; L386-L390 HydrophobicContact CD2-CG 4.27Å; L386-L390 VanDerWaalsContact O-CB 3.22Å; L386-L390 WeakPolarHBondContact O-CB 3.2Å; L386-L390 WeakPolarHBondContact O-CG 3.24Å; L386-L390 PolarHBondContact O-N 3.23Å; E388-L390 PolarHBondContact O-N 3.22Å; L390-L392 VanDerWaalsContact C-N 3.29Å; L390-L392 HydrophobicContact CB-CD2 4.07Å; L390-L392 HydrophobicContact CB-CG 3.97Å; L390-L392 PolarHBondContact O-N 3.2Å; L390-F405 HydrophobicContact CD1-CE1 4.18Å; L390-F405 HydrophobicContact CD2-CD1 4.19Å; L390-F405 HydrophobicContact CD2-CE1 3.61Å; L390-F405 HydrophobicContact CD2-CE2 4.09Å; L390-F405 HydrophobicContact CD2-CZ 3.56Å; L390-F405 HydrophobicContact CG-CE1 4.46Å; L390-L415 HydrophobicContact CD2-CD1 4.39Å; L390-L415 HydrophobicContact CD2-CD2 4.29Å; L390-V440 HydrophobicContact CD1-CG1 4.32Å
391	R	94.3	Very high	92.8	Very high	222 Å²	222	59.2 Å²	59.2	84%	0.838	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	47.6	-174.8	-55.2	179.4	-178.5	180	0	111.6	I387 E388 D393	I387-R391 CarbonylContact O-C 3.56Å; I387-R391 VanDerWaalsContact O-CA 3.23Å; I387-R391 WeakPolarHBondContact O-CA 3.27Å; I387-R391 PolarHBondContact O-N 3.27Å; E388-R391 PolarHBondContact O-N 3.04Å; R391-D393 PolarHBondContact O-N 3.1Å
392	L	93.8	Very high	92.5	Very high	10 Å²	10	57.8 Å²	57.8	5%	0.052	30%	0.298	C	S	.	.			trans	-70.3	124.3	177.1	-60.1	179.3	0	0	0	109.4	C303 I387 L390 I394 Q401 C402 V440	C303-L392 HydrophobicContact CB-CD2 4.4Å; I387-L392 HydrophobicContact CG1-CB 4.49Å; I387-L392 HydrophobicContact CG1-CD1 4.37Å; I387-L392 HydrophobicContact CG2-CB 4.36Å; I387-L392 PolarHBondContact O-N 3.16Å; L390-L392 VanDerWaalsContact C-N 3.29Å; L390-L392 HydrophobicContact CB-CD2 4.07Å; L390-L392 HydrophobicContact CB-CG 3.97Å; L390-L392 PolarHBondContact O-N 3.2Å; L392-I394 HydrophobicContact CB-CG2 4.46Å; L392-I394 PolarHBondContact O-N 3.18Å; L392-Q401 CarbonylContact C-O 3.5Å; L392-Q401 WeakPolarHBondContact CA-O 3.47Å; L392-C402 HydrophobicContact CD2-CB 3.46Å; L392-C402 VanDerWaalsContact CD2-CB 3.46Å; L392-V440 HydrophobicContact CD1-CG1 3.9Å; L392-V440 HydrophobicContact CD1-CG2 3.77Å
393	D	93.2	Very high	91.9	Very high	76 Å²	76	59.1 Å²	59.1	41%	0.406	32%	0.32	S	S	.	.			trans	-82.6	96.6	166.3	-167	-22.6	0	0	0	108.9	R391 M395 E396 Q401	R391-D393 PolarHBondContact O-N 3.1Å; D393-M395 PolarHBondContact O-N 3.28Å; D393-M395 WeakPolarHBondContact OD1-CB 3.44Å; D393-M395 PolarHBondContact OD1-N 2.83Å; D393-E396 HydrophobicContact CB-CB 4.27Å; D393-E396 HydrophobicContact CB-CG 3.93Å; D393-E396 PolarHBondContact O-N 3.48Å; D393-Q401 PolarHBondContact N-O 2.93Å; D393-Q401 WeakPolarHBondContact O-CA 3.2Å; D393-Q401 WeakPolarHBondContact O-CG 3.35Å
394	I	91.4	Very high	91.4	Very high	57 Å²	57	64.4 Å²	64.4	29%	0.292	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-8	-178.5	60	169.5	0	0	0	113.5	R314 I387 L392	R314-I394 WeakPolarHBondContact CD-O 3.22Å; R314-I394 VanDerWaalsContact CZ-O 3.27Å; R314-I394 PolarHBondContact NE-O 2.82Å; R314-I394 PolarHBondContact NH2-O 3.21Å; I387-I394 HydrophobicContact CD1-CG2 3.88Å; I387-I394 HydrophobicContact CG1-CG2 3.87Å; I387-I394 HydrophobicContact CG2-CG2 4.13Å; L392-I394 HydrophobicContact CB-CG2 4.46Å; L392-I394 PolarHBondContact O-N 3.18Å
395	M	90.3	Very high	91.2	Very high	100 Å²	100	64.9 Å²	64.9	49%	0.493	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-21.1	174.8	-57.6	-53.7	-62.1	0	0	111.8	G311 R314 D393	G311-M395 WeakPolarHBondContact O-CE 3.34Å; R314-M395 PolarHBondContact NH1-O 2.82Å; D393-M395 PolarHBondContact O-N 3.28Å; D393-M395 WeakPolarHBondContact OD1-CB 3.44Å; D393-M395 PolarHBondContact OD1-N 2.83Å
396	E	89.8	Confident	91.1	Very high	84 Å²	84	63.7 Å²	63.7	39%	0.393	35%	0.349	S	S	.	.	S	Bend	trans	-79.1	152.3	176.5	-71.6	-65.3	142.2	0	0	111.9	R314 D393 Q401	R314-E396 PolarHBondContact NH2-O 3.13Å; D393-E396 HydrophobicContact CB-CB 4.27Å; D393-E396 HydrophobicContact CB-CG 3.93Å; D393-E396 PolarHBondContact O-N 3.48Å; E396-Q401 HydrophobicContact CB-CG 4.47Å; E396-Q401 VanDerWaalsContact O-CG 3.23Å; E396-Q401 WeakPolarHBondContact O-CG 3.12Å; E396-Q401 PolarHBondContact O-NE2 3.03Å; E396-Q401 VanDerWaalsContact O-NE2 3.17Å
397	P	85.3	Confident	91.1	Very high	66 Å²	66	63.7 Å²	63.7	43%	0.429	35%	0.35	S	S	.	.			trans	-62.7	156.6	173.2	28.5	-34.7	0	0	0	111	A399 S400 Q401	P397-A399 PolarHBondContact O-N 3.34Å; P397-S400 PolarHBondContact O-N 2.86Å; P397-Q401 WeakPolarHBondContact O-CG 3.43Å; P397-Q401 PolarHBondContact O-N 2.97Å
398	P	86	Confident	91.2	Very high	42 Å²	42	66.3 Å²	66.3	27%	0.273	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-43.6	-38.6	-176.2	-36.9	39.3	0	0	0	116.4	H304 S400	H304-P398 HydrophobicContact CB-CB 4.23Å; H304-P398 WeakPolarHBondContact CB-O 3.44Å; P398-S400 PolarHBondContact O-N 2.77Å
399	A	84.2	Confident	91.2	Very high	84 Å²	84	65.1 Å²	65.1	69%	0.694	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-19	-179.2	0	0	0	0	0	114.5	P397	P397-A399 PolarHBondContact O-N 3.34Å
400	S	87.2	Confident	91.3	Very high	67 Å²	67	63.1 Å²	63.1	47%	0.469	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.2	-4.3	-172.8	-58.6	0	0	0	0	113.9	P397 P398 C402	P397-S400 PolarHBondContact O-N 2.86Å; P398-S400 PolarHBondContact O-N 2.77Å; S400-C402 PolarHBondContact O-N 2.98Å
401	Q	91.1	Very high	91.4	Very high	3 Å²	3	65.9 Å²	65.9	1%	0.014	38%	0.381	C	S	.	.	S	Bend	trans	-60.3	-35.1	-177.8	-66.2	-169	-14.9	0	0	113.3	H304 A305 H307 L392 D393 E396 P397	H304-Q401 VanDerWaalsContact CA-OE1 3.27Å; H304-Q401 HydrophobicContact CB-CB 4.32Å; H304-Q401 HydrophobicContact CB-CG 4.43Å; H304-Q401 VanDerWaalsContact CB-OE1 3.28Å; A305-Q401 PolarHBondContact O-NE2 2.93Å; A305-Q401 VanDerWaalsContact O-NE2 3.16Å; A305-Q401 PolarHBondContact O-OE1 3.34Å; H307-Q401 PolarHBondContact CE1-NE2 3.36Å; H307-Q401 VanDerWaalsContact CE1-NE2 3.33Å; H307-Q401 PolarHBondContact ND1-NE2 2.83Å; L392-Q401 CarbonylContact C-O 3.5Å; L392-Q401 WeakPolarHBondContact CA-O 3.47Å; D393-Q401 PolarHBondContact N-O 2.93Å; D393-Q401 WeakPolarHBondContact O-CA 3.2Å; D393-Q401 WeakPolarHBondContact O-CG 3.35Å; E396-Q401 HydrophobicContact CB-CG 4.47Å; E396-Q401 VanDerWaalsContact O-CG 3.23Å; E396-Q401 WeakPolarHBondContact O-CG 3.12Å; E396-Q401 PolarHBondContact O-NE2 3.03Å; E396-Q401 VanDerWaalsContact O-NE2 3.17Å; P397-Q401 WeakPolarHBondContact O-CG 3.43Å; P397-Q401 PolarHBondContact O-N 2.97Å
402	C	90.7	Very high	91.6	Very high	5 Å²	5	55.4 Å²	55.4	3%	0.034	34%	0.341	C	S	.	.	S	Bend	trans	-118.8	132.2	179.9	-163.4	0	0	0	0	108.7	N302 C303 L392 S400	N302-C402 HydrophobicContact CB-CB 4.28Å; C303-C402 HydrophobicContact CB-CB 4.3Å; C303-C402 WeakPolarHBondContact O-CB 3.23Å; L392-C402 HydrophobicContact CD2-CB 3.46Å; L392-C402 VanDerWaalsContact CD2-CB 3.46Å; S400-C402 PolarHBondContact O-N 2.98Å
403	G	85	Confident	91.8	Very high	58 Å²	58	59.2 Å²	59.2	60%	0.598	36%	0.362	S	S	*	.			trans	-65.4	-130.1	179.3	0	0	0	0	0	112.7	N302 F405	N302-G403 PolarHBondContact ND2-O 3.46Å; G403-F405 PolarHBondContact O-N 3.48Å
404	S	86.4	Confident	92	Very high	128 Å²	128	59.9 Å²	59.9	90%	0.895	36%	0.362	S	S	*	.	S	Bend	trans	-81.9	5.3	-179.2	60.4	0	0	0	0	114.5
405	F	92.5	Very high	92.3	Very high	42 Å²	42	57.1 Å²	57.1	18%	0.184	35%	0.348	C	S	.	.			trans	-69.5	135	-178.4	172.9	-89.9	0	0	0	110.9	L390 G403 A407 E411 L415	L390-F405 HydrophobicContact CD1-CE1 4.18Å; L390-F405 HydrophobicContact CD2-CD1 4.19Å; L390-F405 HydrophobicContact CD2-CE1 3.61Å; L390-F405 HydrophobicContact CD2-CE2 4.09Å; L390-F405 HydrophobicContact CD2-CZ 3.56Å; L390-F405 HydrophobicContact CG-CE1 4.46Å; G403-F405 PolarHBondContact O-N 3.48Å; F405-A407 HydrophobicContact CE1-CB 3.87Å; F405-A407 HydrophobicContact CZ-CB 3.97Å; F405-E411 HydrophobicContact CE2-CB 4.17Å; F405-E411 HydrophobicContact CE2-CG 3.92Å; F405-E411 HydrophobicContact CZ-CB 4.21Å; F405-E411 HydrophobicContact CZ-CG 4.43Å; F405-L415 HydrophobicContact CZ-CD1 4.28Å
406	W	95.3	Very high	92.7	Very high	43 Å²	43	56 Å²	56	16%	0.163	34%	0.342	C	S	.	.			trans	-136.4	123.1	174.5	176.4	-95.4	0	0	0	107.7	R300 D408 Q442 K444	R300-W406 HydrophobicContact CB-CE3 4.1Å; R300-W406 HydrophobicContact CB-CH2 3.99Å; R300-W406 HydrophobicContact CB-CZ3 3.61Å; R300-W406 HydrophobicContact CG-CE3 4.32Å; R300-W406 HydrophobicContact CG-CH2 3.84Å; R300-W406 HydrophobicContact CG-CZ2 4.2Å; R300-W406 HydrophobicContact CG-CZ3 3.91Å; W406-D408 VanDerWaalsContact C-N 3.31Å; W406-D408 PolarHBondContact O-N 2.79Å; W406-Q442 HydrophobicContact CH2-CB 4.3Å; W406-Q442 HydrophobicContact CH2-CG 4.2Å; W406-Q442 HydrophobicContact CZ3-CB 3.95Å; W406-Q442 HydrophobicContact CZ3-CG 4.23Å; W406-K444 HydrophobicContact CH2-CB 3.87Å; W406-K444 HydrophobicContact CZ2-CB 3.99Å
