A0A087Y7E8_POEFO Loading...

Enoyl CoA hydratase domain containing 2

AlphaFold DB , UniProt , Accession A0A087Y7E8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 332 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	44.7	Very low	34.8	Very low	248 Å²	248	154.9 Å²	154.9	100%	1.222	86%	0.855	S	S	*	*				0	105.4	0	-88.4	-172.3	166.7	0	0	108.7
2	A	34.4	Very low	34.6	Very low	100 Å²	100	162.8 Å²	162.8	83%	0.826	86%	0.862	S	S	*	*			trans	-178.4	97.3	155.1	0	0	0	0	0	107.7
3	S	32.7	Very low	34.1	Very low	120 Å²	120	159.9 Å²	159.9	84%	0.839	86%	0.861	S	S	*	*			trans	-75.9	129.5	167.5	-73.4	0	0	0	0	109.3
4	V	35.1	Very low	33.9	Very low	119 Å²	119	155.8 Å²	155.8	72%	0.721	85%	0.851	S	S	*	*			trans	-130.5	104.4	161.8	-179.6	0	0	0	0	107.4	Y6	V4-Y6 HydrophobicContact CG1-CD2 4.05Å; V4-Y6 HydrophobicContact CG1-CE2 4.4Å
5	L	34.9	Very low	33.9	Very low	168 Å²	168	156.1 Å²	156.1	88%	0.88	85%	0.85	S	S	*	*			trans	-80.2	111.1	172.2	-83.9	153.8	0	0	0	108.5
6	Y	33	Very low	33.7	Very low	198 Å²	198	157.5 Å²	157.5	78%	0.776	86%	0.855	S	S	*	*			trans	-98	111.6	164	-110.6	-93.2	0	0	0	109.5	V4	V4-Y6 HydrophobicContact CG1-CD2 4.05Å; V4-Y6 HydrophobicContact CG1-CE2 4.4Å
7	R	33.8	Very low	33.7	Very low	241 Å²	241	161.8 Å²	161.8	91%	0.909	86%	0.856	S	S	*	*			trans	-76.3	122.9	163.1	-75.1	-179.3	176.5	-154.9	-0.7	107.9
8	L	33.5	Very low	33.6	Very low	158 Å²	158	159 Å²	159	83%	0.827	85%	0.852	S	S	*	*			trans	-116.7	125.8	163.3	-81.1	166.9	0	0	0	109.3
9	A	32.2	Very low	33.4	Very low	100 Å²	100	159.5 Å²	159.5	83%	0.826	85%	0.854	S	S	*	*	P	Polyproline II helix	trans	-73.5	138.4	-176.5	0	0	0	0	0	111.3
10	V	32	Very low	33.3	Very low	133 Å²	133	158.2 Å²	158.2	81%	0.806	85%	0.852	S	S	*	*	P	Polyproline II helix	trans	-96.5	126	171.1	-179.2	0	0	0	0	108.1
11	P	36.4	Very low	33.2	Very low	119 Å²	119	157 Å²	157	77%	0.773	85%	0.849	S	S	*	*	P	Polyproline II helix	trans	-80	122.3	168.3	17.6	-8.2	0	0	0	110.6
12	R	32.4	Very low	32.6	Very low	249 Å²	249	150.7 Å²	150.7	94%	0.94	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-65.3	125.5	163.3	-78.7	175.9	165.6	178.2	-4.6	108.9
13	C	28.6	Very low	32.3	Very low	126 Å²	126	157.7 Å²	157.7	85%	0.851	83%	0.832	S	S	*	*			trans	-118.4	112.7	163.8	-149.3	0	0	0	0	108.8
14	S	31.3	Very low	32.2	Very low	102 Å²	102	162.3 Å²	162.3	71%	0.713	83%	0.831	S	S	*	*			trans	-96.5	116.2	-178.3	47.6	0	0	0	0	110.1
15	L	33	Very low	31.9	Very low	161 Å²	161	165.2 Å²	165.2	84%	0.843	84%	0.837	S	S	*	*			trans	-139.9	87	161.8	-83	169.5	0	0	0	109.2
16	L	31.6	Very low	31.8	Very low	178 Å²	178	162.5 Å²	162.5	93%	0.932	83%	0.828	S	S	*	*			trans	-74.4	116.3	160.5	-88.2	138.8	0	0	0	107.8
17	R	33.4	Very low	31.7	Very low	230 Å²	230	161.9 Å²	161.9	87%	0.868	83%	0.832	S	S	*	*			trans	-110.6	128.7	160.2	-89.3	-173.7	175.5	-143.7	0.4	109.3
18	S	31.4	Very low	31.4	Very low	112 Å²	112	161.9 Å²	161.9	78%	0.783	83%	0.832	S	S	*	*			trans	-58.4	125.3	-177.5	52.5	0	0	0	0	112.8
19	L	30.1	Very low	31.3	Very low	169 Å²	169	161.4 Å²	161.4	89%	0.885	83%	0.829	S	S	*	*			trans	-87.8	111.7	165.1	-74.1	162.9	0	0	0	108.9
20	T	31.3	Very low	31.2	Very low	133 Å²	133	166.6 Å²	166.6	82%	0.816	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-86.5	118.1	164.2	42.4	0	0	0	0	109.1
21	V	31.3	Very low	31.3	Very low	132 Å²	132	168.3 Å²	168.3	80%	0.8	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-87.7	126.2	177.9	-178.6	0	0	0	0	109.5
22	P	32.8	Very low	31.2	Very low	116 Å²	116	168.6 Å²	168.6	75%	0.753	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-78.7	130.7	168.8	-10.8	27.3	0	0	0	111.3
23	R	27.8	Very low	31	Very low	247 Å²	247	160 Å²	160	93%	0.932	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-62.9	132.2	168	-90.3	176.8	171.7	-171.7	-2.3	110.2
24	W	29.3	Very low	31.1	Very low	217 Å²	217	161.2 Å²	161.2	82%	0.822	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-89	119.4	168.1	53.1	-84.1	0	0	0	109	T26	W24-T26 HydrophobicContact CE3-CG2 3.95Å; W24-T26 HydrophobicContact CH2-CG2 4.38Å; W24-T26 HydrophobicContact CZ3-CG2 3.39Å
25	E	29.1	Very low	31	Very low	181 Å²	181	165.6 Å²	165.6	85%	0.846	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-85.5	128.1	171.1	-87.3	179.9	164.4	0	0	110.4
26	T	32.6	Very low	31	Very low	111 Å²	111	167.7 Å²	167.7	68%	0.681	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-74.7	120.4	170	42.8	0	0	0	0	111.1	W24	W24-T26 HydrophobicContact CE3-CG2 3.95Å; W24-T26 HydrophobicContact CH2-CG2 4.38Å; W24-T26 HydrophobicContact CZ3-CG2 3.39Å
27	Q	31.6	Very low	30.8	Very low	184 Å²	184	166.9 Å²	166.9	86%	0.86	82%	0.822	S	S	*	*			trans	-115.2	129.9	161.4	-81.2	-175.3	-7.9	0	0	111.7
28	R	28.4	Very low	30.6	Very low	241 Å²	241	159.9 Å²	159.9	91%	0.909	81%	0.813	S	S	*	*			trans	-83.3	142.8	-178.9	-69.5	177	-157.6	-144.6	1.6	111.7
29	L	31.2	Very low	30.6	Very low	148 Å²	148	160 Å²	160	78%	0.775	81%	0.81	S	S	*	*			trans	-12.9	140.9	154.8	-69.2	152.8	0	0	0	118.9
30	K	29.5	Very low	30.6	Very low	209 Å²	209	160.2 Å²	160.2	91%	0.909	80%	0.803	S	S	*	*			trans	-139.7	123.4	141	-76.6	-171.1	178.1	178.6	0	110.8
31	H	34.2	Very low	30.4	Very low	169 Å²	169	160.6 Å²	160.6	78%	0.782	80%	0.8	S	S	*	*			trans	-93.5	156	161.6	-83.3	-73.9	0	0	0	110
32	P	35.1	Very low	30.3	Very low	126 Å²	126	161.5 Å²	161.5	82%	0.818	80%	0.799	S	S	*	*			trans	-124.8	138.6	131	18.6	0.4	0	0	0	109.3
33	G	27.9	Very low	30.1	Very low	67 Å²	67	160.9 Å²	160.9	69%	0.691	80%	0.804	S	S	*	*				101.3	85.6	61.6	0	0	0	0	0	108.8
34	L	29.5	Very low	30.1	Very low	153 Å²	153	152.9 Å²	152.9	80%	0.801	80%	0.798	S	S	*	*				59.3	117.9	113	-99.5	143	0	0	0	116.4
35	H	29.9	Very low	30.1	Very low	194 Å²	194	151.5 Å²	151.5	90%	0.898	80%	0.801	S	S	*	*			trans	-154.1	133.7	132.1	-112.9	-77.5	0	0	0	112.1
36	R	32.8	Very low	30.1	Very low	205 Å²	205	150.9 Å²	150.9	77%	0.774	80%	0.803	S	S	*	*			trans	-76.3	153.3	171.4	-69.9	170.2	156.3	176.7	-7.1	109.9
37	D	28.3	Very low	30	Very low	160 Å²	160	157.2 Å²	157.2	86%	0.856	82%	0.815	S	S	*	*				-175.2	146.8	107.5	-93.5	-21.1	0	0	0	113.7
38	A	28.1	Very low	29.8	Very low	83 Å²	83	154.4 Å²	154.4	69%	0.686	82%	0.815	S	S	*	*			trans	-96.6	163	176.9	0	0	0	0	0	110.7
39	T	31.2	Very low	29.9	Very low	116 Å²	116	150.9 Å²	150.9	71%	0.712	81%	0.814	S	S	*	*				141.2	141.5	109.7	-20.4	0	0	0	0	114.5
40	K	30.8	Very low	29.7	Very low	172 Å²	172	148.6 Å²	148.6	75%	0.748	82%	0.816	S	S	*	*			trans	84.8	116.3	146.6	-83.3	158.6	-178.3	-171.6	0	119.1
41	L	27.5	Very low	29.7	Very low	142 Å²	142	143.4 Å²	143.4	74%	0.743	81%	0.812	S	S	*	*				72.3	131.5	76.1	-83.9	152.5	0	0	0	110.1
42	L	29.4	Very low	29.5	Very low	151 Å²	151	141.9 Å²	141.9	79%	0.791	82%	0.819	S	S	*	*			cis	-171	142.5	32.2	-97.1	154.7	0	0	0	107.1
43	A	28.2	Very low	29.3	Very low	102 Å²	102	141.2 Å²	141.2	84%	0.843	82%	0.817	S	S	*	*				109.3	146	94.5	0	0	0	0	0	112.7
44	G	26.7	Very low	29.3	Very low	79 Å²	79	149.6 Å²	149.6	81%	0.814	83%	0.828	S	S	*	*			trans	162.1	87.6	170.7	0	0	0	0	0	113.2
45	E	30.3	Very low	29.7	Very low	188 Å²	188	147.3 Å²	147.3	88%	0.879	83%	0.831	S	S	*	*			trans	-65.5	150.1	173.9	-64.8	170.1	121.7	0	0	112.9
46	N	29.7	Very low	29.7	Very low	169 Å²	169	145.2 Å²	145.2	90%	0.904	83%	0.826	S	S	*	*			trans	-163	123	130.5	-114.1	-17.4	0	0	0	111.7
47	R	29.2	Very low	29.7	Very low	244 Å²	244	141.1 Å²	141.1	92%	0.921	83%	0.83	S	S	*	*			trans	-99.6	137.1	167.6	-85	-178.9	169.1	-174.5	-2.4	109