407	A	95.8	Very high	93.1	Very high	2 Å²	2	56 Å²	56	2%	0.017	35%	0.351	C	S	.	.			trans	-77.7	84.7	179.3	0	0	0	0	0	109.4	F378 F405 L412 Q442	F378-A407 HydrophobicContact CZ-CB 4.28Å; F405-A407 HydrophobicContact CE1-CB 3.87Å; F405-A407 HydrophobicContact CZ-CB 3.97Å; A407-L412 HydrophobicContact CB-CD2 3.78Å; A407-L412 HydrophobicContact CB-CG 3.98Å; A407-Q442 PolarHBondContact O-NE2 3Å
408	D	96.4	Very high	93.6	Very high	81 Å²	81	56.6 Å²	56.6	43%	0.433	35%	0.348	S	S	.	.			trans	-78.6	-177.4	167.3	67.2	24.7	0	0	0	111.5	W406 G410 E411 L412	W406-D408 VanDerWaalsContact C-N 3.31Å; W406-D408 PolarHBondContact O-N 2.79Å; D408-G410 PolarHBondContact O-N 3.06Å; D408-G410 PolarHBondContact OD1-N 3.18Å; D408-E411 PolarHBondContact O-N 2.58Å; D408-E411 PolarHBondContact OD1-N 3.42Å; D408-L412 VanDerWaalsContact O-CB 3.32Å; D408-L412 WeakPolarHBondContact O-CB 3.34Å; D408-L412 WeakPolarHBondContact O-CG 3.26Å; D408-L412 PolarHBondContact O-N 3.21Å
409	D	96.8	Very high	94.2	Very high	95 Å²	95	56.7 Å²	56.7	51%	0.508	36%	0.357	S	S	.	.	H	α-helix	trans	-59.3	-35.6	-176.1	-60.7	-0.3	0	0	0	112.3	N413 R424	D409-N413 WeakPolarHBondContact O-CB 3.47Å; D409-N413 PolarHBondContact O-N 2.89Å; D409-N413 PolarHBondContact O-ND2 3.19Å; D409-N413 VanDerWaalsContact O-ND2 3.08Å; D409-R424 IonicContact OD1-CZ 2.77Å; D409-R424 IonicContact OD1-NH1 3.36Å; D409-R424 PolarHBondContact OD1-NH1 2.92Å
410	G	97.4	Very high	94.8	Very high	46 Å²	46	53.6 Å²	53.6	47%	0.474	33%	0.328	S	S	.	.	H	α-helix	trans	-68.5	-50.4	178.7	0	0	0	0	0	111.4	D408 L412 N413 Q414	D408-G410 PolarHBondContact O-N 3.06Å; D408-G410 PolarHBondContact OD1-N 3.18Å; G410-L412 VanDerWaalsContact C-N 3.33Å; G410-L412 PolarHBondContact O-N 2.86Å; G410-N413 PolarHBondContact O-N 3.33Å; G410-Q414 WeakPolarHBondContact O-CB 3.39Å; G410-Q414 PolarHBondContact O-N 2.55Å
411	E	97.1	Very high	95.4	Very high	72 Å²	72	53.5 Å²	53.5	34%	0.336	32%	0.317	S	S	.	.	H	α-helix	trans	-62.7	-38.9	177	-70.2	-60.5	148.4	0	0	112.1	F405 D408 Q414 L415	F405-E411 HydrophobicContact CE2-CB 4.17Å; F405-E411 HydrophobicContact CE2-CG 3.92Å; F405-E411 HydrophobicContact CZ-CB 4.21Å; F405-E411 HydrophobicContact CZ-CG 4.43Å; D408-E411 PolarHBondContact O-N 2.58Å; D408-E411 PolarHBondContact OD1-N 3.42Å; E411-Q414 PolarHBondContact O-N 3.1Å; E411-L415 WeakPolarHBondContact O-CB 3.48Å; E411-L415 VanDerWaalsContact O-CG 3.28Å; E411-L415 WeakPolarHBondContact O-CG 3.48Å; E411-L415 PolarHBondContact O-N 3.24Å
412	L	98.3	Very high	95.7	Very high	2 Å²	2	53.6 Å²	53.6	1%	0.01	32%	0.318	C	S	.	.	H	α-helix	trans	-66.7	-40.7	177.6	-73.3	171.1	0	0	0	112.7	V376 F378 A407 D408 G410 Q414 L415 H416 Y422	V376-L412 HydrophobicContact CG1-CD1 4.4Å; V376-L412 HydrophobicContact CG1-CD2 3.7Å; V376-L412 HydrophobicContact CG2-CD1 3.96Å; F378-L412 HydrophobicContact CE1-CD2 4.12Å; F378-L412 HydrophobicContact CZ-CD2 3.85Å; A407-L412 HydrophobicContact CB-CD2 3.78Å; A407-L412 HydrophobicContact CB-CG 3.98Å; D408-L412 VanDerWaalsContact O-CB 3.32Å; D408-L412 WeakPolarHBondContact O-CB 3.34Å; D408-L412 WeakPolarHBondContact O-CG 3.26Å; D408-L412 PolarHBondContact O-N 3.21Å; G410-L412 VanDerWaalsContact C-N 3.33Å; G410-L412 PolarHBondContact O-N 2.86Å; L412-Q414 VanDerWaalsContact C-N 3.32Å; L412-L415 PolarHBondContact O-N 3.26Å; L412-H416 WeakPolarHBondContact O-CB 3.28Å; L412-H416 PolarHBondContact O-N 3.16Å; L412-Y422 HydrophobicContact CB-CE1 4.07Å; L412-Y422 HydrophobicContact CB-CE2 4.24Å; L412-Y422 HydrophobicContact CD1-CE2 4.01Å; L412-Y422 HydrophobicContact CD2-CD1 4.13Å; L412-Y422 HydrophobicContact CD2-CD2 4Å; L412-Y422 HydrophobicContact CD2-CE1 4.12Å; L412-Y422 HydrophobicContact CD2-CE2 3.97Å; L412-Y422 HydrophobicContact CD2-CG 4.09Å; L412-Y422 HydrophobicContact CG-CE2 4.3Å
413	N	97.8	Very high	96.1	Very high	90 Å²	90	53.3 Å²	53.3	48%	0.481	32%	0.316	S	S	.	.	H	α-helix	trans	-64.8	-39.8	174.3	-71.9	-24.3	0	0	0	111.1	D409 G410 H416 S417	D409-N413 WeakPolarHBondContact O-CB 3.47Å; D409-N413 PolarHBondContact O-N 2.89Å; D409-N413 PolarHBondContact O-ND2 3.19Å; D409-N413 VanDerWaalsContact O-ND2 3.08Å; G410-N413 PolarHBondContact O-N 3.33Å; N413-H416 PolarHBondContact O-N 2.93Å; N413-S417 PolarHBondContact O-N 3.24Å
414	Q	97.8	Very high	96.8	Very high	90 Å²	90	54 Å²	54	42%	0.421	30%	0.3	S	S	.	.	H	α-helix	trans	-63.7	-49.6	176.2	-178.3	55.3	43.9	0	0	111.1	G410 E411 L412 H416 S417 E418	G410-Q414 WeakPolarHBondContact O-CB 3.39Å; G410-Q414 PolarHBondContact O-N 2.55Å; E411-Q414 PolarHBondContact O-N 3.1Å; L412-Q414 VanDerWaalsContact C-N 3.32Å; Q414-H416 VanDerWaalsContact C-N 3.28Å; Q414-H416 PolarHBondContact O-N 2.98Å; Q414-S417 PolarHBondContact NE2-OG 3.15Å; Q414-S417 WeakPolarHBondContact O-CB 3.43Å; Q414-S417 PolarHBondContact O-N 2.92Å; Q414-S417 VanDerWaalsContact O-N 3.1Å; Q414-S417 PolarHBondContact O-OG 3Å; Q414-E418 WeakPolarHBondContact CG-OE1 3.34Å; Q414-E418 PolarHBondContact NE2-OE1 3.29Å; Q414-E418 WeakPolarHBondContact O-CG 3.39Å; Q414-E418 PolarHBondContact O-N 3.01Å
415	L	97.7	Very high	97.3	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-58.5	-40.3	174.7	-71.9	169.4	0	0	0	111.5	F378 R389 L390 F405 E411 L412 S417 E418 G419 F420	F378-L415 HydrophobicContact CE1-CD1 3.8Å; F378-L415 HydrophobicContact CZ-CD1 3.79Å; R389-L415 HydrophobicContact CG-CD2 3.96Å; L390-L415 HydrophobicContact CD2-CD1 4.39Å; L390-L415 HydrophobicContact CD2-CD2 4.29Å; F405-L415 HydrophobicContact CZ-CD1 4.28Å; E411-L415 WeakPolarHBondContact O-CB 3.48Å; E411-L415 VanDerWaalsContact O-CG 3.28Å; E411-L415 WeakPolarHBondContact O-CG 3.48Å; E411-L415 PolarHBondContact O-N 3.24Å; L412-L415 PolarHBondContact O-N 3.26Å; L415-S417 VanDerWaalsContact C-N 3.35Å; L415-S417 PolarHBondContact O-N 2.72Å; L415-E418 WeakPolarHBondContact O-CB 3.49Å; L415-E418 PolarHBondContact O-N 2.86Å; L415-G419 PolarHBondContact O-N 3.26Å; L415-F420 HydrophobicContact CB-CB 4.17Å; L415-F420 HydrophobicContact CB-CD2 4.06Å; L415-F420 HydrophobicContact CB-CG 4.45Å; L415-F420 HydrophobicContact CD2-CD2 3.67Å; L415-F420 HydrophobicContact CD2-CE2 3.93Å; L415-F420 HydrophobicContact CD2-CG 4.39Å; L415-F420 HydrophobicContact CG-CD2 4.49Å; L415-F420 WeakPolarHBondContact O-CB 3.29Å; L415-F420 VanDerWaalsContact O-CD2 3.27Å; L415-F420 WeakPolarHBondContact O-CD2 3.22Å; L415-F420 PolarHBondContact O-N 3.44Å
416	H	98	Very high	97.6	Very high	76 Å²	76	48.9 Å²	48.9	35%	0.352	27%	0.268	S	S	.	.	H	α-helix	trans	-62.8	-42.1	175.3	-167.2	51.7	0	0	0	112.5	L412 N413 Q414 E418 G419 F420 Y422	L412-H416 WeakPolarHBondContact O-CB 3.28Å; L412-H416 PolarHBondContact O-N 3.16Å; N413-H416 PolarHBondContact O-N 2.93Å; Q414-H416 VanDerWaalsContact C-N 3.28Å; Q414-H416 PolarHBondContact O-N 2.98Å; H416-E418 PolarHBondContact O-N 3.47Å; H416-G419 WeakPolarHBondContact O-CA 3.43Å; H416-G419 PolarHBondContact O-N 3.41Å; H416-F420 WeakPolarHBondContact CA-O 3.39Å; H416-F420 PolarHBondContact ND1-O 2.69Å; H416-F420 VanDerWaalsContact ND1-O 3.16Å; H416-Y422 HydrophobicContact CB-CE1 4.18Å
417	S	97.5	Very high	97.7	Very high	85 Å²	85	46.9 Å²	46.9	59%	0.594	26%	0.26	S	S	*	.	H	α-helix	trans	-62.7	-27.4	175.7	80.8	0	0	0	0	113.1	N413 Q414 L415 G419	N413-S417 PolarHBondContact O-N 3.24Å; Q414-S417 PolarHBondContact NE2-OG 3.15Å; Q414-S417 WeakPolarHBondContact O-CB 3.43Å; Q414-S417 PolarHBondContact O-N 2.92Å; Q414-S417 VanDerWaalsContact O-N 3.1Å; Q414-S417 PolarHBondContact O-OG 3Å; L415-S417 VanDerWaalsContact C-N 3.35Å; L415-S417 PolarHBondContact O-N 2.72Å; S417-G419 VanDerWaalsContact C-N 3.26Å; S417-G419 PolarHBondContact O-N 2.86Å
418	E	97.3	Very high	97.8	Very high	77 Å²	77	51.5 Å²	51.5	36%	0.36	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-3.8	173.9	-66.3	170.2	-156	0	0	113	R389 Q414 L415 H416 F420	R389-E418 IonicContact CZ-OE1 3.67Å; R389-E418 IonicContact CZ-OE2 3.52Å; R389-E418 IonicContact NE-OE1 3.54Å; R389-E418 IonicContact NE-OE2 2.74Å; R389-E418 PolarHBondContact NE-OE2 3.28Å; R389-E418 IonicContact NH2-OE1 2.9Å; R389-E418 PolarHBondContact NH2-OE1 3.36Å; R389-E418 IonicContact NH2-OE2 3.47Å; R389-E418 PolarHBondContact NH2-OE2 3.09Å; Q414-E418 WeakPolarHBondContact CG-OE1 3.34Å; Q414-E418 PolarHBondContact NE2-OE1 3.29Å; Q414-E418 WeakPolarHBondContact O-CG 3.39Å; Q414-E418 PolarHBondContact O-N 3.01Å; L415-E418 WeakPolarHBondContact O-CB 3.49Å; L415-E418 PolarHBondContact O-N 2.86Å; H416-E418 PolarHBondContact O-N 3.47Å; E418-F420 HydrophobicContact CB-CD2 3.9Å; E418-F420 HydrophobicContact CB-CE2 3.97Å
419	G	97.1	Very high	97.8	Very high	45 Å²	45	47.7 Å²	47.7	46%	0.464	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	97.2	5.4	176.8	0	0	0	0	0	115	H382 L415 H416 S417	H382-G419 PolarHBondContact CE1-O 3.27Å; H382-G419 VanDerWaalsContact CE1-O 3.27Å; L415-G419 PolarHBondContact O-N 3.26Å; H416-G419 WeakPolarHBondContact O-CA 3.43Å; H416-G419 PolarHBondContact O-N 3.41Å; S417-G419 VanDerWaalsContact C-N 3.26Å; S417-G419 PolarHBondContact O-N 2.86Å
420	F	98.2	Very high	97.8	Very high	18 Å²	18	43.3 Å²	43.3	8%	0.079	23%	0.234	C	C	.	.			trans	-73.9	144	173.7	-63.8	-77.9	0	0	0	111.1	H382 D385 L386 R389 L415 H416 E418	H382-F420 HydrophobicContact CB-CD1 3.67Å; H382-F420 HydrophobicContact CB-CE1 4.04Å; H382-F420 AromaticContact CG-CD1 3.88Å; D385-F420 HydrophobicContact CB-CE1 3.85Å; D385-F420 HydrophobicContact CB-CZ 4.25Å; L386-F420 HydrophobicContact CD1-CD1 4.35Å; L386-F420 HydrophobicContact CD2-CD1 3.52Å; L386-F420 HydrophobicContact CD2-CE1 3.67Å; L386-F420 HydrophobicContact CD2-CG 4.06Å; L386-F420 HydrophobicContact CD2-CZ 4.31Å; L386-F420 HydrophobicContact CG-CD1 3.64Å; L386-F420 HydrophobicContact CG-CE1 3.63Å; R389-F420 HydrophobicContact CB-CE2 4.37Å; R389-F420 HydrophobicContact CB-CZ 3.92Å; R389-F420 HydrophobicContact CG-CE2 3.89Å; R389-F420 HydrophobicContact CG-CZ 3.96Å; L415-F420 HydrophobicContact CB-CB 4.17Å; L415-F420 HydrophobicContact CB-CD2 4.06Å; L415-F420 HydrophobicContact CB-CG 4.45Å; L415-F420 HydrophobicContact CD2-CD2 3.67Å; L415-F420 HydrophobicContact CD2-CE2 3.93Å; L415-F420 HydrophobicContact CD2-CG 4.39Å; L415-F420 HydrophobicContact CG-CD2 4.49Å; L415-F420 WeakPolarHBondContact O-CB 3.29Å; L415-F420 VanDerWaalsContact O-CD2 3.27Å; L415-F420 WeakPolarHBondContact O-CD2 3.22Å; L415-F420 PolarHBondContact O-N 3.44Å; H416-F420 WeakPolarHBondContact CA-O 3.39Å; H416-F420 PolarHBondContact ND1-O 2.69Å; H416-F420 VanDerWaalsContact ND1-O 3.16Å; E418-F420 HydrophobicContact CB-CD2 3.9Å; E418-F420 HydrophobicContact CB-CE2 3.97Å
421	R	98.5	Very high	97.8	Very high	65 Å²	65	41.3 Å²	41.3	25%	0.245	21%	0.212	C	C	.	.			trans	-112.7	146.6	172.6	-64.4	-169	-51.8	-128.8	-39.7	112.9	G85 G86 D379 R381 H382	G85-R421 CarbonylContact O-C 3.51Å; G85-R421 WeakPolarHBondContact O-CA 3.43Å; G85-R421 WeakPolarHBondContact O-CB 3.39Å; G85-R421 WeakPolarHBondContact O-CG 3.25Å; G86-R421 WeakPolarHBondContact O-CD 3.38Å; D379-R421 HydrophobicContact CB-CB 3.86Å; D379-R421 PolarHBondContact N-O 3.2Å; D379-R421 IonicContact OD2-CZ 2.71Å; D379-R421 IonicContact OD2-NE 2.82Å; D379-R421 PolarHBondContact OD2-NE 2.71Å; D379-R421 IonicContact OD2-NH2 2.98Å; D379-R421 PolarHBondContact OD2-NH2 2.61Å; R381-R421 VanDerWaalsContact NH2-CZ 3.28Å; R381-R421 VanDerWaalsContact NH2-NH2 3.17Å; H382-R421 PolarHBondContact CD2-N 3.09Å; H382-R421 PolarHBondContact NE2-N 3.38Å
422	Y	98.7	Very high	97.9	Very high	5 Å²	5	37.9 Å²	37.9	2%	0.02	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	165.2	179.1	66.9	-85.8	0	0	0	111.5	Y82 N84 G85 G87 V376 V377 F378 L412 H416 R424	Y82-Y422 HydrophobicContact CD1-CD2 4.29Å; Y82-Y422 HydrophobicContact CD1-CE2 4.12Å; Y82-Y422 WeakPolarHBondContact CD1-O 3.43Å; Y82-Y422 HydrophobicContact CE1-CD2 4.08Å; Y82-Y422 AromaticContact CE1-CE2 3.51Å; Y82-Y422 HydrophobicContact CE1-CE2 3.51Å; N84-Y422 PolarHBondContact O-OH 3.3Å; G85-Y422 CarbonylContact C-O 3.52Å; G85-Y422 VanDerWaalsContact C-O 3.29Å; G85-Y422 WeakPolarHBondContact CA-O 3.29Å; G85-Y422 PolarHBondContact O-N 3.13Å; G87-Y422 WeakPolarHBondContact CA-O 3.44Å; G87-Y422 PolarHBondContact N-O 3.3Å; G87-Y422 VanDerWaalsContact N-O 3.09Å; V376-Y422 HydrophobicContact CG1-CD2 4.12Å; V377-Y422 CarbonylContact O-C 3.58Å; V377-Y422 VanDerWaalsContact O-CA 3.26Å; V377-Y422 WeakPolarHBondContact O-CA 3.08Å; F378-Y422 HydrophobicContact CE1-CD1 4.48Å; F378-Y422 HydrophobicContact CE1-CG 4.45Å; L412-Y422 HydrophobicContact CB-CE1 4.07Å; L412-Y422 HydrophobicContact CB-CE2 4.24Å; L412-Y422 HydrophobicContact CD1-CE2 4.01Å; L412-Y422 HydrophobicContact CD2-CD1 4.13Å; L412-Y422 HydrophobicContact CD2-CD2 4Å; L412-Y422 HydrophobicContact CD2-CE1 4.12Å; L412-Y422 HydrophobicContact CD2-CE2 3.97Å; L412-Y422 HydrophobicContact CD2-CG 4.09Å; L412-Y422 HydrophobicContact CG-CE2 4.3Å; H416-Y422 HydrophobicContact CB-CE1 4.18Å; Y422-R424 HydrophobicContact CE2-CB 4.44Å
423	V	98.7	Very high	97.9	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	138.1	165.3	178.4	0	0	0	0	107.9	Y82 A89 C133 V376 V377 L425	Y82-V423 HydrophobicContact CD2-CG1 4.48Å; Y82-V423 HydrophobicContact CG-CG1 4.21Å; A89-V423 HydrophobicContact CB-CG1 4.09Å; A89-V423 HydrophobicContact CB-CG2 4.35Å; C133-V423 HydrophobicContact CB-CG2 4.08Å; V376-V423 WeakPolarHBondContact CA-O 3.49Å; V377-V423 PolarHBondContact N-O 3.41Å; V377-V423 PolarHBondContact O-N 3.4Å; V423-L425 HydrophobicContact CG1-CB 4.24Å; V423-L425 HydrophobicContact CG1-CD2 3.63Å; V423-L425 HydrophobicContact CG1-CG 4.35Å
424	R	98.6	Very high	98	Very high	72 Å²	72	33.9 Å²	33.9	27%	0.272	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	122.8	163.9	-178.7	-179.6	-179.7	176.4	1.2	109.9	Y82 D374 V375 V376 D409 Y422	Y82-R424 WeakPolarHBondContact CD2-O 3.4Å; Y82-R424 HydrophobicContact CE1-CB 4.01Å; Y82-R424 HydrophobicContact CE2-CB 4.17Å; Y82-R424 WeakPolarHBondContact CE2-O 3.48Å; D374-R424 WeakPolarHBondContact OD1-CG 3.4Å; D374-R424 IonicContact OD1-CZ 2.85Å; D374-R424 IonicContact OD1-NE 3.72Å; D374-R424 PolarHBondContact OD1-NE 2.85Å; D374-R424 IonicContact OD1-NH2 3.84Å; D374-R424 IonicContact OD2-CZ 2.65Å; D374-R424 IonicContact OD2-NE 3.2Å; D374-R424 PolarHBondContact OD2-NE 3.43Å; D374-R424 IonicContact OD2-NH2 2.65Å; D374-R424 PolarHBondContact OD2-NH2 2.87Å; V375-R424 CarbonylContact O-C 3.51Å; V375-R424 WeakPolarHBondContact O-CA 3.46Å; V376-R424 HydrophobicContact CG2-CB 4.16Å; V376-R424 HydrophobicContact CG2-CG 3.94Å; D409-R424 IonicContact OD1-CZ 2.77Å; D409-R424 IonicContact OD1-NH1 3.36Å; D409-R424 PolarHBondContact OD1-NH1 2.92Å; Y422-R424 HydrophobicContact CE2-CB 4.44Å
425	L	98.3	Very high	98	Very high	4 Å²	4	29.8 Å²	29.8	2%	0.021	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	149.1	-177.3	71	92.6	0	0	0	112.7	A89 I134 V136 V375 V423 L427	A89-L425 HydrophobicContact CB-CD2 3.94Å; I134-L425 HydrophobicContact CG2-CD2 3.5Å; V136-L425 HydrophobicContact CG2-CD1 4.16Å; V375-L425 PolarHBondContact N-O 2.87Å; V375-L425 VanDerWaalsContact N-O 3.07Å; V375-L425 PolarHBondContact O-N 3.32Å; V423-L425 HydrophobicContact CG1-CB 4.24Å; V423-L425 HydrophobicContact CG1-CD2 3.63Å; V423-L425 HydrophobicContact CG1-CG 4.35Å; L425-L427 HydrophobicContact CD1-CD2 3.48Å; L425-L427 VanDerWaalsContact CD1-CD2 3.48Å; L425-L427 HydrophobicContact CD1-CG 4.03Å
426	P	98.1	Very high	98	Very high	59 Å²	59	29.9 Å²	29.9	38%	0.383	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	133.7	172.1	31.3	-32.3	0	0	0	111.4	I371 K373	I371-P426 HydrophobicContact CD1-CB 3.94Å; I371-P426 HydrophobicContact CD1-CG 4.47Å; I371-P426 HydrophobicContact CG1-CB 4.16Å; I371-P426 HydrophobicContact CG2-CB 3.55Å; K373-P426 CarbonylContact O-C 3.57Å; K373-P426 WeakPolarHBondContact O-CA 3.26Å
427	L	98.4	Very high	98	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	142	166.5	-61.3	178.1	0	0	0	110.6	V136 L323 V372 K373 V375 L425 Y433 F443	V136-L427 HydrophobicContact CB-CD2 4.45Å; V136-L427 HydrophobicContact CG1-CD2 3.85Å; V136-L427 HydrophobicContact CG2-CD2 3.66Å; L323-L427 HydrophobicContact CD1-CB 3.51Å; L323-L427 HydrophobicContact CD1-CD1 3.79Å; L323-L427 HydrophobicContact CD1-CG 4.28Å; V372-L427 VanDerWaalsContact CG2-O 3.29Å; V372-L427 WeakPolarHBondContact CG2-O 3.22Å; V372-L427 PolarHBondContact N-O 2.83Å; K373-L427 HydrophobicContact CB-CB 4.27Å; K373-L427 PolarHBondContact N-O 3.09Å; K373-L427 VanDerWaalsContact N-O 3.15Å; K373-L427 PolarHBondContact O-N 2.82Å; V375-L427 HydrophobicContact CG2-CD1 3.6Å; V375-L427 HydrophobicContact CG2-CG 3.76Å; L425-L427 HydrophobicContact CD1-CD2 3.48Å; L425-L427 VanDerWaalsContact CD1-CD2 3.48Å; L425-L427 HydrophobicContact CD1-CG 4.03Å; L427-Y433 HydrophobicContact CD1-CD1 3.62Å; L427-Y433 HydrophobicContact CD1-CE1 4.01Å; L427-Y433 HydrophobicContact CD1-CG 3.91Å; L427-F443 HydrophobicContact CD1-CE1 4.06Å
428	R	97.7	Very high	98	Very high	99 Å²	99	23.4 Å²	23.4	37%	0.374	12%	0.116	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	165.9	-173.3	-62.3	177.2	178.3	-96.3	0.7	112.7	A369 R370 I371 N430 D431	A369-R428 HydrophobicContact CB-CB 3.91Å; A369-R428 PolarHBondContact O-NH1 3.4Å; R370-R428 CarbonylContact O-C 3.48Å; R370-R428 VanDerWaalsContact O-CA 3.25Å; R370-R428 WeakPolarHBondContact O-CA 3.44Å; I371-R428 HydrophobicContact CG1-CG 4.07Å; R428-N430 PolarHBondContact O-N 3.14Å; R428-D431 PolarHBondContact N-OD2 3.24Å; R428-D431 VanDerWaalsContact O-CB 3.31Å; R428-D431 WeakPolarHBondContact O-CB 3.13Å; R428-D431 PolarHBondContact O-N 2.96Å; R428-D431 VanDerWaalsContact O-N 3.13Å