48	S	28.7	Very low	30	Very low	124 Å²	124	144 Å²	144	87%	0.867	83%	0.828	S	S	*	*			trans	-136.2	141.9	156.2	135.2	0	0	0	0	108.2
49	L	29.4	Very low	30.4	Very low	168 Å²	168	144.6 Å²	144.6	88%	0.88	83%	0.828	S	S	*	*			trans	-101.7	151.6	-168.3	-90.8	156.8	0	0	0	111.8
50	A	28.5	Very low	30.6	Very low	99 Å²	99	147.3 Å²	147.3	82%	0.818	83%	0.832	S	S	*	*			trans	82.6	109	150.9	0	0	0	0	0	119.5
51	A	28	Very low	30.9	Very low	100 Å²	100	147.1 Å²	147.1	83%	0.826	83%	0.834	S	S	*	*				-155.5	125.8	120	0	0	0	0	0	110.2
52	C	29.5	Very low	31.4	Very low	138 Å²	138	146.1 Å²	146.1	93%	0.932	83%	0.834	S	S	*	*			trans	-75	124.9	177.6	-160.1	0	0	0	0	109.3
53	S	30.9	Very low	32	Very low	111 Å²	111	143.2 Å²	143.2	78%	0.776	83%	0.831	S	S	*	*			trans	-148.7	114.1	158.4	63.4	0	0	0	0	111.5
54	R	29.8	Very low	33	Very low	243 Å²	243	144.3 Å²	144.3	92%	0.917	83%	0.827	S	S	*	*			trans	32.7	112.9	150.8	-67.2	178.5	178.2	174.6	-0.9	118.1	D56	R54-D56 PolarHBondContact O-N 3.49Å
55	A	36	Very low	34.4	Very low	105 Å²	105	149.7 Å²	149.7	87%	0.868	83%	0.831	S	S	*	*			trans	-51.1	119.3	159.5	0	0	0	0	0	111.1
56	D	30.3	Very low	36.4	Very low	150 Å²	150	145.5 Å²	145.5	80%	0.802	82%	0.818	S	S	*	*			trans	-121	103.8	155.1	-123.9	-12.6	0	0	0	105.7	R54 R58	R54-D56 PolarHBondContact O-N 3.49Å; D56-R58 PolarHBondContact O-N 2.88Å
57	S	34	Very low	39.2	Very low	120 Å²	120	140.7 Å²	140.7	84%	0.839	80%	0.798	S	S	*	*			trans	-74.1	73.7	177.6	46.5	0	0	0	0	109.2	S59	S57-S59 PolarHBondContact O-N 3.45Å
58	R	34.2	Very low	42.3	Very low	220 Å²	220	133.5 Å²	133.5	83%	0.83	78%	0.781	S	S	*	*			trans	-71.5	104.7	160.9	-91	178.9	172.3	-178.2	-2.1	107.5	D56 Q60	D56-R58 PolarHBondContact O-N 2.88Å; R58-Q60 VanDerWaalsContact C-N 3.27Å; R58-Q60 PolarHBondContact O-N 3.17Å
59	S	36.4	Very low	45.6	Very low	96 Å²	96	128.5 Å²	128.5	67%	0.671	74%	0.744	S	S	*	*			trans	-56.8	97.6	160.5	53	0	0	0	0	107.7	S57 H61	S57-S59 PolarHBondContact O-N 3.45Å; S59-H61 PolarHBondContact O-N 3.32Å
60	Q	35.4	Very low	48.9	Very low	172 Å²	172	120.9 Å²	120.9	80%	0.804	70%	0.704	S	S	*	*			trans	-67.2	88.4	161.5	-74.5	179.6	-7.2	0	0	105.9	R58 T62	R58-Q60 VanDerWaalsContact C-N 3.27Å; R58-Q60 PolarHBondContact O-N 3.17Å; Q60-T62 PolarHBondContact O-N 3.37Å
61	H	35.8	Very low	52.2	Low	169 Å²	169	120.1 Å²	120.1	78%	0.782	69%	0.686	S	S	*	*			trans	-62.5	89.2	150.6	-79.5	-75.5	0	0	0	105.7	S59 A63	S59-H61 PolarHBondContact O-N 3.32Å; H61-A63 PolarHBondContact O-N 3.41Å
62	T	38.7	Very low	55.5	Low	121 Å²	121	117.1 Å²	117.1	74%	0.742	66%	0.656	S	S	*	*			trans	-58.5	96.5	158.9	-0.3	0	0	0	0	105	Q60 V64	Q60-T62 PolarHBondContact O-N 3.37Å; T62-V64 PolarHBondContact O-N 3.11Å
63	A	42.7	Very low	58.8	Low	90 Å²	90	115.5 Å²	115.5	74%	0.744	63%	0.633	S	S	*	*			trans	-55	109.9	163.1	0	0	0	0	0	105	H61 E65	H61-A63 PolarHBondContact O-N 3.41Å; A63-E65 PolarHBondContact O-N 3.22Å
64	V	48.8	Very low	62	Low	125 Å²	125	115.8 Å²	115.8	76%	0.758	62%	0.617	S	S	*	*			trans	-58.7	109.7	170.9	176.6	0	0	0	0	104.6	T62 V66	T62-V64 PolarHBondContact O-N 3.11Å; V64-V66 VanDerWaalsContact C-N 3.33Å; V64-V66 PolarHBondContact O-N 3.13Å
65	E	56.1	Low	65.3	Low	192 Å²	192	105.1 Å²	105.1	90%	0.897	58%	0.578	S	S	*	*			trans	-62.8	100.2	177.5	-148	176.2	-163.6	0	0	106.3	A63 S67	A63-E65 PolarHBondContact O-N 3.22Å; E65-S67 PolarHBondContact O-N 3.42Å
66	V	71.5	Confident	68.3	Low	99 Å²	99	108.1 Å²	108.1	60%	0.6	58%	0.575	S	S	*	*			trans	-67.1	109.6	-177.3	-179	0	0	0	0	106.5	V64 V68 T99	V64-V66 VanDerWaalsContact C-N 3.33Å; V64-V66 PolarHBondContact O-N 3.13Å; V66-V68 PolarHBondContact O-N 3.32Å; V66-T99 HydrophobicContact CG1-CG2 4.07Å
67	S	88.4	Confident	71.4	Confident	69 Å²	69	104.3 Å²	104.3	48%	0.483	57%	0.57	S	S	.	*			trans	-58.9	127.1	178.9	57.3	0	0	0	0	110	E65 E69 Q103	E65-S67 PolarHBondContact O-N 3.42Å; S67-E69 PolarHBondContact O-N 3.15Å; S67-Q103 PolarHBondContact O-NE2 3.03Å
68	V	95.9	Very high	74.4	Confident	92 Å²	92	105.9 Å²	105.9	56%	0.558	57%	0.565	S	S	*	*			trans	-69.9	114.5	172.8	-177.9	0	0	0	0	108.3	V66 D71	V66-V68 PolarHBondContact O-N 3.32Å; V68-D71 HydrophobicContact CG1-CB 4.04Å
69	E	97.9	Very high	77.4	Confident	20 Å²	20	96.3 Å²	96.3	9%	0.093	53%	0.53	C	S	.	.			trans	-110.9	-21.6	178.8	-65.7	-168	154.2	0	0	112	S67 C88 R89 T99 F100	S67-E69 PolarHBondContact O-N 3.15Å; E69-C88 PolarHBondContact O-N 3.01Å; E69-C88 PolarHBondContact O-SG 2.91Å; E69-C88 VanDerWaalsContact O-SG 3.36Å; E69-R89 HydrophobicContact CB-CB 4.08Å; E69-R89 HydrophobicContact CB-CG 4.35Å; E69-R89 HydrophobicContact CG-CB 4.21Å; E69-R89 HydrophobicContact CG-CG 3.97Å; E69-R89 VanDerWaalsContact OE1-CD 3.32Å; E69-R89 WeakPolarHBondContact OE1-CD 3.36Å; E69-R89 WeakPolarHBondContact OE1-CG 3.34Å; E69-R89 IonicContact OE1-CZ 3.65Å; E69-R89 IonicContact OE1-NE 3.39Å; E69-R89 PolarHBondContact OE1-NE 2.82Å; E69-R89 IonicContact OE1-NH2 2.73Å; E69-R89 VanDerWaalsContact OE2-CD 3.32Å; E69-R89 WeakPolarHBondContact OE2-CD 3.49Å; E69-R89 IonicContact OE2-CZ 3.71Å; E69-R89 IonicContact OE2-NE 3.95Å; E69-R89 PolarHBondContact OE2-NE 3.46Å; E69-T99 HydrophobicContact CG-CG2 4.16Å; E69-T99 WeakPolarHBondContact OE2-CB 3.44Å; E69-F100 HydrophobicContact CB-CB 4.42Å; E69-F100 HydrophobicContact CB-CD2 4.05Å; E69-F100 WeakPolarHBondContact OE2-CA 3.37Å; E69-F100 WeakPolarHBondContact OE2-CB 3.35Å; E69-F100 PolarHBondContact OE2-N 2.96Å
70	V	98.1	Very high	80.4	Confident	7 Å²	7	99.5 Å²	99.5	4%	0.042	53%	0.532	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	131.3	171.7	-165.5	0	0	0	0	108.9	V85 L86 F100 Q103 M104 L107	V70-V85 HydrophobicContact CG1-CG1 3.75Å; V70-L86 CarbonylContact C-O 3.57Å; V70-L86 WeakPolarHBondContact CA-O 3.34Å; V70-F100 HydrophobicContact CG2-CD1 3.93Å; V70-F100 HydrophobicContact CG2-CD2 3.63Å; V70-F100 HydrophobicContact CG2-CE1 3.88Å; V70-F100 HydrophobicContact CG2-CE2 3.6Å; V70-F100 HydrophobicContact CG2-CG 3.8Å; V70-F100 HydrophobicContact CG2-CZ 3.73Å; V70-Q103 HydrophobicContact CB-CB 4.13Å; V70-Q103 HydrophobicContact CG2-CB 4.34Å; V70-M104 HydrophobicContact CB-CE 4.48Å; V70-M104 HydrophobicContact CG1-CE 3.62Å; V70-M104 HydrophobicContact CG1-SD 3.89Å; V70-M104 HydrophobicContact CG2-CB 4.27Å; V70-M104 HydrophobicContact CG2-CE 3.96Å; V70-L107 HydrophobicContact CB-CD1 4.17Å; V70-L107 HydrophobicContact CG1-CD1 3.6Å
71	D	97.8	Very high	83.4	Confident	83 Å²	83	91.9 Å²	91.9	44%	0.444	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	170.7	-179.8	-166.3	14.8	0	0	0	110.9	V68 L86	V68-D71 HydrophobicContact CG1-CB 4.04Å; D71-L86 HydrophobicContact CB-CB 4.28Å; D71-L86 PolarHBondContact N-O 3.32Å; D71-L86 PolarHBondContact O-N 3.49Å
72	L	97.8	Very high	86.4	Confident	37 Å²	37	83.9 Å²	83.9	19%	0.194	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	131.6	-178.9	-177.3	149.7	0	0	0	111	R74 V83 E84 L107 L111	L72-R74 HydrophobicContact CD2-CG 3.95Å; L72-V83 HydrophobicContact CD1-CG1 3.76Å; L72-V83 HydrophobicContact CD2-CG1 3.71Å; L72-V83 HydrophobicContact CG-CG1 3.52Å; L72-E84 WeakPolarHBondContact CA-O 3.22Å; L72-L107 HydrophobicContact CB-CD1 4.3Å; L72-L107 HydrophobicContact CB-CD2 3.78Å; L72-L107 HydrophobicContact CD1-CD2 3.96Å; L72-L111 HydrophobicContact CD1-CD1 4.3Å; L72-L111 HydrophobicContact CD1-CD2 3.91Å; L72-L111 HydrophobicContact CD1-CG 4.09Å