429	D	96.4	Very high	98	Very high	1 Å²	1	19.9 Å²	19.9	1%	0.005	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.6	138.3	166.3	-180	41.1	0	0	0	110.5	K324 A325 A369 R370 D431	K324-D429 WeakPolarHBondContact CA-OD1 3.45Å; K324-D429 IonicContact NZ-OD1 3.5Å; K324-D429 PolarHBondContact NZ-OD1 2.9Å; K324-D429 IonicContact NZ-OD2 3.95Å; K324-D429 PolarHBondContact NZ-OD2 3.24Å; A325-D429 HydrophobicContact CB-CB 3.59Å; A325-D429 PolarHBondContact N-OD1 3.24Å; A369-D429 HydrophobicContact CB-CB 3.96Å; A369-D429 WeakPolarHBondContact CB-O 3.44Å; R370-D429 PolarHBondContact O-N 2.64Å; D429-D431 PolarHBondContact O-N 3.43Å
430	N	96.2	Very high	98	Very high	4 Å²	4	17.8 Å²	17.8	2%	0.021	8%	0.078	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.9	4.3	-176.6	-48.7	-63.6	0	0	0	115.3	G139 A140 A141 R142 L323 K324 R428	G139-N430 CarbonylContact C-O 3.45Å; G139-N430 WeakPolarHBondContact CA-O 3.35Å; G139-N430 PolarHBondContact N-O 2.89Å; A140-N430 PolarHBondContact N-O 3.46Å; A141-N430 PolarHBondContact N-O 3.36Å; R142-N430 WeakPolarHBondContact CA-OD1 3.37Å; R142-N430 HydrophobicContact CB-CB 4.39Å; L323-N430 WeakPolarHBondContact O-CA 3.47Å; L323-N430 PolarHBondContact O-N 3.4Å; K324-N430 PolarHBondContact NZ-OD1 2.84Å; R428-N430 PolarHBondContact O-N 3.14Å
431	D	98	Very high	98	Very high	3 Å²	3	17 Å²	17	2%	0.016	8%	0.075	C	C	.	.			trans	-74.3	141.4	172.1	-68.9	-4	0	0	0	110.6	V136 H138 G139 L323 R428 D429	V136-D431 HydrophobicContact CG1-CB 4.13Å; H138-D431 WeakPolarHBondContact CA-OD1 3.23Å; H138-D431 IonicContact CE1-OD2 3.54Å; H138-D431 IonicContact CG-OD1 2.73Å; H138-D431 VanDerWaalsContact ND1-CG 3.33Å; H138-D431 IonicContact ND1-OD1 2.69Å; H138-D431 PolarHBondContact ND1-OD1 2.63Å; H138-D431 IonicContact ND1-OD2 3.46Å; H138-D431 PolarHBondContact ND1-OD2 3.42Å; G139-D431 PolarHBondContact N-OD1 3.08Å; L323-D431 PolarHBondContact N-O 3.5Å; R428-D431 PolarHBondContact N-OD2 3.24Å; R428-D431 VanDerWaalsContact O-CB 3.31Å; R428-D431 WeakPolarHBondContact O-CB 3.13Å; R428-D431 PolarHBondContact O-N 2.96Å; R428-D431 VanDerWaalsContact O-N 3.13Å; D429-D431 PolarHBondContact O-N 3.43Å
432	I	98.6	Very high	98	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	6%	0.064	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	141.3	159.9	65.9	-174.6	0	0	0	108.1	V136 V137 A140 A141 F226 L227 G321 L322 F434	V136-I432 WeakPolarHBondContact CA-O 3.48Å; V137-I432 HydrophobicContact CB-CD1 4.08Å; V137-I432 HydrophobicContact CB-CG1 3.76Å; V137-I432 HydrophobicContact CG2-CG1 4.4Å; V137-I432 PolarHBondContact N-O 3.03Å; V137-I432 PolarHBondContact O-N 3.36Å; A140-I432 HydrophobicContact CB-CD1 3.54Å; A140-I432 HydrophobicContact CB-CG1 3.81Å; A140-I432 HydrophobicContact CB-CG2 4.38Å; A141-I432 HydrophobicContact CB-CG2 3.82Å; F226-I432 HydrophobicContact CB-CD1 3.88Å; F226-I432 HydrophobicContact CG-CD1 4.43Å; L227-I432 HydrophobicContact CD1-CG2 4.21Å; L227-I432 HydrophobicContact CD2-CB 4.11Å; L227-I432 HydrophobicContact CD2-CD1 3.9Å; L227-I432 HydrophobicContact CD2-CG2 4.05Å; L227-I432 HydrophobicContact CG-CD1 4.05Å; L227-I432 HydrophobicContact CG-CG2 4.42Å; G321-I432 CarbonylContact O-C 3.57Å; G321-I432 VanDerWaalsContact O-CA 3.23Å; G321-I432 WeakPolarHBondContact O-CA 3.34Å; L322-I432 HydrophobicContact CB-CG2 4.22Å; L322-I432 HydrophobicContact CD1-CG2 4.2Å; L322-I432 HydrophobicContact CG-CG2 4.07Å; I432-F434 HydrophobicContact CB-CZ 4.44Å; I432-F434 HydrophobicContact CD1-CE2 4.19Å; I432-F434 HydrophobicContact CD1-CZ 3.7Å; I432-F434 HydrophobicContact CG1-CE2 4Å; I432-F434 HydrophobicContact CG1-CZ 3.84Å
433	Y	98.9	Very high	97.9	Very high	9 Å²	9	14.7 Å²	14.7	4%	0.035	7%	0.066	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	155.6	-178.3	66.7	-89.9	0	0	0	111.5	I134 G135 V320 G321 L323 L427 I435 F443	I134-Y433 HydrophobicContact CD1-CD2 4.41Å; G135-Y433 CarbonylContact O-C 3.58Å; G135-Y433 WeakPolarHBondContact O-CA 3.32Å; V320-Y433 WeakPolarHBondContact CA-O 3.46Å; G321-Y433 PolarHBondContact N-O 2.9Å; G321-Y433 WeakPolarHBondContact O-CD1 3.36Å; G321-Y433 PolarHBondContact O-N 2.94Å; L323-Y433 HydrophobicContact CD1-CD1 4.13Å; L323-Y433 HydrophobicContact CD1-CE1 4.05Å; L323-Y433 HydrophobicContact CD2-CE1 3.88Å; L323-Y433 HydrophobicContact CG-CD1 4.17Å; L323-Y433 HydrophobicContact CG-CE1 3.87Å; L427-Y433 HydrophobicContact CD1-CD1 3.62Å; L427-Y433 HydrophobicContact CD1-CE1 4.01Å; L427-Y433 HydrophobicContact CD1-CG 3.91Å; Y433-I435 HydrophobicContact CD2-CD1 4.15Å; Y433-I435 HydrophobicContact CD2-CG1 4.13Å; Y433-I435 HydrophobicContact CE2-CD1 4.03Å; Y433-I435 HydrophobicContact CE2-CG1 4.45Å; Y433-F443 HydrophobicContact CD2-CZ 4.4Å; Y433-F443 HydrophobicContact CE2-CE1 4.15Å; Y433-F443 AromaticContact CE2-CZ 3.58Å; Y433-F443 HydrophobicContact CE2-CZ 3.58Å; Y433-F443 AromaticContact CZ-CE1 3.98Å; Y433-F443 AromaticContact CZ-CZ 3.75Å
434	F	98.8	Very high	97.9	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	125.9	-172.1	-51.6	-74.7	0	0	0	108.7	Y112 F113 L116 F117 I134 G135 V137 F226 L227 V230 A319 V320 I432	Y112-F434 AromaticContact CE1-CD2 3.96Å; Y112-F434 HydrophobicContact CE1-CD2 3.96Å; Y112-F434 HydrophobicContact CE1-CE2 4.18Å; F113-F434 AromaticContact CE1-CD1 3.65Å; F113-F434 HydrophobicContact CE1-CD1 3.65Å; F113-F434 AromaticContact CE1-CD2 3.91Å; F113-F434 HydrophobicContact CE1-CD2 3.91Å; F113-F434 AromaticContact CE1-CE1 3.68Å; F113-F434 HydrophobicContact CE1-CE1 3.68Å; F113-F434 AromaticContact CE1-CE2 3.92Å; F113-F434 HydrophobicContact CE1-CE2 3.92Å; F113-F434 AromaticContact CE1-CG 3.77Å; F113-F434 HydrophobicContact CE1-CG 3.77Å; F113-F434 AromaticContact CE1-CZ 3.81Å; F113-F434 HydrophobicContact CE1-CZ 3.81Å; F113-F434 HydrophobicContact CZ-CD1 4.05Å; F113-F434 HydrophobicContact CZ-CD2 4.48Å; F113-F434 AromaticContact CZ-CE1 3.57Å; F113-F434 HydrophobicContact CZ-CE1 3.57Å; F113-F434 HydrophobicContact CZ-CE2 4.03Å; F113-F434 HydrophobicContact CZ-CG 4.48Å; F113-F434 AromaticContact CZ-CZ 3.56Å; F113-F434 HydrophobicContact CZ-CZ 3.56Å; L116-F434 HydrophobicContact CD2-CB 3.45Å; L116-F434 VanDerWaalsContact CD2-CB 3.45Å; L116-F434 HydrophobicContact CD2-CD2 4.33Å; L116-F434 HydrophobicContact CD2-CG 4.18Å; F117-F434 HydrophobicContact CZ-CB 4.14Å; I134-F434 WeakPolarHBondContact CA-O 3.08Å; G135-F434 PolarHBondContact N-O 3.38Å; G135-F434 PolarHBondContact O-N 3.38Å; V137-F434 HydrophobicContact CG2-CE2 3.94Å; F226-F434 HydrophobicContact CB-CZ 4.03Å; L227-F434 HydrophobicContact CD2-CE1 4.15Å; L227-F434 HydrophobicContact CD2-CZ 4.33Å; V230-F434 HydrophobicContact CG2-CD1 4.18Å; V230-F434 HydrophobicContact CG2-CE1 3.69Å; A319-F434 CarbonylContact O-C 3.53Å; A319-F434 WeakPolarHBondContact O-CA 3.48Å; V320-F434 HydrophobicContact CB-CD1 4.32Å; V320-F434 HydrophobicContact CG1-CD1 3.74Å; V320-F434 HydrophobicContact CG1-CE1 3.63Å; V320-F434 HydrophobicContact CG2-CD1 4.03Å; V320-F434 HydrophobicContact CG2-CE1 4.48Å; I432-F434 HydrophobicContact CB-CZ 4.44Å; I432-F434 HydrophobicContact CD1-CE2 4.19Å; I432-F434 HydrophobicContact CD1-CZ 3.7Å; I432-F434 HydrophobicContact CG1-CE2 4Å; I432-F434 HydrophobicContact CG1-CZ 3.84Å
435	I	98.7	Very high	97.9	Very high	3 Å²	3	13.7 Å²	13.7	2%	0.015	7%	0.065	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	116.2	-178.5	-61.8	177.6	0	0	0	107.2	I134 A318 A319 Y433 V439 F443	I134-I435 HydrophobicContact CD1-CG1 4.27Å; I134-I435 HydrophobicContact CG1-CG1 4.26Å; A318-I435 CarbonylContact C-O 3.11Å; A318-I435 WeakPolarHBondContact CA-O 3.31Å; A318-I435 WeakPolarHBondContact CB-O 3.01Å; A319-I435 HydrophobicContact CB-CB 4.39Å; A319-I435 PolarHBondContact N-O 3.46Å; A319-I435 PolarHBondContact O-N 2.82Å; Y433-I435 HydrophobicContact CD2-CD1 4.15Å; Y433-I435 HydrophobicContact CD2-CG1 4.13Å; Y433-I435 HydrophobicContact CE2-CD1 4.03Å; Y433-I435 HydrophobicContact CE2-CG1 4.45Å; I435-V439 HydrophobicContact CG2-CB 3.56Å; I435-V439 HydrophobicContact CG2-CG1 3.55Å; I435-V439 HydrophobicContact CG2-CG2 4.24Å; I435-F443 HydrophobicContact CD1-CE2 4.3Å; I435-F443 HydrophobicContact CD1-CZ 4.01Å
436	P	98.4	Very high	97.9	Very high	2 Å²	2	15.9 Å²	15.9	1%	0.013	8%	0.078	C	C	.	.			trans	-58.4	162.3	172.2	-24.2	35.2	0	0	0	112.4	L116 F117 C133 V439	L116-P436 HydrophobicContact CD1-CG 4.12Å; L116-P436 HydrophobicContact CG-CG 4.33Å; F117-P436 HydrophobicContact CD1-CB 4.2Å; F117-P436 HydrophobicContact CD1-CG 4.1Å; F117-P436 HydrophobicContact CE1-CB 4.43Å; F117-P436 HydrophobicContact CE1-CG 4.21Å; C133-P436 WeakPolarHBondContact O-CD 3.31Å; P436-V439 HydrophobicContact CB-CG2 4.25Å; P436-V439 WeakPolarHBondContact O-CB 3.48Å; P436-V439 WeakPolarHBondContact O-CG2 3.36Å
437	R	96.9	Very high	97.8	Very high	16 Å²	16	13.5 Å²	13.5	6%	0.06	6%	0.063	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	163	172.5	74	172.4	172.2	-177.2	-6.2	111.3	E119 T317 V439 Y461	E119-R437 WeakPolarHBondContact OE1-CG 3.37Å; E119-R437 IonicContact OE1-CZ 3.83Å; E119-R437 IonicContact OE1-NE 3.77Å; E119-R437 PolarHBondContact OE1-NE 3.34Å; E119-R437 IonicContact OE1-NH2 2.77Å; E119-R437 PolarHBondContact OE1-NH2 3.49Å; E119-R437 IonicContact OE2-CZ 2.89Å; E119-R437 IonicContact OE2-NE 3.7Å; E119-R437 IonicContact OE2-NH2 3.34Å; E119-R437 PolarHBondContact OE2-NH2 3.13Å; T317-R437 WeakPolarHBondContact O-CA 3.47Å; R437-V439 PolarHBondContact O-N 2.82Å; R437-Y461 HydrophobicContact CB-CD2 4.2Å; R437-Y461 HydrophobicContact CB-CE2 3.75Å; R437-Y461 VanDerWaalsContact CD-CD2 3.42Å; R437-Y461 HydrophobicContact CG-CD2 3.78Å; R437-Y461 HydrophobicContact CG-CE2 3.44Å; R437-Y461 VanDerWaalsContact CG-CE2 3.44Å; R437-Y461 HydrophobicContact CG-CG 4.49Å; R437-Y461 VanDerWaalsContact CZ-CB 3.47Å; R437-Y461 PolarHBondContact NH1-O 3.01Å; R437-Y461 PolarHBondContact NH2-O 3.29Å; R437-Y461 VanDerWaalsContact NH2-O 3.16Å
438	N	96.9	Very high	97.8	Very high	10 Å²	10	13.5 Å²	13.5	5%	0.053	6%	0.063	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.9	16.6	-178.7	-57.9	-34.9	0	0	0	114.3	V127 P128 T316 P380 Y383	V127-N438 HydrophobicContact CG2-CB 4.38Å; P128-N438 PolarHBondContact O-ND2 3.26Å; P128-N438 VanDerWaalsContact O-ND2 3.13Å; T316-N438 WeakPolarHBondContact CB-OD1 3.2Å; T316-N438 WeakPolarHBondContact CG2-OD1 3.28Å; T316-N438 PolarHBondContact OG1-OD1 3.24Å; P380-N438 WeakPolarHBondContact CA-O 3.45Å; P380-N438 HydrophobicContact CB-CB 4.15Å; Y383-N438 VanDerWaalsContact CB-O 3.31Å; Y383-N438 WeakPolarHBondContact CB-O 3.47Å; Y383-N438 HydrophobicContact CD1-CB 4.09Å; Y383-N438 HydrophobicContact CD2-CB 4.12Å; Y383-N438 VanDerWaalsContact CD2-O 3.31Å; Y383-N438 WeakPolarHBondContact CD2-O 3.22Å; Y383-N438 HydrophobicContact CG-CB 3.74Å
439	V	98.1	Very high	97.9	Very high	3 Å²	3	8.8 Å²	8.8	2%	0.018	5%	0.045	C	C	.	.			trans	-100.1	113.4	178.7	172.2	0	0	0	0	110.2	V377 P380 I435 P436 R437 H441	V377-V439 HydrophobicContact CG1-CG1 3.12Å; P380-V439 HydrophobicContact CB-CG2 3.81Å; P380-V439 HydrophobicContact CG-CG2 4.01Å; I435-V439 HydrophobicContact CG2-CB 3.56Å; I435-V439 HydrophobicContact CG2-CG1 3.55Å; I435-V439 HydrophobicContact CG2-CG2 4.24Å; P436-V439 HydrophobicContact CB-CG2 4.25Å; P436-V439 WeakPolarHBondContact O-CB 3.48Å; P436-V439 WeakPolarHBondContact O-CG2 3.36Å; R437-V439 PolarHBondContact O-N 2.82Å; V439-H441 HydrophobicContact CG1-CB 4.44Å; V439-H441 PolarHBondContact O-ND1 2.8Å
440	V	98.1	Very high	97.9	Very high	1 Å²	1	8.7 Å²	8.7	1%	0.006	5%	0.045	C	C	.	.			trans	-76.7	135.8	167.5	-179.8	0	0	0	0	108.8	C303 H304 A305 F378 Y383 L386 L390 L392	C303-V440 HydrophobicContact CB-CG1 3.95Å; H304-V440 CarbonylContact O-C 3.47Å; H304-V440 VanDerWaalsContact O-CA 3.26Å; H304-V440 WeakPolarHBondContact O-CA 3.37Å; A305-V440 HydrophobicContact CB-CG2 4.41Å; F378-V440 HydrophobicContact CB-CB 4.37Å; F378-V440 WeakPolarHBondContact CB-O 3.22Å; F378-V440 HydrophobicContact CD2-CB 4.09Å; F378-V440 HydrophobicContact CD2-CG1 4.01Å; F378-V440 WeakPolarHBondContact CD2-O 3.26Å; F378-V440 PolarHBondContact N-O 2.98Å; Y383-V440 HydrophobicContact CD2-CG2 4.13Å; Y383-V440 HydrophobicContact CE2-CG2 4.48Å; L386-V440 HydrophobicContact CB-CG2 4.23Å; L386-V440 HydrophobicContact CD1-CB 4.33Å; L386-V440 HydrophobicContact CD1-CG2 4.38Å; L390-V440 HydrophobicContact CD1-CG1 4.32Å; L392-V440 HydrophobicContact CD1-CG1 3.9Å; L392-V440 HydrophobicContact CD1-CG2 3.77Å
441	H	98.3	Very high	98	Very high	2 Å²	2	8.5 Å²	8.5	1%	0.009	4%	0.044	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	159.3	-177.6	57.7	-87.4	0	0	0	112.8	C303 H304 D306 V376 V377 V439 F443	C303-H441 CarbonylContact C-O 3.56Å; C303-H441 VanDerWaalsContact CA-O 3.29Å; C303-H441 WeakPolarHBondContact CA-O 3.25Å; H304-H441 AromaticContact CD2-CE1 3.99Å; H304-H441 AromaticContact CD2-NE2 3.73Å; H304-H441 AromaticContact CE1-CD2 3.68Å; H304-H441 AromaticContact CE1-NE2 3.56Å; H304-H441 PolarHBondContact N-O 2.89Å; H304-H441 PolarHBondContact ND1-O 2.8Å; H304-H441 AromaticContact NE2-CD2 3.75Å; H304-H441 AromaticContact NE2-CE1 3.85Å; H304-H441 AromaticContact NE2-NE2 3.13Å; H304-H441 PolarHBondContact NE2-NE2 2.8Å; H304-H441 VanDerWaalsContact NE2-NE2 3.13Å; H304-H441 PolarHBondContact O-N 3.15Å; H304-H441 PolarHBondContact O-ND1 2.81Å; D306-H441 IonicContact OD2-CE1 3.73Å; D306-H441 PolarHBondContact OD2-CE1 3.32Å; D306-H441 IonicContact OD2-NE2 2.78Å; V376-H441 CarbonylContact O-C 3.55Å; V376-H441 WeakPolarHBondContact O-CA 3.2Å; V376-H441 WeakPolarHBondContact O-CB 3.42Å; V377-H441 HydrophobicContact CB-CB 4.42Å; V377-H441 HydrophobicContact CG1-CB 4.17Å; V377-H441 HydrophobicContact CG2-CB 4.28Å; V439-H441 HydrophobicContact CG1-CB 4.44Å; V439-H441 PolarHBondContact O-ND1 2.8Å; H441-F443 AromaticContact CD2-CD2 3.87Å; H441-F443 AromaticContact CD2-CE2 3.32Å; H441-F443 WeakPolarHBondContact CD2-CE2 3.48Å; H441-F443 AromaticContact NE2-CE2 3.73Å
442	Q	97.4	Very high	98.1	Very high	4 Å²	4	8.4 Å²	8.4	2%	0.019	4%	0.043	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	152.4	175	61.2	172.1	36.6	0	0	110.8	T301 C303 V375 V376 W406 A407	T301-Q442 WeakPolarHBondContact O-CB 3.42Å; C303-Q442 PolarHBondContact SG-OE1 3.01Å; V375-Q442 WeakPolarHBondContact CG1-O 3.43Å; V376-Q442 HydrophobicContact CB-CG 3.72Å; V376-Q442 HydrophobicContact CG2-CG 4.29Å; V376-Q442 PolarHBondContact N-O 2.96Å; V376-Q442 PolarHBondContact O-N 2.87Å; W406-Q442 HydrophobicContact CH2-CB 4.3Å; W406-Q442 HydrophobicContact CH2-CG 4.2Å; W406-Q442 HydrophobicContact CZ3-CB 3.95Å; W406-Q442 HydrophobicContact CZ3-CG 4.23Å; A407-Q442 PolarHBondContact O-NE2 3Å
443	F	97.7	Very high	98	Very high	16 Å²	16	9.1 Å²	9.1	7%	0.07	5%	0.049	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	132.7	-179.5	-74.3	-85.5	0	0	0	111.4	R300 T301 K373 V375 L427 Y433 I435 H441	R300-F443 CarbonylContact C-O 3.59Å; R300-F443 WeakPolarHBondContact CA-O 3.34Å; T301-F443 PolarHBondContact N-O 3.36Å; T301-F443 PolarHBondContact O-N 3.46Å; K373-F443 HydrophobicContact CB-CD1 4.38Å; K373-F443 HydrophobicContact CD-CD1 3.51Å; K373-F443 HydrophobicContact CD-CE1 4.02Å; K373-F443 HydrophobicContact CD-CG 4.37Å; V375-F443 HydrophobicContact CB-CD1 4.24Å; V375-F443 HydrophobicContact CB-CE1 4.24Å; V375-F443 HydrophobicContact CG1-CD1 3.79Å; V375-F443 HydrophobicContact CG1-CE1 3.57Å; V375-F443 HydrophobicContact CG1-CG 4.41Å; V375-F443 HydrophobicContact CG1-CZ 4.01Å; V375-F443 HydrophobicContact CG2-CD1 3.51Å; V375-F443 HydrophobicContact CG2-CE1 3.56Å; L427-F443 HydrophobicContact CD1-CE1 4.06Å; Y433-F443 HydrophobicContact CD2-CZ 4.4Å; Y433-F443 HydrophobicContact CE2-CE1 4.15Å; Y433-F443 AromaticContact CE2-CZ 3.58Å; Y433-F443 HydrophobicContact CE2-CZ 3.58Å; Y433-F443 AromaticContact CZ-CE1 3.98Å; Y433-F443 AromaticContact CZ-CZ 3.75Å; I435-F443 HydrophobicContact CD1-CE2 4.3Å; I435-F443 HydrophobicContact CD1-CZ 4.01Å; H441-F443 AromaticContact CD2-CD2 3.87Å; H441-F443 AromaticContact CD2-CE2 3.32Å; H441-F443 WeakPolarHBondContact CD2-CE2 3.48Å; H441-F443 AromaticContact NE2-CE2 3.73Å
444	K	98	Very high	98	Very high	45 Å²	45	9 Å²	9	20%	0.196	5%	0.049	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	121.8	165.8	175.4	-178.5	179	167.9	0	109.2	E259 R300 K373 D374 W406 V446	E259-K444 WeakPolarHBondContact OE1-CE 3.23Å; E259-K444 IonicContact OE1-NZ 2.83Å; E259-K444 PolarHBondContact OE1-NZ 3.44Å; R300-K444 HydrophobicContact CG-CG 4.45Å; K373-K444 CarbonylContact C-O 3.44Å; K373-K444 WeakPolarHBondContact CA-O 3.25Å; D374-K444 HydrophobicContact CB-CB 4.34Å; D374-K444 PolarHBondContact N-O 3.32Å; D374-K444 PolarHBondContact O-N 2.84Å; W406-K444 HydrophobicContact CH2-CB 3.87Å; W406-K444 HydrophobicContact CZ2-CB 3.99Å; K444-V446 HydrophobicContact CD-CG1 4.23Å; K444-V446 HydrophobicContact CG-CG1 4.19Å; K444-V446 PolarHBondContact O-N 3.31Å
445	S	98.4	Very high	97.9	Very high	7 Å²	7	10.9 Å²	10.9	5%	0.049	6%	0.057	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	112.8	170.9	-40.2	0	0	0	0	108.8	R256 G258 E259 D299 V372	R256-S445 WeakPolarHBondContact CB-OG 3.35Å; G258-S445 WeakPolarHBondContact CA-O 3.33Å; E259-S445 PolarHBondContact N-O 2.85Å; D299-S445 PolarHBondContact O-N 3.11Å; D299-S445 WeakPolarHBondContact OD1-CB 3.45Å; D299-S445 PolarHBondContact OD1-OG 3.02Å; D299-S445 WeakPolarHBondContact OD2-CB 3.4Å; V372-S445 CarbonylContact O-C 3.58Å; V372-S445 WeakPolarHBondContact O-CA 3.32Å