73	K	98.5	Very high	89.2	Confident	105 Å²	105	78.2 Å²	78.2	46%	0.457	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	126.2	174.9	-179.9	-177.3	174.2	-165.4	0	111	L75 V83 E84 L86	K73-L75 HydrophobicContact CD-CD2 4.19Å; K73-L75 HydrophobicContact CG-CD2 4.28Å; K73-V83 WeakPolarHBondContact O-CA 3.45Å; K73-E84 HydrophobicContact CB-CB 4.33Å; K73-E84 PolarHBondContact N-O 3.03Å; K73-E84 PolarHBondContact O-N 2.91Å; K73-L86 HydrophobicContact CB-CD1 3.82Å; K73-L86 HydrophobicContact CB-CG 4.43Å
74	R	98.6	Very high	91.9	Very high	117 Å²	117	74.1 Å²	74.1	44%	0.442	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	131.5	170.8	-61.1	-177.7	179.4	-88.1	-3.5	109.1	L72 V83 D114	L72-R74 HydrophobicContact CD2-CG 3.95Å; R74-V83 HydrophobicContact CG-CG2 4.08Å; R74-D114 IonicContact CZ-OD2 3.76Å; R74-D114 IonicContact NH1-OD2 3.79Å; R74-D114 PolarHBondContact NH1-OD2 2.99Å; R74-D114 IonicContact NH2-OD2 2.89Å; R74-D114 PolarHBondContact NH2-OD2 3.22Å
75	L	98.6	Very high	94.3	Very high	18 Å²	18	68.1 Å²	68.1	9%	0.094	36%	0.357	C	S	.	.			trans	-85.7	152.8	175.3	-57.9	-170	0	0	0	111.1	K73 D79 I82 E84 L265	K73-L75 HydrophobicContact CD-CD2 4.19Å; K73-L75 HydrophobicContact CG-CD2 4.28Å; L75-D79 HydrophobicContact CB-CB 3.6Å; L75-D79 HydrophobicContact CD1-CB 3.86Å; L75-D79 HydrophobicContact CG-CB 4.4Å; L75-I82 HydrophobicContact CB-CB 4.4Å; L75-I82 HydrophobicContact CD1-CB 4.06Å; L75-I82 HydrophobicContact CD1-CG2 3.88Å; L75-I82 HydrophobicContact CG-CB 4.4Å; L75-I82 HydrophobicContact CG-CG2 4.41Å; L75-I82 PolarHBondContact N-O 3.46Å; L75-E84 HydrophobicContact CD1-CG 4.43Å; L75-E84 HydrophobicContact CD2-CG 4.34Å; L75-E84 HydrophobicContact CG-CG 4.35Å; L75-L265 HydrophobicContact CD1-CD1 3.57Å
76	E	97.7	Very high	96.3	Very high	169 Å²	169	59.6 Å²	59.6	79%	0.79	32%	0.317	S	S	*	.			trans	-120.8	178.7	-174.8	-61.8	-173.9	170.3	0	0	111.2	Q78 D79	E76-Q78 PolarHBondContact O-N 2.81Å; E76-D79 PolarHBondContact O-N 3.29Å; E76-D79 VanDerWaalsContact O-N 3.14Å
77	G	97	Very high	97.6	Very high	69 Å²	69	54.9 Å²	54.9	71%	0.711	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	61.4	-129	179	0	0	0	0	0	112.2	D79 K80	G77-D79 PolarHBondContact O-N 2.68Å; G77-K80 WeakPolarHBondContact O-CB 3.38Å; G77-K80 PolarHBondContact O-N 3.46Å
78	Q	95.9	Very high	98.1	Very high	154 Å²	154	52.7 Å²	52.7	72%	0.72	27%	0.273	S	S	*	.	G	3₁₀ helix	trans	-65.4	-18	179.4	69.6	-175.9	0.7	0	0	113.8	E76	E76-Q78 PolarHBondContact O-N 2.81Å
79	D	98.3	Very high	98.1	Very high	19 Å²	19	49.9 Å²	49.9	10%	0.102	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-99.4	9.4	-178.3	-64.3	-36.6	0	0	0	112.5	L75 E76 G77 G81 I82 R269	L75-D79 HydrophobicContact CB-CB 3.6Å; L75-D79 HydrophobicContact CD1-CB 3.86Å; L75-D79 HydrophobicContact CG-CB 4.4Å; E76-D79 PolarHBondContact O-N 3.29Å; E76-D79 VanDerWaalsContact O-N 3.14Å; G77-D79 PolarHBondContact O-N 2.68Å; D79-G81 PolarHBondContact O-N 2.73Å; D79-I82 HydrophobicContact CB-CD1 4.2Å; D79-I82 WeakPolarHBondContact O-CB 3.43Å; D79-I82 PolarHBondContact O-N 3.5Å; D79-R269 WeakPolarHBondContact OD1-CG 3.2Å; D79-R269 IonicContact OD1-CZ 3.32Å; D79-R269 IonicContact OD1-NE 2.77Å; D79-R269 PolarHBondContact OD1-NE 2.99Å; D79-R269 IonicContact OD1-NH2 2.65Å; D79-R269 PolarHBondContact OD1-NH2 2.87Å; D79-R269 IonicContact OD2-CZ 2.81Å; D79-R269 IonicContact OD2-NE 3.58Å; D79-R269 IonicContact OD2-NH2 2.87Å; D79-R269 PolarHBondContact OD2-NH2 2.94Å
80	K	98.2	Very high	98.1	Very high	163 Å²	163	54.1 Å²	54.1	71%	0.709	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	124	178.3	-176.6	180	179.6	179.4	0	110.7	G77	G77-K80 WeakPolarHBondContact O-CB 3.38Å; G77-K80 PolarHBondContact O-N 3.46Å
81	G	98.2	Very high	98	Very high	12 Å²	12	66.1 Å²	66.1	12%	0.124	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	105.1	-10	-175.9	0	0	0	0	0	113.5	D79 R118 V119	D79-G81 PolarHBondContact O-N 2.73Å; G81-R118 WeakPolarHBondContact O-CA 3.47Å; G81-R118 PolarHBondContact O-N 2.97Å; G81-V119 PolarHBondContact O-N 3.47Å
82	I	98.8	Very high	97.9	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	133.9	168.7	-57.1	173.2	0	0	0	109	L75 D79 V119 I121 L265 A268 R269 L272	L75-I82 HydrophobicContact CB-CB 4.4Å; L75-I82 HydrophobicContact CD1-CB 4.06Å; L75-I82 HydrophobicContact CD1-CG2 3.88Å; L75-I82 HydrophobicContact CG-CB 4.4Å; L75-I82 HydrophobicContact CG-CG2 4.41Å; L75-I82 PolarHBondContact N-O 3.46Å; D79-I82 HydrophobicContact CB-CD1 4.2Å; D79-I82 WeakPolarHBondContact O-CB 3.43Å; D79-I82 PolarHBondContact O-N 3.5Å; I82-V119 WeakPolarHBondContact CA-O 3.35Å; I82-V119 HydrophobicContact CG1-CB 4.44Å; I82-I121 HydrophobicContact CG2-CD1 3.74Å; I82-I121 HydrophobicContact CG2-CG1 4.1Å; I82-L265 HydrophobicContact CD1-CD1 3.79Å; I82-L265 HydrophobicContact CG2-CD1 4.43Å; I82-A268 HydrophobicContact CD1-CB 3.57Å; I82-A268 HydrophobicContact CG1-CB 4.07Å; I82-A268 HydrophobicContact CG2-CB 4.5Å; I82-R269 HydrophobicContact CD1-CG 4.42Å; I82-L272 HydrophobicContact CD1-CD1 3.55Å; I82-L272 HydrophobicContact CD1-CG 4.01Å; I82-L272 HydrophobicContact CG1-CD1 3.78Å; I82-L272 HydrophobicContact CG1-CD2 3.91Å; I82-L272 HydrophobicContact CG1-CG 3.89Å
83	V	98.8	Very high	97.9	Very high	2 Å²	2	69.5 Å²	69.5	1%	0.012	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	135.6	172.8	179.7	0	0	0	0	110.1	L72 K73 R74 L111 V117 V119 V120 I121	L72-V83 HydrophobicContact CD1-CG1 3.76Å; L72-V83 HydrophobicContact CD2-CG1 3.71Å; L72-V83 HydrophobicContact CG-CG1 3.52Å; K73-V83 WeakPolarHBondContact O-CA 3.45Å; R74-V83 HydrophobicContact CG-CG2 4.08Å; V83-L111 HydrophobicContact CB-CD2 4.29Å; V83-L111 HydrophobicContact CG1-CD2 3.93Å; V83-V117 HydrophobicContact CB-CG1 4.34Å; V83-V117 HydrophobicContact CG2-CB 4.42Å; V83-V117 HydrophobicContact CG2-CG1 4.07Å; V83-V117 HydrophobicContact CG2-CG2 3.64Å; V83-V119 PolarHBondContact N-O 2.95Å; V83-V120 CarbonylContact O-C 3.45Å; V83-V120 VanDerWaalsContact O-CA 3.31Å; V83-V120 WeakPolarHBondContact O-CA 3.3Å; V83-I121 PolarHBondContact O-N 3.32Å
84	E	98.8	Very high	97.9	Very high	4 Å²	4	64.5 Å²	64.5	2%	0.019	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	127.8	176	-58.8	175.5	171.9	0	0	109.9	L72 K73 L75 L86 I121 Y261	L72-E84 WeakPolarHBondContact CA-O 3.22Å; K73-E84 HydrophobicContact CB-CB 4.33Å; K73-E84 PolarHBondContact N-O 3.03Å; K73-E84 PolarHBondContact O-N 2.91Å; L75-E84 HydrophobicContact CD1-CG 4.43Å; L75-E84 HydrophobicContact CD2-CG 4.34Å; L75-E84 HydrophobicContact CG-CG 4.35Å; E84-L86 HydrophobicContact CB-CD2 3.68Å; E84-L86 HydrophobicContact CB-CG 4.29Å; E84-I121 CarbonylContact C-O 3.41Å; E84-I121 WeakPolarHBondContact CA-O 3.36Å; E84-Y261 HydrophobicContact CG-CE2 4.45Å; E84-Y261 WeakPolarHBondContact OE1-CE2 3.49Å; E84-Y261 PolarHBondContact OE1-OH 3.42Å
85	V	98.8	Very high	97.9	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	115	164	179	0	0	0	0	107.3	V70 M104 L111 V120 I121 F122 R123	V70-V85 HydrophobicContact CG1-CG1 3.75Å; V85-M104 HydrophobicContact CG1-CE 4.02Å; V85-M104 HydrophobicContact CG1-SD 3.53Å; V85-M104 VanDerWaalsContact CG1-SD 3.53Å; V85-L111 HydrophobicContact CG2-CD1 3.74Å; V85-V120 HydrophobicContact CG2-CG1 3.81Å; V85-I121 PolarHBondContact N-O 3.36Å; V85-F122 HydrophobicContact CB-CD1 3.69Å; V85-F122 HydrophobicContact CB-CE1 3.95Å; V85-F122 HydrophobicContact CB-CG 4.29Å; V85-F122 HydrophobicContact CG1-CD1 3.73Å; V85-F122 HydrophobicContact CG1-CE1 3.89Å; V85-F122 HydrophobicContact CG2-CD1 4.14Å; V85-F122 HydrophobicContact CG2-CE1 3.91Å; V85-F122 HydrophobicContact CG2-CZ 4.3Å; V85-R123 PolarHBondContact O-N 2.97Å