446	V	97.6	Very high	97.8	Very high	50 Å²	50	10.7 Å²	10.7	30%	0.303	6%	0.057	S	C	.	.			trans	-90.6	-21	-179.7	-61.5	0	0	0	0	112.5	I371 V372 D374 K444	I371-V446 HydrophobicContact CB-CG2 4.31Å; I371-V446 HydrophobicContact CG2-CG2 3.71Å; I371-V446 WeakPolarHBondContact O-CG2 3.22Å; V372-V446 PolarHBondContact O-N 3.06Å; D374-V446 HydrophobicContact CB-CG1 3.79Å; K444-V446 HydrophobicContact CD-CG1 4.23Å; K444-V446 HydrophobicContact CG-CG1 4.19Å; K444-V446 PolarHBondContact O-N 3.31Å
447	S	97.4	Very high	97.7	Very high	8 Å²	8	12 Å²	12	6%	0.056	6%	0.061	C	C	.	.	S	Bend	trans	-145.8	166.7	172.3	71.3	0	0	0	0	110.2	G190 R370 I371 V372 V449	G190-S447 WeakPolarHBondContact O-CB 3.34Å; R370-S447 WeakPolarHBondContact CD-OG 3.5Å; R370-S447 PolarHBondContact NE-OG 2.98Å; I371-S447 PolarHBondContact O-OG 3.35Å; V372-S447 WeakPolarHBondContact CA-OG 3.42Å; V372-S447 PolarHBondContact O-N 3.22Å; S447-V449 PolarHBondContact O-N 2.78Å
448	A	98	Very high	97.7	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	6%	0.059	C	C	.	.			trans	-61.5	126.7	-177.7	0	0	0	0	0	111.5	Y187 G190 Y192 R256 V326 R370	Y187-A448 HydrophobicContact CE2-CB 4.38Å; G190-A448 VanDerWaalsContact O-CB 3.26Å; G190-A448 WeakPolarHBondContact O-CB 3.42Å; G190-A448 PolarHBondContact O-N 3Å; Y192-A448 HydrophobicContact CD1-CB 3.51Å; Y192-A448 HydrophobicContact CE1-CB 3.68Å; R256-A448 CarbonylContact O-C 3.54Å; R256-A448 WeakPolarHBondContact O-CA 3.49Å; V326-A448 HydrophobicContact CB-CB 3.87Å; V326-A448 HydrophobicContact CG2-CB 4.19Å; V326-A448 PolarHBondContact N-O 2.9Å; R370-A448 PolarHBondContact NH2-O 3.26Å
449	V	98.3	Very high	97.5	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	135.2	-170.9	62.3	0	0	0	0	111	S255 R256 L323 K324 V372 S447	S255-V449 CarbonylContact C-O 3.55Å; S255-V449 WeakPolarHBondContact CA-O 3.43Å; S255-V449 PolarHBondContact OG-O 2.65Å; R256-V449 HydrophobicContact CB-CG1 4.23Å; R256-V449 PolarHBondContact N-O 2.85Å; R256-V449 PolarHBondContact O-N 3.43Å; L323-V449 HydrophobicContact CB-CG2 4.33Å; L323-V449 HydrophobicContact CD2-CG2 4.16Å; K324-V449 CarbonylContact O-C 3.53Å; K324-V449 WeakPolarHBondContact O-CA 3.37Å; V372-V449 HydrophobicContact CB-CB 3.76Å; V372-V449 HydrophobicContact CB-CG1 4.3Å; V372-V449 HydrophobicContact CB-CG2 3.74Å; V372-V449 HydrophobicContact CG1-CB 3.95Å; V372-V449 HydrophobicContact CG1-CG2 3.98Å; V372-V449 HydrophobicContact CG2-CB 4.48Å; V372-V449 HydrophobicContact CG2-CG2 3.92Å; S447-V449 PolarHBondContact O-N 2.78Å
450	S	98.2	Very high	97.2	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	131.5	160.8	-62.4	0	0	0	0	109.5	L148 W254 S255 K324	L148-S450 WeakPolarHBondContact CG-OG 3.38Å; W254-S450 CarbonylContact O-C 3.56Å; W254-S450 VanDerWaalsContact O-CA 3.23Å; W254-S450 WeakPolarHBondContact O-CA 3.24Å; S255-S450 PolarHBondContact OG-OG 3.37Å; K324-S450 PolarHBondContact N-O 2.97Å; K324-S450 PolarHBondContact O-N 3.11Å
451	S	98.4	Very high	96.8	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	141.5	178.2	-54	0	0	0	0	109.2	L253 W254 L322 L323 K373	L253-S451 VanDerWaalsContact CA-O 3.27Å; L253-S451 WeakPolarHBondContact CA-O 2.78Å; W254-S451 VanDerWaalsContact CZ2-CB 3.5Å; W254-S451 PolarHBondContact N-O 3.32Å; W254-S451 PolarHBondContact O-N 3.04Å; L322-S451 WeakPolarHBondContact O-CA 3.31Å; L323-S451 WeakPolarHBondContact CD2-OG 3.28Å; K373-S451 VanDerWaalsContact CE-OG 3.32Å; K373-S451 WeakPolarHBondContact CE-OG 3.42Å; K373-S451 PolarHBondContact NZ-OG 2.72Å
452	I	98.2	Very high	96.1	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	133.9	160.1	-57.3	176	0	0	0	106.8	L147 I202 L217 I221 P251 I252 L253 G321 L322 W454	L147-I452 HydrophobicContact CD1-CD1 3.9Å; L147-I452 HydrophobicContact CD1-CG1 3.78Å; L147-I452 HydrophobicContact CD2-CD1 3.99Å; I202-I452 HydrophobicContact CD1-CD1 4Å; I202-I452 HydrophobicContact CD1-CG1 4.14Å; I202-I452 HydrophobicContact CD1-CG2 3.99Å; L217-I452 HydrophobicContact CD1-CD1 4.28Å; L217-I452 HydrophobicContact CD2-CD1 3.97Å; L217-I452 HydrophobicContact CG-CD1 4.29Å; I221-I452 HydrophobicContact CD1-CG2 4.36Å; P251-I452 HydrophobicContact CB-CG2 3.68Å; I252-I452 CarbonylContact O-C 3.55Å; I252-I452 VanDerWaalsContact O-CA 3.23Å; I252-I452 WeakPolarHBondContact O-CA 3.48Å; L253-I452 HydrophobicContact CB-CG1 4.17Å; L253-I452 HydrophobicContact CD1-CD1 4.12Å; L253-I452 HydrophobicContact CD1-CG1 3.88Å; L253-I452 HydrophobicContact CG-CG1 4.11Å; G321-I452 CarbonylContact C-O 3.55Å; G321-I452 WeakPolarHBondContact CA-O 3.48Å; L322-I452 HydrophobicContact CB-CB 4.31Å; L322-I452 HydrophobicContact CD2-CD1 4.4Å; L322-I452 PolarHBondContact N-O 2.73Å; L322-I452 PolarHBondContact O-N 3.08Å; I452-W454 HydrophobicContact CG2-CE3 3.95Å; I452-W454 HydrophobicContact CG2-CZ3 3.73Å
453	A	98.2	Very high	95	Very high	16 Å²	16	23.2 Å²	23.2	13%	0.132	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	158.7	174.1	0	0	0	0	0	112.4	P251 I252 W254 V320	P251-A453 WeakPolarHBondContact CA-O 3.43Å; I252-A453 PolarHBondContact N-O 3.44Å; I252-A453 PolarHBondContact O-N 3.1Å; W254-A453 HydrophobicContact CH2-CB 3.45Å; W254-A453 VanDerWaalsContact CH2-CB 3.45Å; W254-A453 HydrophobicContact CZ3-CB 3.62Å; V320-A453 WeakPolarHBondContact O-CA 3.32Å; V320-A453 VanDerWaalsContact O-CB 3.23Å; V320-A453 WeakPolarHBondContact O-CB 3.37Å
454	W	97.8	Very high	93.2	Very high	6 Å²	6	25.6 Å²	25.6	2%	0.023	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	163.6	176.5	56	94.3	0	0	0	110.4	I221 L227 V230 P232 D249 P251 V320 I452	I221-W454 HydrophobicContact CD1-CH2 4.41Å; I221-W454 HydrophobicContact CD1-CZ3 4.18Å; I221-W454 HydrophobicContact CG2-CH2 3.73Å; I221-W454 HydrophobicContact CG2-CZ2 4.11Å; I221-W454 HydrophobicContact CG2-CZ3 4.49Å; L227-W454 HydrophobicContact CB-CZ2 4.39Å; L227-W454 HydrophobicContact CD1-CH2 4.37Å; L227-W454 HydrophobicContact CD2-CH2 3.86Å; L227-W454 HydrophobicContact CD2-CZ2 3.94Å; L227-W454 HydrophobicContact CG-CH2 4.48Å; V230-W454 PolarHBondContact O-NE1 3.49Å; P232-W454 HydrophobicContact CG-CB 4.11Å; P232-W454 HydrophobicContact CG-CG 4.2Å; D249-W454 CarbonylContact O-C 3.53Å; D249-W454 WeakPolarHBondContact O-CA 3.28Å; D249-W454 WeakPolarHBondContact O-CB 3.19Å; P251-W454 HydrophobicContact CB-CB 4.37Å; P251-W454 HydrophobicContact CB-CD2 4.39Å; P251-W454 HydrophobicContact CB-CE3 3.73Å; P251-W454 HydrophobicContact CB-CZ3 4.4Å; P251-W454 HydrophobicContact CG-CB 4.18Å; P251-W454 HydrophobicContact CG-CD2 3.94Å; P251-W454 HydrophobicContact CG-CE3 3.65Å; P251-W454 HydrophobicContact CG-CG 4.22Å; P251-W454 HydrophobicContact CG-CZ3 4.29Å; V320-W454 HydrophobicContact CB-CD2 4.02Å; V320-W454 HydrophobicContact CB-CG 4.3Å; V320-W454 HydrophobicContact CB-CZ2 3.92Å; V320-W454 HydrophobicContact CG1-CD2 4.36Å; V320-W454 HydrophobicContact CG1-CH2 3.96Å; V320-W454 HydrophobicContact CG1-CZ2 3.42Å; V320-W454 VanDerWaalsContact CG1-CZ2 3.42Å; V320-W454 PolarHBondContact N-O 3.14Å; V320-W454 PolarHBondContact O-N 3.02Å; I452-W454 HydrophobicContact CG2-CE3 3.95Å; I452-W454 HydrophobicContact CG2-CZ3 3.73Å
455	H	97.3	Very high	91.4	Very high	39 Å²	39	27.4 Å²	27.4	18%	0.181	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	152.5	168.6	-59	141.2	0	0	0	110.8	D249 D306 H307 T317 A318	D249-H455 HydrophobicContact CB-CB 4.02Å; D249-H455 PolarHBondContact O-N 3.26Å; D306-H455 WeakPolarHBondContact CB-NE2 3.36Å; D306-H455 VanDerWaalsContact CG-NE2 3.32Å; D306-H455 IonicContact OD1-CD2 3.82Å; D306-H455 IonicContact OD1-CE1 3.73Å; D306-H455 IonicContact OD1-NE2 2.84Å; D306-H455 PolarHBondContact OD1-NE2 3.03Å; H307-H455 PolarHBondContact O-CE1 3.35Å; T317-H455 HydrophobicContact CG2-CB 3.61Å; A318-H455 CarbonylContact O-C 3.59Å; A318-H455 WeakPolarHBondContact O-CA 3.05Å
456	V	97	Very high	89.1	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	115.1	173.7	62.7	0	0	0	0	109.9	V230 T317 A318 V320 L458	V230-V456 HydrophobicContact CB-CG1 4.48Å; V230-V456 HydrophobicContact CB-CG2 4.34Å; T317-V456 PolarHBondContact OG1-O 3.32Å; A318-V456 HydrophobicContact CB-CG1 3.68Å; A318-V456 PolarHBondContact N-O 3.47Å; A318-V456 PolarHBondContact O-N 3.27Å; V320-V456 HydrophobicContact CG2-CB 4.47Å; V320-V456 HydrophobicContact CG2-CG1 3.93Å; V456-L458 HydrophobicContact CG1-CD2 4.12Å; V456-L458 HydrophobicContact CG1-CG 4.19Å; V456-L458 HydrophobicContact CG2-CD2 3.83Å; V456-L458 HydrophobicContact CG2-CG 4.36Å; V456-L458 PolarHBondContact O-N 2.89Å; V456-L458 VanDerWaalsContact O-N 3.07Å