86	L	98.8	Very high	97.9	Very high	13 Å²	13	58.5 Å²	58.5	7%	0.068	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	111.3	-169.3	-57.1	-178.3	0	0	0	110.4	V70 D71 K73 E84 R123 L125	V70-L86 CarbonylContact C-O 3.57Å; V70-L86 WeakPolarHBondContact CA-O 3.34Å; D71-L86 HydrophobicContact CB-CB 4.28Å; D71-L86 PolarHBondContact N-O 3.32Å; D71-L86 PolarHBondContact O-N 3.49Å; K73-L86 HydrophobicContact CB-CD1 3.82Å; K73-L86 HydrophobicContact CB-CG 4.43Å; E84-L86 HydrophobicContact CB-CD2 3.68Å; E84-L86 HydrophobicContact CB-CG 4.29Å; L86-R123 HydrophobicContact CD2-CG 3.66Å; L86-L125 HydrophobicContact CB-CD1 4.25Å; L86-L125 HydrophobicContact CB-CG 4.21Å; L86-L125 HydrophobicContact CD1-CD1 4.33Å; L86-L125 HydrophobicContact CD2-CD2 4.02Å
87	M	98.8	Very high	97.9	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	115.8	175.3	-56.1	179.5	-76.1	0	0	110.1	N94 F100 M104 R123 S124 L125 F130 L183	M87-N94 HydrophobicContact CB-CB 4.36Å; M87-F100 HydrophobicContact CB-CE2 4Å; M87-F100 HydrophobicContact CB-CZ 3.93Å; M87-F100 HydrophobicContact CG-CE2 4.19Å; M87-F100 HydrophobicContact CG-CZ 3.63Å; M87-F100 HydrophobicContact SD-CZ 3.77Å; M87-M104 HydrophobicContact CG-CE 3.83Å; M87-M104 HydrophobicContact SD-CE 4.11Å; M87-R123 WeakPolarHBondContact CE-O 3.18Å; M87-R123 PolarHBondContact N-O 3.43Å; M87-S124 PolarHBondContact O-OG 3.12Å; M87-L125 PolarHBondContact O-N 2.95Å; M87-F130 HydrophobicContact CE-CD1 4.31Å; M87-F130 HydrophobicContact CE-CD2 3.56Å; M87-F130 HydrophobicContact CE-CE1 4.08Å; M87-F130 HydrophobicContact CE-CE2 3.3Å; M87-F130 HydrophobicContact CE-CG 4.08Å; M87-F130 HydrophobicContact CE-CZ 3.58Å; M87-L183 HydrophobicContact SD-CD2 3.97Å
88	C	97.8	Very high	97.8	Very high	23 Å²	23	52.3 Å²	52.3	16%	0.155	23%	0.234	C	C	.	.			trans	-131.2	23.5	-167.5	62.7	0	0	0	0	114.7	E69 H90 L125	E69-C88 PolarHBondContact O-N 3.01Å; E69-C88 PolarHBondContact O-SG 2.91Å; E69-C88 VanDerWaalsContact O-SG 3.36Å; C88-H90 VanDerWaalsContact C-N 3.29Å; C88-H90 PolarHBondContact O-CE1 2.87Å; C88-H90 PolarHBondContact O-N 2.87Å; C88-H90 PolarHBondContact O-ND1 3.5Å; C88-L125 HydrophobicContact CB-CB 4.25Å; C88-L125 HydrophobicContact CB-CD1 4.05Å; C88-L125 HydrophobicContact CB-CG 4.37Å
89	R	97.6	Very high	97.9	Very high	33 Å²	33	47.3 Å²	47.3	13%	0.125	22%	0.215	C	C	.	.			trans	-80.8	70.1	175.4	-165.4	-173.7	-167.7	-149.5	2.1	112	E69 R91 A92 R93 N94 A95 F100 D135 E138	E69-R89 HydrophobicContact CB-CB 4.08Å; E69-R89 HydrophobicContact CB-CG 4.35Å; E69-R89 HydrophobicContact CG-CB 4.21Å; E69-R89 HydrophobicContact CG-CG 3.97Å; E69-R89 VanDerWaalsContact OE1-CD 3.32Å; E69-R89 WeakPolarHBondContact OE1-CD 3.36Å; E69-R89 WeakPolarHBondContact OE1-CG 3.34Å; E69-R89 IonicContact OE1-CZ 3.65Å; E69-R89 IonicContact OE1-NE 3.39Å; E69-R89 PolarHBondContact OE1-NE 2.82Å; E69-R89 IonicContact OE1-NH2 2.73Å; E69-R89 VanDerWaalsContact OE2-CD 3.32Å; E69-R89 WeakPolarHBondContact OE2-CD 3.49Å; E69-R89 IonicContact OE2-CZ 3.71Å; E69-R89 IonicContact OE2-NE 3.95Å; E69-R89 PolarHBondContact OE2-NE 3.46Å; R89-R91 PolarHBondContact O-N 2.95Å; R89-A92 HydrophobicContact CG-CB 4.02Å; R89-A92 PolarHBondContact O-N 2.81Å; R89-R93 PolarHBondContact O-N 2.65Å; R89-N94 WeakPolarHBondContact CA-OD1 3.5Å; R89-N94 PolarHBondContact N-OD1 3.48Å; R89-N94 PolarHBondContact O-N 3.49Å; R89-A95 WeakPolarHBondContact CD-O 3.36Å; R89-A95 PolarHBondContact NH1-O 2.91Å; R89-F100 HydrophobicContact CB-CD2 4.12Å; R89-F100 HydrophobicContact CB-CE2 4.47Å; R89-D135 IonicContact CZ-OD2 3.86Å; R89-D135 IonicContact NH1-OD2 2.75Å; R89-D135 PolarHBondContact NH1-OD2 3.38Å; R89-D135 IonicContact NH2-OD2 3.22Å; R89-D135 PolarHBondContact NH2-OD2 3.23Å; R89-E138 IonicContact CZ-OE1 2.75Å; R89-E138 IonicContact NH1-OE1 3.66Å; R89-E138 IonicContact NH2-OE1 3.93Å; R89-E138 PolarHBondContact NH2-OE1 3.1Å
90	H	96.4	Very high	97.8	Very high	108 Å²	108	46.4 Å²	46.4	50%	0.5	21%	0.21	S	C	.	.	G	3₁₀ helix	trans	-52.6	-50.3	-174.4	-66.3	78.9	0	0	0	113.8	C88 A92 R93 V126	C88-H90 VanDerWaalsContact C-N 3.29Å; C88-H90 PolarHBondContact O-CE1 2.87Å; C88-H90 PolarHBondContact O-N 2.87Å; C88-H90 PolarHBondContact O-ND1 3.5Å; H90-A92 PolarHBondContact O-N 2.87Å; H90-A92 VanDerWaalsContact O-N 3.15Å; H90-R93 PolarHBondContact O-N 3Å; H90-V126 HydrophobicContact CB-CG2 4.4Å
91	R	96	Very high	97.8	Very high	260 Å²	260	38.9 Å²	38.9	98%	0.981	18%	0.177	S	C	*	.	G	3₁₀ helix	trans	-63.8	-23.4	-173.9	-65.9	-174.9	177.8	-167.3	0.3	113.8	R89	R89-R91 PolarHBondContact O-N 2.95Å
92	A	97.2	Very high	97.8	Very high	26 Å²	26	42 Å²	42	22%	0.215	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-116.5	15.2	-177.5	0	0	0	0	0	112.8	R89 H90 N94 A95	R89-A92 HydrophobicContact CG-CB 4.02Å; R89-A92 PolarHBondContact O-N 2.81Å; H90-A92 PolarHBondContact O-N 2.87Å; H90-A92 VanDerWaalsContact O-N 3.15Å; A92-N94 PolarHBondContact O-N 2.97Å; A92-A95 HydrophobicContact CB-CB 4.22Å; A92-A95 WeakPolarHBondContact O-CB 3.46Å; A92-A95 PolarHBondContact O-N 2.76Å
93	R	98.1	Very high	97.8	Very high	165 Å²	165	43.3 Å²	43.3	62%	0.623	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.5	43	179.5	-59.9	-174.1	-66.6	-173.3	-2.8	112.2	R89 H90 A95 V129 A132	R89-R93 PolarHBondContact O-N 2.65Å; H90-R93 PolarHBondContact O-N 3Å; R93-A95 PolarHBondContact O-N 3.43Å; R93-A95 VanDerWaalsContact O-N 3.15Å; R93-V129 HydrophobicContact CB-CG1 3.92Å; R93-V129 HydrophobicContact CB-CG2 4.13Å; R93-V129 HydrophobicContact CG-CG2 4.2Å; R93-V129 VanDerWaalsContact O-CG1 3.24Å; R93-V129 WeakPolarHBondContact O-CG1 3.19Å; R93-A132 HydrophobicContact CB-CB 3.99Å; R93-A132 WeakPolarHBondContact O-CB 3.4Å; R93-A132 PolarHBondContact O-N 2.62Å; R93-A132 VanDerWaalsContact O-N 3.1Å
94	N	98.6	Very high	97.8	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.2	36.2	-174.1	-57.7	-34.9	0	0	0	113.8	M87 R89 A92 L96 F100 S124 V126 F130 C131	M87-N94 HydrophobicContact CB-CB 4.36Å; R89-N94 WeakPolarHBondContact CA-OD1 3.5Å; R89-N94 PolarHBondContact N-OD1 3.48Å; R89-N94 PolarHBondContact O-N 3.49Å; A92-N94 PolarHBondContact O-N 2.97Å; N94-L96 PolarHBondContact O-N 3.46Å; N94-F100 HydrophobicContact CB-CE2 4.13Å; N94-S124 PolarHBondContact ND2-OG 3.45Å; N94-V126 WeakPolarHBondContact ND2-CG2 3.41Å; N94-V126 WeakPolarHBondContact OD1-CG2 3.43Å; N94-F130 WeakPolarHBondContact CB-O 3.17Å; N94-F130 PolarHBondContact ND2-O 2.9Å; N94-C131 HydrophobicContact CB-CB 4.38Å; N94-C131 PolarHBondContact O-SG 3.17Å
95	A	98.4	Very high	97.7	Very high	9 Å²	9	47.3 Å²	47.3	7%	0.074	22%	0.218	C	C	.	.			trans	-61.3	137.3	169.5	0	0	0	0	0	109.8	R89 A92 R93 G97 G133 D135	R89-A95 WeakPolarHBondContact CD-O 3.36Å; R89-A95 PolarHBondContact NH1-O 2.91Å; A92-A95 HydrophobicContact CB-CB 4.22Å; A92-A95 WeakPolarHBondContact O-CB 3.46Å; A92-A95 PolarHBondContact O-N 2.76Å; R93-A95 PolarHBondContact O-N 3.43Å; R93-A95 VanDerWaalsContact O-N 3.15Å; A95-G97 PolarHBondContact O-N 2.9Å; A95-G133 CarbonylContact C-O 3.51Å; A95-G133 WeakPolarHBondContact CA-O 3.23Å; A95-D135 HydrophobicContact CB-CB 3.96Å
96	L	98.3	Very high	97.6	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	25%	0.248	C	C	.	.	B	Isolated β-bridge	trans	-75.3	89.3	178.8	-50.2	174.6	0	0	0	107.8	N94 F100 V101 G133 D135 F150 L154 M158	N94-L96 PolarHBondContact O-N 3.46Å; L96-F100 HydrophobicContact CD2-CD1 3.53Å; L96-F100 HydrophobicContact CD2-CE1 3.31Å; L96-F100 HydrophobicContact CD2-CZ 4.15Å; L96-V101 HydrophobicContact CB-CG2 4.01Å; L96-G133 PolarHBondContact N-O 3.19Å; L96-D135 PolarHBondContact O-N 3.49Å; L96-F150 WeakPolarHBondContact O-CZ 3.42Å; L96-L154 HydrophobicContact CB-CD2 3.87Å; L96-L154 HydrophobicContact CD1-CD2 3.95Å; L96-M158 HydrophobicContact CD1-CE 3.81Å
97	G	97.3	Very high	97.6	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	25%	0.252	C	S	.	.			trans	-98.4	178.4	169.2	0	0	0	0	0	111.4	A95 T99 F100 V101 E138	A95-G97 PolarHBondContact O-N 2.9Å; G97-T99 PolarHBondContact O-N 3.22Å; G97-F100 PolarHBondContact O-N 3.22Å; G97-V101 WeakPolarHBondContact O-CB 3.4Å; G97-V101 VanDerWaalsContact O-CG2 3.22Å; G97-V101 WeakPolarHBondContact O-CG2 3.45Å; G97-V101 PolarHBondContact O-N 3.42Å; G97-E138 WeakPolarHBondContact CA-OE1 3.19Å; G97-E138 WeakPolarHBondContact CA-OE2 3.47Å
98	H	95.5	Very high	97.6	Very high	107 Å²	107	54.5 Å²	54.5	50%	0.495	25%	0.252	S	S	.	.	H	α-helix	trans	-56.5	-48.7	-176.8	-79	-81.1	0	0	0	113.6	V101 S102 E138 M142 F150	H98-V101 PolarHBondContact O-N 3.29Å; H98-S102 WeakPolarHBondContact O-CB 3.49Å; H98-S102 PolarHBondContact O-N 3.38Å; H98-E138 IonicContact CD2-OE2 3.41Å; H98-E138 PolarHBondContact CD2-OE2 3.03Å; H98-E138 VanDerWaalsContact CD2-OE2 3.31Å; H98-E138 IonicContact CG-OE2 3.27Å; H98-E138 PolarHBondContact N-OE2 3.41Å; H98-M142 WeakPolarHBondContact NE2-CE 3.41Å; H98-F150 AromaticContact CE1-CD2 3.58Å; H98-F150 AromaticContact NE2-CD2 3.82Å
99	T	96.5	Very high	97.6	Very high	50 Å²	50	56.4 Å²	56.4	31%	0.307	27%	0.266	S	S	.	.	H	α-helix	trans	-61	-53.2	180	-58.1	0	0	0	0	111.1	V66 E69 G97 V101 S102 Q103	V66-T99 HydrophobicContact CG1-CG2 4.07Å; E69-T99 HydrophobicContact CG-CG2 4.16Å; E69-T99 WeakPolarHBondContact OE2-CB 3.44Å; G97-T99 PolarHBondContact O-N 3.22Å; T99-V101 VanDerWaalsContact C-N 3.34Å; T99-V101 PolarHBondContact O-N 3.15Å; T99-S102 PolarHBondContact O-N 2.8Å; T99-Q103 WeakPolarHBondContact O-CG 3.32Å; T99-Q103 PolarHBondContact O-N 2.95Å
100	F	98	Very high	97.5	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-51.4	-50.6	175.5	-168.6	-77.9	0	0	0	112.4	E69 V70 M87 R89 N94 L96 G97 S102 Q103 M104	E69-F100 HydrophobicContact CB-CB 4.42Å; E69-F100 HydrophobicContact CB-CD2 4.05Å; E69-F100 WeakPolarHBondContact OE2-CA 3.37Å; E69-F100 WeakPolarHBondContact OE2-CB 3.35Å; E69-F100 PolarHBondContact OE2-N 2.96Å; V70-F100 HydrophobicContact CG2-CD1 3.93Å; V70-F100 HydrophobicContact CG2-CD2 3.63Å; V70-F100 HydrophobicContact CG2-CE1 3.88Å; V70-F100 HydrophobicContact CG2-CE2 3.6Å; V70-F100 HydrophobicContact CG2-CG 3.8Å; V70-F100 HydrophobicContact CG2-CZ 3.73Å; M87-F100 HydrophobicContact CB-CE2 4Å; M87-F100 HydrophobicContact CB-CZ 3.93Å; M87-F100 HydrophobicContact CG-CE2 4.19Å; M87-F100 HydrophobicContact CG-CZ 3.63Å; M87-F100 HydrophobicContact SD-CZ 3.77Å; R89-F100 HydrophobicContact CB-CD2 4.12Å; R89-F100 HydrophobicContact CB-CE2 4.47Å; N94-F100 HydrophobicContact CB-CE2 4.13Å; L96-F100 HydrophobicContact CD2-CD1 3.53Å; L96-F100 HydrophobicContact CD2-CE1 3.31Å; L96-F100 HydrophobicContact CD2-CZ 4.15Å; G97-F100 PolarHBondContact O-N 3.22Å; F100-S102 PolarHBondContact O-N 3.3Å; F100-Q103 PolarHBondContact O-N 3.01Å; F100-M104 HydrophobicContact CE1-CE 3.48Å; F100-M104 VanDerWaalsContact CE1-CE 3.48Å; F100-M104 HydrophobicContact CZ-CE 3.67Å; F100-M104 VanDerWaalsContact O-CB 3.27Å; F100-M104 WeakPolarHBondContact O-CB 3.44Å; F100-M104 PolarHBondContact O-N 3.18Å
101	V	97.9	Very high	97.6	Very high	4 Å²	4	53.2 Å²	53.2	2%	0.024	26%	0.257	C	S	.	.	H	α-helix	trans	-65.1	-41.1	-177.7	171.7	0	0	0	0	110.8	L96 G97 H98 T99 R105 L154 L157	L96-V101 HydrophobicContact CB-CG2 4.01Å; G97-V101 WeakPolarHBondContact O-CB 3.4Å; G97-V101 VanDerWaalsContact O-CG2 3.22Å; G97-V101 WeakPolarHBondContact O-CG2 3.45Å; G97-V101 PolarHBondContact O-N 3.42Å; H98-V101 PolarHBondContact O-N 3.29Å; T99-V101 VanDerWaalsContact C-N 3.34Å; T99-V101 PolarHBondContact O-N 3.15Å; V101-R105 HydrophobicContact CG1-CG 4.48Å; V101-R105 WeakPolarHBondContact O-CB 3.5Å; V101-R105 VanDerWaalsContact O-CG 3.25Å; V101-R105 WeakPolarHBondContact O-CG 3.44Å; V101-R105 PolarHBondContact O-N 2.97Å; V101-L154 HydrophobicContact CG2-CD2 3.46Å; V101-L154 VanDerWaalsContact CG2-CD2 3.46Å; V101-L157 HydrophobicContact CG1-CD2 4.2Å; V101-L157 HydrophobicContact CG2-CD2 4.5Å
102	S	97.5	Very high	97.7	Very high	78 Å²	78	42.8 Å²	42.8	55%	0.545	23%	0.225	S	C	.	.	H	α-helix	trans	-61	-51.5	176.8	-169.3	0	0	0	0	111.7	H98 T99 F100 M104 R105 E106	H98-S102 WeakPolarHBondContact O-CB 3.49Å; H98-S102 PolarHBondContact O-N 3.38Å; T99-S102 PolarHBondContact O-N 2.8Å; F100-S102 PolarHBondContact O-N 3.3Å; S102-M104 PolarHBondContact O-N 3.14Å; S102-R105 PolarHBondContact O-N 3.26Å; S102-E106 PolarHBondContact O-N 3.29Å
103	Q	98.1	Very high	97.6	Very high	27 Å²	27	48.9 Å²	48.9	13%	0.126	25%	0.248	C	C	.	.	H	α-helix	trans	-63.6	-42.3	179.7	-70.6	175.4	-3.7	0	0	112	S67 V70 T99 F100 R105 E106 L107	S67-Q103 PolarHBondContact O-NE2 3.03Å; V70-Q103 HydrophobicContact CB-CB 4.13Å; V70-Q103 HydrophobicContact CG2-CB 4.34Å; T99-Q103 WeakPolarHBondContact O-CG 3.32Å; T99-Q103 PolarHBondContact O-N 2.95Å; F100-Q103 PolarHBondContact O-N 3.01Å; Q103-R105 VanDerWaalsContact C-N 3.34Å; Q103-R105 PolarHBondContact O-N 2.81Å; Q103-E106 PolarHBondContact O-N 3.18Å; Q103-L107 WeakPolarHBondContact O-CG 3.44Å; Q103-L107 PolarHBondContact O-N 3.15Å
104	M	98.5	Very high	97.5	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-60.8	-42.8	176.3	-172.6	69.8	73.4	0	0	111.7	V70 V85 M87 F100 S102 L107 V108 F122 L157 L183	V70-M104 HydrophobicContact CB-CE 4.48Å; V70-M104 HydrophobicContact CG1-CE 3.62Å; V70-M104 HydrophobicContact CG1-SD 3.89Å; V70-M104 HydrophobicContact CG2-CB 4.27Å; V70-M104 HydrophobicContact CG2-CE 3.96Å; V85-M104 HydrophobicContact CG1-CE 4.02Å; V85-M104 HydrophobicContact CG1-SD 3.53Å; V85-M104 VanDerWaalsContact CG1-SD 3.53Å; M87-M104 HydrophobicContact CG-CE 3.83Å; M87-M104 HydrophobicContact SD-CE 4.11Å; F100-M104 HydrophobicContact CE1-CE 3.48Å; F100-M104 VanDerWaalsContact CE1-CE 3.48Å; F100-M104 HydrophobicContact CZ-CE 3.67Å; F100-M104 VanDerWaalsContact O-CB 3.27Å; F100-M104 WeakPolarHBondContact O-CB 3.44Å; F100-M104 PolarHBondContact O-N 3.18Å; S102-M104 PolarHBondContact O-N 3.14Å; M104-L107 PolarHBondContact O-N 3.31Å; M104-V108 HydrophobicContact CG-CG2 4.44Å; M104-V108 WeakPolarHBondContact O-CB 3.49Å; M104-V108 VanDerWaalsContact O-CG2 3.29Å; M104-V108 WeakPolarHBondContact O-CG2 3.38Å; M104-V108 PolarHBondContact O-N 3.25Å; M104-F122 HydrophobicContact SD-CD1 4.2Å; M104-F122 HydrophobicContact SD-CE1 3.88Å; M104-L157 HydrophobicContact CB-CD1 4.13Å; M104-L157 HydrophobicContact CB-CD2 4.08Å; M104-L157 HydrophobicContact CG-CD1 3.53Å; M104-L157 HydrophobicContact CG-CD2 3.87Å; M104-L157 HydrophobicContact CG-CG 4.28Å; M104-L183 HydrophobicContact CE-CD2 4.37Å