457	R	96	Very high	87	Confident	30 Å²	30	40.2 Å²	40.2	11%	0.113	19%	0.186	C	C	.	.			trans	-80.4	83.3	176.6	-58.4	-176.8	-164.7	-146	-2.3	109.1	S237 S238 D249 D309 K459 Y462	S237-R457 CarbonylContact C-O 3.57Å; S237-R457 WeakPolarHBondContact CA-O 3.31Å; S238-R457 PolarHBondContact N-O 2.92Å; S238-R457 VanDerWaalsContact OG-CB 3.31Å; S238-R457 WeakPolarHBondContact OG-CB 3.49Å; S238-R457 PolarHBondContact OG-O 2.88Å; D249-R457 IonicContact OD1-CZ 3.26Å; D249-R457 IonicContact OD1-NE 3.92Å; D249-R457 PolarHBondContact OD1-NE 3.06Å; D249-R457 IonicContact OD1-NH2 3.01Å; D249-R457 PolarHBondContact OD1-NH2 2.89Å; D249-R457 IonicContact OD2-CZ 2.79Å; D249-R457 IonicContact OD2-NE 3.18Å; D249-R457 PolarHBondContact OD2-NE 3.07Å; D249-R457 IonicContact OD2-NH2 3.67Å; D309-R457 IonicContact OD1-CZ 2.96Å; D309-R457 IonicContact OD1-NH1 3.73Å; D309-R457 PolarHBondContact OD1-NH1 2.71Å; D309-R457 IonicContact OD1-NH2 2.87Å; D309-R457 PolarHBondContact OD1-NH2 3.22Å; D309-R457 IonicContact OD2-CZ 2.63Å; D309-R457 IonicContact OD2-NH1 3.67Å; D309-R457 PolarHBondContact OD2-NH1 3.44Å; R457-K459 PolarHBondContact O-N 3.3Å; R457-Y462 HydrophobicContact CB-CE2 3.76Å; R457-Y462 WeakPolarHBondContact CB-OH 3.38Å
458	L	96	Very high	84.8	Confident	2 Å²	2	43 Å²	43	1%	0.01	20%	0.201	C	C	.	.	B	Isolated β-bridge	trans	-63.9	127.9	-174.3	-62.7	169.8	0	0	0	112.5	F117 L236 A318 V456 N460 Y461 Y462	F117-L458 HydrophobicContact CB-CD1 3.81Å; F117-L458 HydrophobicContact CD1-CD1 3.64Å; F117-L458 HydrophobicContact CD2-CD1 3.46Å; F117-L458 VanDerWaalsContact CD2-CD1 3.46Å; F117-L458 HydrophobicContact CD2-CD2 4.2Å; F117-L458 HydrophobicContact CE1-CD1 3.97Å; F117-L458 HydrophobicContact CE2-CD1 3.79Å; F117-L458 HydrophobicContact CE2-CD2 4.2Å; F117-L458 HydrophobicContact CG-CD1 3.38Å; F117-L458 HydrophobicContact CZ-CD1 4.03Å; L236-L458 HydrophobicContact CB-CD2 3.85Å; L236-L458 WeakPolarHBondContact O-CA 3.47Å; A318-L458 HydrophobicContact CB-CD1 3.92Å; A318-L458 HydrophobicContact CB-CG 4.34Å; V456-L458 HydrophobicContact CG1-CD2 4.12Å; V456-L458 HydrophobicContact CG1-CG 4.19Å; V456-L458 HydrophobicContact CG2-CD2 3.83Å; V456-L458 HydrophobicContact CG2-CG 4.36Å; V456-L458 PolarHBondContact O-N 2.89Å; V456-L458 VanDerWaalsContact O-N 3.07Å; L458-N460 VanDerWaalsContact C-N 3.27Å; L458-N460 WeakPolarHBondContact CB-OD1 3.14Å; L458-N460 PolarHBondContact O-N 2.84Å; L458-Y461 HydrophobicContact CB-CD1 4.45Å; L458-Y461 HydrophobicContact CB-CD2 3.91Å; L458-Y461 HydrophobicContact CB-CE2 4.19Å; L458-Y461 HydrophobicContact CB-CG 4.07Å; L458-Y461 HydrophobicContact CD1-CD2 4.21Å; L458-Y461 HydrophobicContact CD1-CE1 4.21Å; L458-Y461 HydrophobicContact CD1-CE2 3.61Å; L458-Y461 HydrophobicContact CG-CD2 4.45Å; L458-Y461 HydrophobicContact CG-CE2 4.28Å; L458-Y461 VanDerWaalsContact O-CB 3.3Å; L458-Y461 WeakPolarHBondContact O-CB 3.43Å; L458-Y461 PolarHBondContact O-N 3.13Å; L458-Y462 WeakPolarHBondContact O-CD2 3.27Å; L458-Y462 VanDerWaalsContact O-CE2 3.23Å; L458-Y462 WeakPolarHBondContact O-CE2 3.33Å
459	K	94	Very high	82.5	Confident	82 Å²	82	48.7 Å²	48.7	36%	0.357	23%	0.231	S	C	.	.	H	α-helix	trans	-48.9	-47.4	-177.7	-71.4	179.1	-170.7	-178.4	0	113.1	V235 L236 S237 R457 Y461 Y462 D463	V235-K459 WeakPolarHBondContact O-CE 3.49Å; V235-K459 PolarHBondContact O-NZ 2.73Å; L236-K459 PolarHBondContact O-N 3.49Å; S237-K459 WeakPolarHBondContact O-CE 3.48Å; S237-K459 WeakPolarHBondContact O-CG 3.47Å; R457-K459 PolarHBondContact O-N 3.3Å; K459-Y461 PolarHBondContact O-N 2.87Å; K459-Y461 VanDerWaalsContact O-N 3.1Å; K459-Y462 PolarHBondContact O-N 3.47Å; K459-D463 PolarHBondContact O-N 2.94Å; K459-D463 VanDerWaalsContact O-N 3.09Å
460	N	90.7	Very high	80.1	Confident	55 Å²	55	53.8 Å²	53.8	29%	0.294	26%	0.262	S	S	.	.	H	α-helix	trans	-62.1	-20.1	-176.7	66.2	-27.5	0	0	0	114	L458 Y462 Q464	L458-N460 VanDerWaalsContact C-N 3.27Å; L458-N460 WeakPolarHBondContact CB-OD1 3.14Å; L458-N460 PolarHBondContact O-N 2.84Å; N460-Y462 VanDerWaalsContact C-N 3.34Å; N460-Q464 WeakPolarHBondContact O-CG 3.4Å
461	Y	89.9	Confident	77.6	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-75.6	-24	177.2	-73.6	-3.2	0	0	0	113.3	F117 E119 A318 R437 L458 K459	F117-Y461 WeakPolarHBondContact CD1-OH 3.48Å; F117-Y461 WeakPolarHBondContact O-CE1 3.47Å; E119-Y461 VanDerWaalsContact CD-CE1 3.47Å; E119-Y461 HydrophobicContact CG-CD1 4.24Å; E119-Y461 HydrophobicContact CG-CE1 3.69Å; A318-Y461 HydrophobicContact CB-CE2 4.18Å; R437-Y461 HydrophobicContact CB-CD2 4.2Å; R437-Y461 HydrophobicContact CB-CE2 3.75Å; R437-Y461 VanDerWaalsContact CD-CD2 3.42Å; R437-Y461 HydrophobicContact CG-CD2 3.78Å; R437-Y461 HydrophobicContact CG-CE2 3.44Å; R437-Y461 VanDerWaalsContact CG-CE2 3.44Å; R437-Y461 HydrophobicContact CG-CG 4.49Å; R437-Y461 VanDerWaalsContact CZ-CB 3.47Å; R437-Y461 PolarHBondContact NH1-O 3.01Å; R437-Y461 PolarHBondContact NH2-O 3.29Å; R437-Y461 VanDerWaalsContact NH2-O 3.16Å; L458-Y461 HydrophobicContact CB-CD1 4.45Å; L458-Y461 HydrophobicContact CB-CD2 3.91Å; L458-Y461 HydrophobicContact CB-CE2 4.19Å; L458-Y461 HydrophobicContact CB-CG 4.07Å; L458-Y461 HydrophobicContact CD1-CD2 4.21Å; L458-Y461 HydrophobicContact CD1-CE1 4.21Å; L458-Y461 HydrophobicContact CD1-CE2 3.61Å; L458-Y461 HydrophobicContact CG-CD2 4.45Å; L458-Y461 HydrophobicContact CG-CE2 4.28Å; L458-Y461 VanDerWaalsContact O-CB 3.3Å; L458-Y461 WeakPolarHBondContact O-CB 3.43Å; L458-Y461 PolarHBondContact O-N 3.13Å; K459-Y461 PolarHBondContact O-N 2.87Å; K459-Y461 VanDerWaalsContact O-N 3.1Å
462	Y	82.7	Confident	74.9	Confident	44 Å²	44	60.9 Å²	60.9	17%	0.173	32%	0.322	C	S	.	.	H	α-helix	trans	-105	-32.1	-176.7	-50.7	-79.7	0	0	0	112.2	H315 R457 L458 K459 N460 Q464 L465	H315-Y462 AromaticContact CE1-CE1 3.74Å; H315-Y462 AromaticContact CE1-CZ 3.73Å; H315-Y462 PolarHBondContact CE1-OH 2.93Å; H315-Y462 AromaticContact NE2-CE1 3.75Å; H315-Y462 PolarHBondContact NE2-OH 2.88Å; R457-Y462 HydrophobicContact CB-CE2 3.76Å; R457-Y462 WeakPolarHBondContact CB-OH 3.38Å; L458-Y462 WeakPolarHBondContact O-CD2 3.27Å; L458-Y462 VanDerWaalsContact O-CE2 3.23Å; L458-Y462 WeakPolarHBondContact O-CE2 3.33Å; K459-Y462 PolarHBondContact O-N 3.47Å; N460-Y462 VanDerWaalsContact C-N 3.34Å; Y462-Q464 PolarHBondContact O-N 2.74Å; Y462-L465 HydrophobicContact CD1-CD1 4.43Å; Y462-L465 PolarHBondContact O-N 2.9Å; Y462-L465 VanDerWaalsContact O-N 3.14Å
463	D	74.2	Confident	72.1	Confident	88 Å²	88	69 Å²	69	47%	0.471	36%	0.362	S	S	.	.	H	α-helix	trans	-59.4	-31	174.6	-66.2	-18.1	0	0	0	112.1	K459	K459-D463 PolarHBondContact O-N 2.94Å; K459-D463 VanDerWaalsContact O-N 3.09Å
464	Q	60.2	Low	69.1	Low	66 Å²	66	72.5 Å²	72.5	31%	0.308	39%	0.386	S	S	.	.	H	α-helix	trans	-75.4	-31.7	179	-68.6	-176.7	12.9	0	0	112.8	N460 Y462 Q466 R467 D468	N460-Q464 WeakPolarHBondContact O-CG 3.4Å; Y462-Q464 PolarHBondContact O-N 2.74Å; Q464-Q466 VanDerWaalsContact C-N 3.31Å; Q464-Q466 PolarHBondContact O-N 3.49Å; Q464-R467 PolarHBondContact O-N 3.48Å; Q464-D468 PolarHBondContact O-N 3.27Å
465	L	60.4	Low	66.1	Low	83 Å²	83	81.4 Å²	81.4	44%	0.435	43%	0.427	S	S	.	.	H	α-helix	trans	-64.6	-39.5	178.1	-69	168.5	0	0	0	110.9	Y462 R467 D468 D469	Y462-L465 HydrophobicContact CD1-CD1 4.43Å; Y462-L465 PolarHBondContact O-N 2.9Å; Y462-L465 VanDerWaalsContact O-N 3.14Å; L465-R467 VanDerWaalsContact C-N 3.25Å; L465-R467 PolarHBondContact O-N 3.02Å; L465-D468 PolarHBondContact O-N 3.31Å; L465-D469 PolarHBondContact O-N 2.94Å
466	Q	51	Low	63.2	Low	141 Å²	141	88.2 Å²	88.2	66%	0.659	46%	0.459	S	S	*	.	H	α-helix	trans	-65.4	-26.5	178.6	-65.8	-175.8	5.1	0	0	113.5	Q464 T470	Q464-Q466 VanDerWaalsContact C-N 3.31Å; Q464-Q466 PolarHBondContact O-N 3.49Å; Q466-T470 PolarHBondContact O-OG1 3.18Å
467	R	54.1	Low	60.4	Low	185 Å²	185	96.1 Å²	96.1	70%	0.698	50%	0.501	S	S	*	.	H	α-helix	trans	-76.3	-36	177.9	-68	-177	-174.3	179.2	1.1	112.3	Q464 L465 T470 S471	Q464-R467 PolarHBondContact O-N 3.48Å; L465-R467 VanDerWaalsContact C-N 3.25Å; L465-R467 PolarHBondContact O-N 3.02Å; R467-T470 PolarHBondContact O-N 2.87Å; R467-T470 PolarHBondContact O-OG1 3.06Å; R467-S471 PolarHBondContact O-N 2.67Å
468	D	50.8	Low	57.8	Low	67 Å²	67	102.3 Å²	102.3	36%	0.358	54%	0.536	S	S	.	.	H	α-helix	trans	-69.8	-39.5	-177.9	-69.8	-23	0	0	0	110.8	R121 Q464 L465 T470 S471	R121-D468 IonicContact CZ-OD2 3.64Å; R121-D468 VanDerWaalsContact CZ-OD2 3.3Å; R121-D468 IonicContact NE-OD2 3.61Å; R121-D468 IonicContact NH2-OD2 3.03Å; R121-D468 PolarHBondContact NH2-OD2 3.35Å; Q464-D468 PolarHBondContact O-N 3.27Å; L465-D468 PolarHBondContact O-N 3.31Å; D468-T470 VanDerWaalsContact C-N 3.32Å; D468-T470 PolarHBondContact O-N 3.5Å; D468-S471 PolarHBondContact O-N 3.1Å; D468-S471 VanDerWaalsContact O-N 3.14Å; D468-S471 PolarHBondContact O-OG 3.35Å
469	D	49.4	Very low	55.1	Low	118 Å²	118	106.3 Å²	106.3	63%	0.631	57%	0.565	S	S	*	*	H	α-helix	trans	-65.2	-31.6	177.5	-70.3	-21.1	0	0	0	113.2	L465 S471	L465-D469 PolarHBondContact O-N 2.94Å; D469-S471 VanDerWaalsContact C-N 3.35Å
470	T	46.9	Very low	52.5	Low	107 Å²	107	108.9 Å²	108.9	66%	0.656	58%	0.583	S	S	*	*	H	α-helix	trans	-76.6	-18.8	175.4	38.8	0	0	0	0	114.3	Q466 R467 D468	Q466-T470 PolarHBondContact O-OG1 3.18Å; R467-T470 PolarHBondContact O-N 2.87Å; R467-T470 PolarHBondContact O-OG1 3.06Å; D468-T470 VanDerWaalsContact C-N 3.32Å; D468-T470 PolarHBondContact O-N 3.5Å