105	R	97.8	Very high	97.3	Very high	91 Å²	91	47.1 Å²	47.1	34%	0.343	26%	0.259	S	S	.	.	H	α-helix	trans	-65	-41.1	178.4	-75.6	-180	71.1	-165	-5.4	112	V101 S102 Q103 S109 S153 L157	V101-R105 HydrophobicContact CG1-CG 4.48Å; V101-R105 WeakPolarHBondContact O-CB 3.5Å; V101-R105 VanDerWaalsContact O-CG 3.25Å; V101-R105 WeakPolarHBondContact O-CG 3.44Å; V101-R105 PolarHBondContact O-N 2.97Å; S102-R105 PolarHBondContact O-N 3.26Å; Q103-R105 VanDerWaalsContact C-N 3.34Å; Q103-R105 PolarHBondContact O-N 2.81Å; R105-S109 VanDerWaalsContact O-CB 3.29Å; R105-S109 WeakPolarHBondContact O-CB 3.42Å; R105-S109 PolarHBondContact O-N 2.86Å; R105-S153 PolarHBondContact NH1-OG 2.84Å; R105-L157 HydrophobicContact CG-CB 3.84Å; R105-L157 HydrophobicContact CG-CD1 3.71Å; R105-L157 HydrophobicContact CG-CG 4.2Å
106	E	97.6	Very high	97.2	Very high	132 Å²	132	49.7 Å²	49.7	62%	0.617	28%	0.28	S	S	*	.	H	α-helix	trans	-59.3	-50.7	174.7	-175.2	174.7	-177.3	0	0	110.8	S102 Q103 V108 S109 T110	S102-E106 PolarHBondContact O-N 3.29Å; Q103-E106 PolarHBondContact O-N 3.18Å; E106-V108 PolarHBondContact O-N 2.98Å; E106-S109 WeakPolarHBondContact O-CB 3.36Å; E106-S109 PolarHBondContact O-N 3.4Å; E106-S109 VanDerWaalsContact O-N 3.14Å; E106-T110 PolarHBondContact O-N 3.48Å; E106-T110 PolarHBondContact O-OG1 2.83Å
107	L	98	Very high	97.2	Very high	30 Å²	30	49.7 Å²	49.7	16%	0.157	28%	0.28	C	S	.	.	H	α-helix	trans	-61	-45.4	178.3	-70.7	178.4	0	0	0	112.9	V70 L72 Q103 M104 S109 T110 L111	V70-L107 HydrophobicContact CB-CD1 4.17Å; V70-L107 HydrophobicContact CG1-CD1 3.6Å; L72-L107 HydrophobicContact CB-CD1 4.3Å; L72-L107 HydrophobicContact CB-CD2 3.78Å; L72-L107 HydrophobicContact CD1-CD2 3.96Å; Q103-L107 WeakPolarHBondContact O-CG 3.44Å; Q103-L107 PolarHBondContact O-N 3.15Å; M104-L107 PolarHBondContact O-N 3.31Å; L107-S109 VanDerWaalsContact C-N 3.27Å; L107-S109 PolarHBondContact O-N 3.36Å; L107-T110 PolarHBondContact O-N 3.22Å; L107-L111 WeakPolarHBondContact O-CB 3.48Å; L107-L111 VanDerWaalsContact O-CG 3.28Å; L107-L111 WeakPolarHBondContact O-CG 3.44Å; L107-L111 PolarHBondContact O-N 3.38Å
108	V	98.2	Very high	97.3	Very high	2 Å²	2	52.8 Å²	52.8	1%	0.012	29%	0.292	C	S	.	.	H	α-helix	trans	-61.2	-38.6	176.1	169.6	0	0	0	0	110.9	M104 E106 L111 S112 F122 L157 Q160 L164	M104-V108 HydrophobicContact CG-CG2 4.44Å; M104-V108 WeakPolarHBondContact O-CB 3.49Å; M104-V108 VanDerWaalsContact O-CG2 3.29Å; M104-V108 WeakPolarHBondContact O-CG2 3.38Å; M104-V108 PolarHBondContact O-N 3.25Å; E106-V108 PolarHBondContact O-N 2.98Å; V108-L111 PolarHBondContact O-N 3.43Å; V108-S112 PolarHBondContact O-N 2.77Å; V108-S112 VanDerWaalsContact O-N 3.1Å; V108-F122 HydrophobicContact CG2-CE1 4.34Å; V108-F122 HydrophobicContact CG2-CZ 4.31Å; V108-L157 HydrophobicContact CG2-CD1 4.29Å; V108-Q160 HydrophobicContact CG1-CB 3.82Å; V108-L164 HydrophobicContact CG1-CD1 4.34Å; V108-L164 HydrophobicContact CG1-CD2 4.18Å; V108-L164 HydrophobicContact CG1-CG 4.19Å
109	S	97.1	Very high	97.4	Very high	62 Å²	62	47.7 Å²	47.7	43%	0.434	27%	0.268	S	S	.	.	H	α-helix	trans	-67.3	-36	175.7	-171.5	0	0	0	0	112.7	R105 E106 L107 S112 H113	R105-S109 VanDerWaalsContact O-CB 3.29Å; R105-S109 WeakPolarHBondContact O-CB 3.42Å; R105-S109 PolarHBondContact O-N 2.86Å; E106-S109 WeakPolarHBondContact O-CB 3.36Å; E106-S109 PolarHBondContact O-N 3.4Å; E106-S109 VanDerWaalsContact O-N 3.14Å; L107-S109 VanDerWaalsContact C-N 3.27Å; L107-S109 PolarHBondContact O-N 3.36Å; S109-S112 PolarHBondContact O-OG 3.11Å; S109-H113 PolarHBondContact O-ND1 3.31Å
110	T	97.4	Very high	97.5	Very high	71 Å²	71	45.3 Å²	45.3	44%	0.436	25%	0.254	S	S	.	.	H	α-helix	trans	-66.5	-45	173.4	-58.2	0	0	0	0	110.8	E106 L107 S112 H113	E106-T110 PolarHBondContact O-N 3.48Å; E106-T110 PolarHBondContact O-OG1 2.83Å; L107-T110 PolarHBondContact O-N 3.22Å; T110-S112 VanDerWaalsContact C-N 3.31Å; T110-S112 PolarHBondContact O-N 2.91Å; T110-H113 PolarHBondContact O-N 3.43Å
111	L	98	Very high	97.6	Very high	3 Å²	3	45.3 Å²	45.3	2%	0.016	25%	0.254	C	S	.	.	H	α-helix	trans	-64.2	-31.3	-178.4	-73	170.6	0	0	0	113.5	L72 V83 V85 L107 V108 H113 D114 V117 V120 L164	L72-L111 HydrophobicContact CD1-CD1 4.3Å; L72-L111 HydrophobicContact CD1-CD2 3.91Å; L72-L111 HydrophobicContact CD1-CG 4.09Å; V83-L111 HydrophobicContact CB-CD2 4.29Å; V83-L111 HydrophobicContact CG1-CD2 3.93Å; V85-L111 HydrophobicContact CG2-CD1 3.74Å; L107-L111 WeakPolarHBondContact O-CB 3.48Å; L107-L111 VanDerWaalsContact O-CG 3.28Å; L107-L111 WeakPolarHBondContact O-CG 3.44Å; L107-L111 PolarHBondContact O-N 3.38Å; V108-L111 PolarHBondContact O-N 3.43Å; L111-H113 PolarHBondContact O-N 3.34Å; L111-D114 PolarHBondContact O-N 3.22Å; L111-V117 HydrophobicContact CD2-CG2 3.92Å; L111-V120 HydrophobicContact CD1-CG1 3.99Å; L111-V120 HydrophobicContact CD1-CG2 4.14Å; L111-V120 HydrophobicContact CD2-CG2 4.24Å; L111-L164 HydrophobicContact CB-CD2 3.9Å
112	S	96.9	Very high	97.6	Very high	42 Å²	42	45.1 Å²	45.1	29%	0.294	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-20.8	-179.5	63.7	0	0	0	0	113.8	V108 S109 T110	V108-S112 PolarHBondContact O-N 2.77Å; V108-S112 VanDerWaalsContact O-N 3.1Å; S109-S112 PolarHBondContact O-OG 3.11Å; T110-S112 VanDerWaalsContact C-N 3.31Å; T110-S112 PolarHBondContact O-N 2.91Å
113	H	95.8	Very high	97.7	Very high	153 Å²	153	43.1 Å²	43.1	71%	0.708	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-107.1	-0.5	-178.8	-57.9	91.9	0	0	0	113.3	S109 T110 L111 S115	S109-H113 PolarHBondContact O-ND1 3.31Å; T110-H113 PolarHBondContact O-N 3.43Å; L111-H113 PolarHBondContact O-N 3.34Å; H113-S115 PolarHBondContact O-N 3.09Å
114	D	96.8	Very high	97.7	Very high	32 Å²	32	42.5 Å²	42.5	17%	0.171	23%	0.232	C	C	.	.			trans	-92.3	104.3	-174.7	-172.5	-13.6	0	0	0	111.8	R74 L111 A116 V117	R74-D114 IonicContact CZ-OD2 3.76Å; R74-D114 IonicContact NH1-OD2 3.79Å; R74-D114 PolarHBondContact NH1-OD2 2.99Å; R74-D114 IonicContact NH2-OD2 2.89Å; R74-D114 PolarHBondContact NH2-OD2 3.22Å; L111-D114 PolarHBondContact O-N 3.22Å; D114-A116 PolarHBondContact O-N 2.79Å; D114-A116 WeakPolarHBondContact OD1-CB 3.48Å; D114-A116 PolarHBondContact OD1-N 2.8Å; D114-V117 HydrophobicContact CB-CG2 3.84Å; D114-V117 PolarHBondContact O-N 3.48Å; D114-V117 WeakPolarHBondContact OD2-CG2 3.46Å
115	S	94.4	Very high	97.7	Very high	97 Å²	97	45.7 Å²	45.7	68%	0.678	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-20.7	-179.5	61.1	0	0	0	0	113.7	H113 V117 R280	H113-S115 PolarHBondContact O-N 3.09Å; S115-V117 VanDerWaalsContact C-N 3.33Å; S115-R280 PolarHBondContact O-NH2 3.19Å
116	A	96.2	Very high	97.8	Very high	63 Å²	63	42.1 Å²	42.1	52%	0.521	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77	-19.4	179.2	0	0	0	0	0	112.9	D114	D114-A116 PolarHBondContact O-N 2.79Å; D114-A116 WeakPolarHBondContact OD1-CB 3.48Å; D114-A116 PolarHBondContact OD1-N 2.8Å
117	V	98.1	Very high	97.7	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	24%	0.241	C	C	.	.			trans	-75.1	131.7	176.8	-174.7	0	0	0	0	110.1	V83 L111 D114 S115 V120 T166 R280	V83-V117 HydrophobicContact CB-CG1 4.34Å; V83-V117 HydrophobicContact CG2-CB 4.42Å; V83-V117 HydrophobicContact CG2-CG1 4.07Å; V83-V117 HydrophobicContact CG2-CG2 3.64Å; L111-V117 HydrophobicContact CD2-CG2 3.92Å; D114-V117 HydrophobicContact CB-CG2 3.84Å; D114-V117 PolarHBondContact O-N 3.48Å; D114-V117 WeakPolarHBondContact OD2-CG2 3.46Å; S115-V117 VanDerWaalsContact C-N 3.33Å; V117-V120 HydrophobicContact CG1-CG2 3.63Å; V117-T166 HydrophobicContact CB-CG2 4.19Å; V117-T166 HydrophobicContact CG1-CG2 4.05Å; V117-T166 WeakPolarHBondContact O-CG2 3.32Å; V117-R280 PolarHBondContact O-NH2 2.9Å
118	R	98.4	Very high	97.7	Very high	65 Å²	65	41.9 Å²	41.9	25%	0.245	26%	0.256	C	S	.	.	S	Bend	trans	-110.6	-35.9	175.2	-61.7	-164.7	-179.5	-158.6	-0.8	112.2	G81 P167 L272 P276 Y329	G81-R118 WeakPolarHBondContact O-CA 3.47Å; G81-R118 PolarHBondContact O-N 2.97Å; R118-P167 WeakPolarHBondContact O-CD 3.46Å; R118-L272 HydrophobicContact CB-CD2 3.88Å; R118-L272 HydrophobicContact CG-CD2 4.44Å; R118-L272 PolarHBondContact NH1-O 2.89Å; R118-P276 HydrophobicContact CG-CB 4.3Å; R118-Y329 PolarHBondContact NH2-O 2.86Å
119	V	98.9	Very high	97.7	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	141.6	176.3	-174.3	0	0	0	0	109.5	G81 I82 V83 V169 A268 I271	G81-V119 PolarHBondContact O-N 3.47Å; I82-V119 WeakPolarHBondContact CA-O 3.35Å; I82-V119 HydrophobicContact CG1-CB 4.44Å; V83-V119 PolarHBondContact N-O 2.95Å; V119-V169 HydrophobicContact CG1-CG2 4.13Å; V119-A268 HydrophobicContact CB-CB 4.14Å; V119-A268 HydrophobicContact CG1-CB 3.73Å; V119-A268 HydrophobicContact CG2-CB 4.32Å; V119-I271 HydrophobicContact CG2-CB 3.95Å; V119-I271 HydrophobicContact CG2-CG2 3.72Å
120	V	98.9	Very high	97.8	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	131.8	173.5	179.1	0	0	0	0	109.7	V83 V85 L111 V117 F122 P167 T168 V169	V83-V120 CarbonylContact O-C 3.45Å; V83-V120 VanDerWaalsContact O-CA 3.31Å; V83-V120 WeakPolarHBondContact O-CA 3.3Å; V85-V120 HydrophobicContact CG2-CG1 3.81Å; L111-V120 HydrophobicContact CD1-CG1 3.99Å; L111-V120 HydrophobicContact CD1-CG2 4.14Å; L111-V120 HydrophobicContact CD2-CG2 4.24Å; V117-V120 HydrophobicContact CG1-CG2 3.63Å; V120-F122 HydrophobicContact CG1-CD2 4.14Å; V120-F122 HydrophobicContact CG1-CE2 3.69Å; V120-F122 HydrophobicContact CG1-CZ 4.1Å; V120-P167 PolarHBondContact N-O 3.4Å; V120-T168 HydrophobicContact CB-CG2 4.21Å; V120-T168 CarbonylContact O-C 3.1Å; V120-T168 VanDerWaalsContact O-CA 3.29Å; V120-T168 WeakPolarHBondContact O-CA 3.41Å; V120-V169 PolarHBondContact O-N 2.73Å
121	I	98.9	Very high	97.9	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	118.7	174.8	-58.4	177.4	0	0	0	108.7	I82 V83 E84 V85 V169 A171 Y261 A264 L265 A268	I82-I121 HydrophobicContact CG2-CD1 3.74Å; I82-I121 HydrophobicContact CG2-CG1 4.1Å; V83-I121 PolarHBondContact O-N 3.32Å; E84-I121 CarbonylContact C-O 3.41Å; E84-I121 WeakPolarHBondContact CA-O 3.36Å; V85-I121 PolarHBondContact N-O 3.36Å; I121-V169 CarbonylContact C-O 3.58Å; I121-V169 WeakPolarHBondContact CA-O 3.37Å; I121-V169 HydrophobicContact CG1-CB 4.37Å; I121-A171 HydrophobicContact CG2-CB 4.16Å; I121-Y261 HydrophobicContact CG2-CD2 4.35Å; I121-A264 HydrophobicContact CD1-CB 4.32Å; I121-A264 HydrophobicContact CG2-CB 4.05Å; I121-L265 HydrophobicContact CD1-CD1 4.3Å; I121-A268 HydrophobicContact CD1-CB 4.01Å
122	F	98.9	Very high	97.9	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	117.7	168.2	-65.4	-96.2	0	0	0	108.4	V85 M104 V108 V120 F130 A161 L164 T168 V169 A171 C187	V85-F122 HydrophobicContact CB-CD1 3.69Å; V85-F122 HydrophobicContact CB-CE1 3.95Å; V85-F122 HydrophobicContact CB-CG 4.29Å; V85-F122 HydrophobicContact CG1-CD1 3.73Å; V85-F122 HydrophobicContact CG1-CE1 3.89Å; V85-F122 HydrophobicContact CG2-CD1 4.14Å; V85-F122 HydrophobicContact CG2-CE1 3.91Å; V85-F122 HydrophobicContact CG2-CZ 4.3Å; M104-F122 HydrophobicContact SD-CD1 4.2Å; M104-F122 HydrophobicContact SD-CE1 3.88Å; V108-F122 HydrophobicContact CG2-CE1 4.34Å; V108-F122 HydrophobicContact CG2-CZ 4.31Å; V120-F122 HydrophobicContact CG1-CD2 4.14Å; V120-F122 HydrophobicContact CG1-CE2 3.69Å; V120-F122 HydrophobicContact CG1-CZ 4.1Å; F122-F130 HydrophobicContact CB-CZ 4.47Å; F122-A161 HydrophobicContact CZ-CB 4.45Å; F122-L164 HydrophobicContact CE2-CD1 4.5Å; F122-L164 HydrophobicContact CZ-CD1 4.23Å; F122-T168 HydrophobicContact CE2-CG2 3.98Å; F122-V169 PolarHBondContact N-O 3.4Å; F122-A171 PolarHBondContact O-N 3.07Å; F122-C187 VanDerWaalsContact CD2-SG 3.52Å
123	R	98.8	Very high	97.9	Very high	35 Å²	35	35.7 Å²	35.7	13%	0.132	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	163.2	176.9	65.8	163.9	-98.7	110	-4	111.9	V85 L86 M87 A171 Y261	V85-R123 PolarHBondContact O-N 2.97Å; L86-R123 HydrophobicContact CD2-CG 3.66Å; M87-R123 WeakPolarHBondContact CE-O 3.18Å; M87-R123 PolarHBondContact N-O 3.43Å; R123-A171 HydrophobicContact CB-CB 4.13Å; R123-Y261 HydrophobicContact CB-CD2 4.43Å; R123-Y261 VanDerWaalsContact CD-CD2 3.49Å; R123-Y261 HydrophobicContact CG-CD2 4.41Å
124	S	98.8	Very high	98	Very high	14 Å²	14	29.5 Å²	29.5	10%	0.098	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	144	172.1	-168.7	0	0	0	0	112.2	M87 N94 V126 V129	M87-S124 PolarHBondContact O-OG 3.12Å; N94-S124 PolarHBondContact ND2-OG 3.45Å; S124-V126 PolarHBondContact OG-N 3.41Å; S124-V129 WeakPolarHBondContact CB-O 3.41Å; S124-V129 PolarHBondContact OG-O 3.37Å
125	L	98.4	Very high	98	Very high	68 Å²	68	28.6 Å²	28.6	36%	0.356	19%	0.189	S	C	.	.	S	Bend	trans	-91.8	-4.5	163.5	-57.3	-168.8	0	0	0	112.7	L86 M87 C88 P127	L86-L125 HydrophobicContact CB-CD1 4.25Å; L86-L125 HydrophobicContact CB-CG 4.21Å; L86-L125 HydrophobicContact CD1-CD1 4.33Å; L86-L125 HydrophobicContact CD2-CD2 4.02Å; M87-L125 PolarHBondContact O-N 2.95Å; C88-L125 HydrophobicContact CB-CB 4.25Å; C88-L125 HydrophobicContact CB-CD1 4.05Å; C88-L125 HydrophobicContact CB-CG 4.37Å; L125-P127 WeakPolarHBondContact O-CD 3.36Å
126	V	98.3	Very high	97.9	Very high	15 Å²	15	28.1 Å²	28.1	9%	0.091	18%	0.178	C	C	.	.	S	Bend	trans	-90.9	114.9	-176.5	-175.1	0	0	0	0	109.4	H90 N94 S124 G128 V129	H90-V126 HydrophobicContact CB-CG2 4.4Å; N94-V126 WeakPolarHBondContact ND2-CG2 3.41Å; N94-V126 WeakPolarHBondContact OD1-CG2 3.43Å; S124-V126 PolarHBondContact OG-N 3.41Å; V126-G128 PolarHBondContact O-N 2.73Å; V126-V129 HydrophobicContact CB-CB 4.27Å; V126-V129 HydrophobicContact CG1-CB 4.03Å; V126-V129 HydrophobicContact CG1-CG2 4.25Å; V126-V129 PolarHBondContact O-N 3.19Å; V126-V129 VanDerWaalsContact O-N 3.16Å
127	P	96.3	Very high	97.9	Very high	111 Å²	111	33.4 Å²	33.4	72%	0.721	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.6	132	-176.6	-27.6	36	0	0	0	113	L125 V129	L125-P127 WeakPolarHBondContact O-CD 3.36Å; P127-V129 PolarHBondContact O-N 2.67Å
128	G	97.9	Very high	97.8	Very high	46 Å²	46	35.5 Å²	35.5	47%	0.474	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.7	8.2	177.2	0	0	0	0	0	115.2	V126 G174 V175	V126-G128 PolarHBondContact O-N 2.73Å; G128-G174 VanDerWaalsContact O-CA 3.31Å; G128-G174 WeakPolarHBondContact O-CA 3.23Å; G128-V175 PolarHBondContact O-N 2.92Å
129	V	98.6	Very high	97.6	Very high	17 Å²	17	34.5 Å²	34.5	10%	0.103	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	131	179.8	178.3	0	0	0	0	109.6	R93 S124 V126 P127	R93-V129 HydrophobicContact CB-CG1 3.92Å; R93-V129 HydrophobicContact CB-CG2 4.13Å; R93-V129 HydrophobicContact CG-CG2 4.2Å; R93-V129 VanDerWaalsContact O-CG1 3.24Å; R93-V129 WeakPolarHBondContact O-CG1 3.19Å; S124-V129 WeakPolarHBondContact CB-O 3.41Å; S124-V129 PolarHBondContact OG-O 3.37Å; V126-V129 HydrophobicContact CB-CB 4.27Å; V126-V129 HydrophobicContact CG1-CB 4.03Å; V126-V129 HydrophobicContact CG1-CG2 4.25Å; V126-V129 PolarHBondContact O-N 3.19Å; V126-V129 VanDerWaalsContact O-N 3.16Å; P127-V129 PolarHBondContact O-N 2.67Å