471	S	45.8	Very low	50.1	Low	84 Å²	84	113.2 Å²	113.2	59%	0.587	61%	0.605	S	S	*	*	H	α-helix	trans	-89.6	-13.2	-179.4	66.7	0	0	0	0	114	R467 D468 D469	R467-S471 PolarHBondContact O-N 2.67Å; D468-S471 PolarHBondContact O-N 3.1Å; D468-S471 VanDerWaalsContact O-N 3.14Å; D468-S471 PolarHBondContact O-OG 3.35Å; D469-S471 VanDerWaalsContact C-N 3.35Å
472	G	42.5	Very low	47.7	Very low	66 Å²	66	122.9 Å²	122.9	68%	0.68	65%	0.647	S	S	*	*	S	Bend	trans	-93.7	-4	-179.2	0	0	0	0	0	115.8
473	M	39.2	Very low	45.5	Very low	171 Å²	171	128.5 Å²	128.5	84%	0.842	68%	0.68	S	S	*	*	S	Bend	trans	-104.2	6.8	-172	-118.6	90.1	96.7	0	0	115.1
474	S	35.2	Very low	43.7	Very low	89 Å²	89	129.1 Å²	129.1	62%	0.622	69%	0.689	S	S	*	*	S	Bend	trans	-131.3	78.8	-179.4	60	0	0	0	0	111
475	E	34.5	Very low	42.6	Very low	192 Å²	192	133.1 Å²	133.1	90%	0.897	71%	0.712	S	S	*	*			trans	179.6	74.6	154.4	-101.9	168.5	-151.7	0	0	110.2
476	H	36	Very low	41.5	Very low	183 Å²	183	137.8 Å²	137.8	85%	0.847	73%	0.731	S	S	*	*			trans	-145.7	98.9	158.7	-111.6	-17.5	0	0	0	107.7
477	N	39.2	Very low	40.6	Very low	165 Å²	165	135.1 Å²	135.1	88%	0.882	73%	0.734	S	S	*	*			trans	159	93.1	157.2	-80.6	-18.4	0	0	0	106.8
478	D	40.2	Very low	39.7	Very low	160 Å²	160	136.8 Å²	136.8	86%	0.856	74%	0.742	S	S	*	*				177.5	149.1	103.6	-136	-22.5	0	0	0	110.3
479	S	40.3	Very low	38.9	Very low	87 Å²	87	141.3 Å²	141.3	61%	0.608	76%	0.761	S	S	*	*			trans	-78.2	165.6	-170.6	34.7	0	0	0	0	114.9
480	D	39.7	Very low	38.1	Very low	136 Å²	136	141 Å²	141	73%	0.727	77%	0.767	S	S	*	*			trans	94.4	98.3	151.3	-63	-22.9	0	0	0	121.2
481	L	40.9	Very low	37.7	Very low	145 Å²	145	140.8 Å²	140.8	76%	0.759	77%	0.771	S	S	*	*				50	96.7	115	-72.6	158.7	0	0	0	119
482	K	38.8	Very low	37.3	Very low	203 Å²	203	145.7 Å²	145.7	88%	0.883	78%	0.784	S	S	*	*				157.9	142.4	108.2	-88.1	174.3	179.4	177.6	0	112.8
483	N	35.8	Very low	37.1	Very low	162 Å²	162	147.4 Å²	147.4	87%	0.866	79%	0.786	S	S	*	*			trans	-65	169	-173.8	-107.8	-3.5	0	0	0	116
484	P	37.1	Very low	37.1	Very low	102 Å²	102	145.3 Å²	145.3	66%	0.662	78%	0.777	S	S	*	*			trans	-106	167.5	-144.2	41.7	-35.6	0	0	0	113.9
485	D	36.4	Very low	37.2	Very low	149 Å²	149	150.4 Å²	150.4	80%	0.797	79%	0.788	S	S	*	*			trans	-172	152.5	144.8	-95.6	-30.1	0	0	0	112
486	H	38.2	Very low	37.1	Very low	181 Å²	181	146 Å²	146	84%	0.838	78%	0.778	S	S	*	*			trans	95.3	103.2	166.7	-68.6	-69.4	0	0	0	120.9
487	A	31.7	Very low	37	Very low	86 Å²	86	143.4 Å²	143.4	71%	0.711	78%	0.775	S	S	*	*			trans	-56.7	148	152.4	0	0	0	0	0	112.9
488	Y	34.6	Very low	37	Very low	220 Å²	220	141.1 Å²	141.1	86%	0.863	77%	0.772	S	S	*	*				-169.7	154.4	128.4	-112	-81.9	0	0	0	111.1
489	Q	33.9	Very low	36.7	Very low	162 Å²	162	142.3 Å²	142.3	76%	0.757	77%	0.772	S	S	*	*			trans	-81.1	161.3	-162.6	-69.2	164.1	-36.2	0	0	115.9
490	S	33.4	Very low	36.4	Very low	110 Å²	110	147 Å²	147	77%	0.769	79%	0.79	S	S	*	*			trans	92.3	142.7	130.7	65.7	0	0	0	0	123.6
491	S	39.1	Very low	36	Very low	104 Å²	104	145.6 Å²	145.6	73%	0.727	79%	0.791	S	S	*	*			trans	87.7	98.5	163.9	68.3	0	0	0	0	117.2
492	E	36.9	Very low	35.8	Very low	187 Å²	187	145.2 Å²	145.2	87%	0.874	79%	0.794	S	S	*	*				72.9	112.2	87.7	-79	-171.7	176.5	0	0	111.8
493	S	37.3	Very low	35.7	Very low	102 Å²	102	142.8 Å²	142.8	71%	0.713	79%	0.79	S	S	*	*				162.2	143.4	69.7	44.5	0	0	0	0	106.4
494	I	39.1	Very low	35.5	Very low	127 Å²	127	142.6 Å²	142.6	65%	0.651	79%	0.789	S	S	*	*				160.6	128.1	92.8	-78.5	-168.6	0	0	0	109.3
495	K	38	Very low	35.3	Very low	196 Å²	196	145.1 Å²	145.1	85%	0.852	80%	0.797	S	S	*	*			trans	60.3	147.6	149.1	-64.1	166.6	-165.4	171.7	0	119.7
496	S	32.4	Very low	35.3	Very low	100 Å²	100	144.2 Å²	144.2	70%	0.699	80%	0.796	S	S	*	*			cis	178.3	135.8	-7.5	176	0	0	0	0	104.6
497	T	34.6	Very low	35.1	Very low	128 Å²	128	143.2 Å²	143.2	79%	0.785	80%	0.797	S	S	*	*			trans	170.5	121	132.2	37.3	0	0	0	0	113.4
498	S	38.1	Very low	35.4	Very low	117 Å²	117	145.3 Å²	145.3	82%	0.818	80%	0.802	S	S	*	*			trans	64	106.8	144.4	59.1	0	0	0	0	121.4
499	E	34.6	Very low	35.5	Very low	184 Å²	184	142 Å²	142	86%	0.86	80%	0.798	S	S	*	*			trans	-70.3	138	170.6	-61.2	170.9	138.7	0	0	113.8
500	L	34.1	Very low	35.4	Very low	185 Å²	185	138.9 Å²	138.9	97%	0.969	80%	0.795	S	S	*	*			trans	-156.4	84.8	138.2	-132.7	107.3	0	0	0	108.3
501	S	31	Very low	35.5	Very low	108 Å²	108	141.5 Å²	141.5	76%	0.755	80%	0.8	S	S	*	*			trans	-130.4	114.9	174.1	56.4	0	0	0	0	109.7
502	V	37.4	Very low	35.3	Very low	136 Å²	136	145.2 Å²	145.2	82%	0.824	81%	0.811	S	S	*	*			trans	-140	115	167.1	176.5	0	0	0	0	108.1
503	L	35.5	Very low	35.3	Very low	153 Å²	153	145.9 Å²	145.9	80%	0.801	81%	0.811	S	S	*	*			trans	83.2	80.9	159.7	-60.3	161.9	0	0	0	118.6
504	N	31.4	Very low	35.1	Very low	158 Å²	158	150.9 Å²	150.9	85%	0.845	82%	0.82	S	S	*	*			trans	-118.8	119.2	132.1	-83	-26.3	0	0	0	106.1
505	D	33.3	Very low	35	Very low	154 Å²	154	150.3 Å²	150.3	82%	0.824	83%	0.827	S	S	*	*			trans	163.2	100.1	152.7	-83.8	-16.1	0	0	0	108.4
506	V	37.3	Very low	34.9	Very low	130 Å²	130	146.6 Å²	146.6	79%	0.788	82%	0.823	S	S	*	*			trans	-141.5	97.6	151.9	-175.2	0	0	0	0	107.6	T508	V506-T508 HydrophobicContact CG1-CG2 4.1Å; V506-T508 PolarHBondContact O-N 2.93Å
507	D	33.7	Very low	34.9	Very low	160 Å²	160	150.2 Å²	150.2	86%	0.856	83%	0.829	S	S	*	*			trans	-60.2	107.7	154.2	-80.4	-40.8	0	0	0	109	N509	D507-N509 PolarHBondContact O-N 3.16Å
508	T	37.2	Very low	35	Very low	131 Å²	131	150 Å²	150	80%	0.804	83%	0.833	S	S	*	*			trans	-87.1	88.1	164.7	42.5	0	0	0	0	109.4	V506	V506-T508 HydrophobicContact CG1-CG2 4.1Å; V506-T508 PolarHBondContact O-N 2.93Å
509	N	36.5	Very low	34.8	Very low	149 Å²	149	150.8 Å²	150.8	80%	0.797	83%	0.827	S	S	*	*			trans	-66.5	135.2	158	-106.3	-29.6	0	0	0	109.9	D507	D507-N509 PolarHBondContact O-N 3.16Å
510	S	33	Very low	34.9	Very low	97 Å²	97	150.9 Å²	150.9	68%	0.678	83%	0.827	S	S	*	*			trans	-42.6	128.8	173.9	52.1	0	0	0	0	114.6
511	N	34.2	Very low	34.9	Very low	166 Å²	166	146.5 Å²	146.5	89%	0.888	81%	0.811	S	S	*	*			trans	-163	84	149.4	-93.8	-38.5	0	0	0	110.4	K513	N511-K513 PolarHBondContact O-N 3.28Å
512	L	36.4	Very low	35.2	Very low	181 Å²	181	146.5 Å²	146.5	95%	0.948	81%	0.811	S	S	*	*			trans	-75.9	105	166.5	-96.4	147.4	0	0	0	109.2	K514	L512-K514 PolarHBondContact O-N 3.49Å
513	K	37.2	Very low	35.1	Very low	201 Å²	201	144.3 Å²	144.3	87%	0.874	81%	0.807	S	S	*	*			trans	-71.7	117.6	165.6	-103.7	176.9	174.1	177.4	0	109.3	N511	N511-K513 PolarHBondContact O-N 3.28Å
514	K	32.5	Very low	35.1	Very low	207 Å²	207	143.3 Å²	143.3	90%	0.9	80%	0.803	S	S	*	*			trans	-61.9	141.3	164.6	-72.8	175.8	172.4	179.5	0	110.6	L512	L512-K514 PolarHBondContact O-N 3.49Å
515	S	36.7	Very low	35.3	Very low	115 Å²	115	143.2 Å²	143.2	80%	0.804	80%	0.797	S	S	*	*			trans	-123.4	150	157.4	62.1	0	0	0	0	110
516	P	36	Very low	35.2	Very low	119 Å²	119	143.9 Å²	143.9	77%	0.773	80%	0.8	S	S	*	*			trans	-97.6	150.3	-153.2	36.3	-31	0	0	0	115.2
517	E	32	Very low	35.4	Very low	175 Å²	175	142.3 Å²	142.3	82%	0.818	80%	0.801	S	S	*	*			trans	20.9	126.8	146.3	-62.6	179.5	166.2	0	0	120.8
518	S	37.2	Very low	35.9	Very low	124 Å²	124	144.2 Å²	144.2	87%	0.867	83%	0.826	S	S	*	*			trans	-129.5	116.9	140.3	66.6	0	0	0	0	109.9
519	I	32.7	Very low	35.8	Very low	134 Å²	134	144.9 Å²	144.9	69%	0.687	83%	0.828	S	S	*	*			trans	-72	134.6	179.2	-66.6	159.9	0	0	0	110.5
520	H	38.5	Very low	35.8	Very low	186 Å²	186	144.6 Å²	144.6	86%	0.861	83%	0.829	S	S	*	*			trans	-154.6	116.5	138.4	-113.3	-68.2	0	0	0	111.1
521	S	33.5	Very low	35.9	Very low	93 Å²	93	147.3 Å²	147.3	65%	0.65	84%	0.838	S	S	*	*			trans	-60.6	148.4	166.2	50.2	0	0	0	0	110.7
522	S	37	Very low	36	Very low	107 Å²	107	146.2 Å²	146.2	75%	0.748	84%	0.835	S	S	*	*				-174.9	118.5	89.5	-54.2	0	0	0	0	106.9
523	A	35.6	Very low	36	Very low	90 Å²	90	144 Å²	144	74%	0.744	83%	0.828	S	S	*	*				83.5	112.9	88.3	0	0	0	0	0	115.1
524	N	35.7	Very low	35.9	Very low	133 Å²	133	140.2 Å²	140.2	71%	0.711	83%	0.825	S	S	*	*			trans	118	108.8	136.2	-80.2	27.4	0	0	0	120.1
525	E	35.7	Very low	36.2	Very low	155 Å²	155	135.4 Å²	135.4	72%	0.724	82%	0.819	S	S	*	*				71.1	103.4	123.3	-70.6	178.4	133	0	0	120.7
526	L	31.3	Very low	36.1	Very low	168 Å²	168	137 Å²	137	88%	0.88	82%	0.82	S	S	*	*				36.4	116.3	112.3	-72.5	161.9	0	0	0	118.2
527	A	41.8	Very low	36.1	Very low	97 Å²	97	138.5 Å²	138.5	80%	0.802	82%	0.824	S	S	*	*				-166.8	123.9	122.7	0	0	0	0	0	111.1
528	S	42.5	Very low	36.5	Very low	200 Å²	200	135.2 Å²	135.2	100%	1.399	83%	0.825	S	S	*	*			trans	60.1	0	161.9	-70.1	0	0	0	0	121

Retrieved 528 of 528 residues in 551.2 ms (Link to these results)

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