130	F	98.9	Very high	97.4	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	-67.9	161.2	-179.3	-106.9	0	0	0	109.1	M87 N94 F122 A170 A171 M172 V175 A176 G180 A184	M87-F130 HydrophobicContact CE-CD1 4.31Å; M87-F130 HydrophobicContact CE-CD2 3.56Å; M87-F130 HydrophobicContact CE-CE1 4.08Å; M87-F130 HydrophobicContact CE-CE2 3.3Å; M87-F130 HydrophobicContact CE-CG 4.08Å; M87-F130 HydrophobicContact CE-CZ 3.58Å; N94-F130 WeakPolarHBondContact CB-O 3.17Å; N94-F130 PolarHBondContact ND2-O 2.9Å; F122-F130 HydrophobicContact CB-CZ 4.47Å; F130-A170 HydrophobicContact CZ-CB 4.03Å; F130-A171 WeakPolarHBondContact CD2-O 3.44Å; F130-A171 WeakPolarHBondContact CE2-O 3.34Å; F130-M172 HydrophobicContact CB-CB 4.49Å; F130-M172 HydrophobicContact CB-CG 4.31Å; F130-M172 HydrophobicContact CD1-CG 4.01Å; F130-M172 HydrophobicContact CD2-CB 4.49Å; F130-M172 HydrophobicContact CD2-CG 3.92Å; F130-M172 HydrophobicContact CE1-CG 4.29Å; F130-M172 HydrophobicContact CE2-CG 4.17Å; F130-M172 HydrophobicContact CG-CB 4.44Å; F130-M172 HydrophobicContact CG-CG 3.82Å; F130-M172 HydrophobicContact CZ-CG 4.36Å; F130-V175 WeakPolarHBondContact CA-O 3.44Å; F130-V175 WeakPolarHBondContact CB-O 3.4Å; F130-V175 PolarHBondContact N-O 2.96Å; F130-A176 HydrophobicContact CB-CB 4.01Å; F130-A176 HydrophobicContact CD1-CB 3.8Å; F130-A176 HydrophobicContact CG-CB 4.28Å; F130-G180 WeakPolarHBondContact CE1-O 3.24Å; F130-A184 HydrophobicContact CE1-CB 4.11Å
131	C	98.8	Very high	97.3	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.8	128.2	177.3	171.9	0	0	0	0	110.5	N94 G133 V175 A176 L177 G180	N94-C131 HydrophobicContact CB-CB 4.38Å; N94-C131 PolarHBondContact O-SG 3.17Å; C131-G133 PolarHBondContact O-N 3.11Å; C131-G133 PolarHBondContact SG-N 3.15Å; C131-V175 PolarHBondContact N-O 3.1Å; C131-A176 WeakPolarHBondContact O-CA 3.38Å; C131-L177 PolarHBondContact O-N 2.9Å; C131-G180 VanDerWaalsContact CB-CA 3.47Å; C131-G180 WeakPolarHBondContact SG-CA 3.31Å
132	A	98.3	Very high	97.2	Very high	31 Å²	31	47.1 Å²	47.1	26%	0.256	27%	0.273	S	S	.	.			trans	-79.1	-0.8	-177.8	0	0	0	0	0	114.7	R93 L177	R93-A132 HydrophobicContact CB-CB 3.99Å; R93-A132 WeakPolarHBondContact O-CB 3.4Å; R93-A132 PolarHBondContact O-N 2.62Å; R93-A132 VanDerWaalsContact O-N 3.1Å; A132-L177 CarbonylContact C-O 3.5Å
133	G	97.7	Very high	97.2	Very high	2 Å²	2	51.3 Å²	51.3	2%	0.021	30%	0.295	C	S	.	.			trans	92.7	-160.8	-176.1	0	0	0	0	0	112.5	A95 L96 C131 L177	A95-G133 CarbonylContact C-O 3.51Å; A95-G133 WeakPolarHBondContact CA-O 3.23Å; L96-G133 PolarHBondContact N-O 3.19Å; C131-G133 PolarHBondContact O-N 3.11Å; C131-G133 PolarHBondContact SG-N 3.15Å; G133-L177 WeakPolarHBondContact CA-O 3.49Å; G133-L177 PolarHBondContact N-O 2.78Å; G133-L177 VanDerWaalsContact N-O 3.12Å
134	A	96.9	Very high	97.1	Very high	24 Å²	24	57 Å²	57	20%	0.198	33%	0.328	C	S	.	.	B	Isolated β-bridge	trans	-62.8	144.8	-177.7	0	0	0	0	0	112.5	L136 F150 L154	A134-L136 PolarHBondContact O-N 3.46Å; A134-F150 HydrophobicContact CB-CE1 4.36Å; A134-L154 HydrophobicContact CB-CD1 4.1Å
135	D	97.1	Very high	97	Very high	13 Å²	13	60 Å²	60	7%	0.07	35%	0.349	C	S	.	.			trans	-69.9	102.1	177.9	-164.3	-37.8	0	0	0	110.9	R89 A95 L96 K137 E138 R139	R89-D135 IonicContact CZ-OD2 3.86Å; R89-D135 IonicContact NH1-OD2 2.75Å; R89-D135 PolarHBondContact NH1-OD2 3.38Å; R89-D135 IonicContact NH2-OD2 3.22Å; R89-D135 PolarHBondContact NH2-OD2 3.23Å; A95-D135 HydrophobicContact CB-CB 3.96Å; L96-D135 PolarHBondContact O-N 3.49Å; D135-K137 PolarHBondContact O-N 3.16Å; D135-K137 WeakPolarHBondContact OD1-CA 3.47Å; D135-K137 WeakPolarHBondContact OD1-CB 3.35Å; D135-K137 PolarHBondContact OD1-N 3Å; D135-E138 HydrophobicContact CB-CB 4.14Å; D135-E138 HydrophobicContact CB-CG 4.14Å; D135-E138 PolarHBondContact O-N 2.85Å; D135-E138 PolarHBondContact OD1-N 3.19Å; D135-R139 WeakPolarHBondContact O-CB 3.46Å; D135-R139 VanDerWaalsContact O-CG 3.22Å; D135-R139 WeakPolarHBondContact O-CG 3.16Å; D135-R139 PolarHBondContact O-N 3.34Å
136	L	93.3	Very high	97	Very high	87 Å²	87	61.5 Å²	61.5	46%	0.455	35%	0.354	S	S	.	.	H	α-helix	trans	-67.4	-21	-178.7	-63.1	-177.6	0	0	0	113.1	A134 A140	A134-L136 PolarHBondContact O-N 3.46Å; L136-A140 WeakPolarHBondContact O-CB 2.9Å; L136-A140 PolarHBondContact O-N 2.9Å; L136-A140 VanDerWaalsContact O-N 3.12Å
137	K	95.1	Very high	96.8	Very high	173 Å²	173	62.4 Å²	62.4	75%	0.752	36%	0.362	S	S	*	.	H	α-helix	trans	-74.6	-44.3	176	-65.4	177.7	177.7	179.2	0	110.5	D135	D135-K137 PolarHBondContact O-N 3.16Å; D135-K137 WeakPolarHBondContact OD1-CA 3.47Å; D135-K137 WeakPolarHBondContact OD1-CB 3.35Å; D135-K137 PolarHBondContact OD1-N 3Å
138	E	96.1	Very high	96.8	Very high	44 Å²	44	62 Å²	62	21%	0.206	35%	0.353	C	S	.	.	H	α-helix	trans	-64.5	-45.8	173.8	-66.2	177.6	-148.3	0	0	110.3	R89 G97 H98 D135 A140 L141 M142	R89-E138 IonicContact CZ-OE1 2.75Å; R89-E138 IonicContact NH1-OE1 3.66Å; R89-E138 IonicContact NH2-OE1 3.93Å; R89-E138 PolarHBondContact NH2-OE1 3.1Å; G97-E138 WeakPolarHBondContact CA-OE1 3.19Å; G97-E138 WeakPolarHBondContact CA-OE2 3.47Å; H98-E138 IonicContact CD2-OE2 3.41Å; H98-E138 PolarHBondContact CD2-OE2 3.03Å; H98-E138 VanDerWaalsContact CD2-OE2 3.31Å; H98-E138 IonicContact CG-OE2 3.27Å; H98-E138 PolarHBondContact N-OE2 3.41Å; D135-E138 HydrophobicContact CB-CB 4.14Å; D135-E138 HydrophobicContact CB-CG 4.14Å; D135-E138 PolarHBondContact O-N 2.85Å; D135-E138 PolarHBondContact OD1-N 3.19Å; E138-A140 VanDerWaalsContact C-N 3.28Å; E138-A140 PolarHBondContact O-N 2.88Å; E138-L141 PolarHBondContact O-N 3.18Å; E138-L141 VanDerWaalsContact O-N 3.1Å; E138-M142 HydrophobicContact CB-CE 4.25Å
139	R	95.1	Very high	96.8	Very high	44 Å²	44	64.5 Å²	64.5	17%	0.166	36%	0.356	C	S	.	.	H	α-helix	trans	-61.2	-31.2	179.4	-72.8	168.5	56.8	84.6	8.9	114.5	D135 L141 M142 F150	D135-R139 WeakPolarHBondContact O-CB 3.46Å; D135-R139 VanDerWaalsContact O-CG 3.22Å; D135-R139 WeakPolarHBondContact O-CG 3.16Å; D135-R139 PolarHBondContact O-N 3.34Å; R139-L141 PolarHBondContact O-N 3.12Å; R139-M142 HydrophobicContact CG-SD 4.3Å; R139-M142 PolarHBondContact O-N 3.28Å; R139-F150 HydrophobicContact CG-CD1 4.35Å; R139-F150 HydrophobicContact CG-CE1 4.21Å
140	A	94.6	Very high	96.8	Very high	83 Å²	83	64 Å²	64	69%	0.686	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-15.8	179.5	0	0	0	0	0	113.2	L136 E138	L136-A140 WeakPolarHBondContact O-CB 2.9Å; L136-A140 PolarHBondContact O-N 2.9Å; L136-A140 VanDerWaalsContact O-N 3.12Å; E138-A140 VanDerWaalsContact C-N 3.28Å; E138-A140 PolarHBondContact O-N 2.88Å
141	L	96.9	Very high	96.7	Very high	151 Å²	151	65.1 Å²	65.1	79%	0.791	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.8	-9.1	179.8	-57.5	176.4	0	0	0	112.9	E138 R139	E138-L141 PolarHBondContact O-N 3.18Å; E138-L141 VanDerWaalsContact O-N 3.1Å; R139-L141 PolarHBondContact O-N 3.12Å
142	M	96.9	Very high	96.6	Very high	31 Å²	31	70.1 Å²	70.1	15%	0.153	38%	0.382	C	S	.	.			trans	-81.7	141.1	-177.6	-66.6	172.6	-175	0	0	111.1	H98 E138 R139 E146 F150	H98-M142 WeakPolarHBondContact NE2-CE 3.41Å; E138-M142 HydrophobicContact CB-CE 4.25Å; R139-M142 HydrophobicContact CG-SD 4.3Å; R139-M142 PolarHBondContact O-N 3.28Å; M142-E146 WeakPolarHBondContact CA-OE2 3.22Å; M142-E146 HydrophobicContact CB-CB 3.89Å; M142-E146 HydrophobicContact CG-CB 4.15Å; M142-F150 HydrophobicContact CE-CB 4.22Å; M142-F150 HydrophobicContact CE-CD1 4.26Å; M142-F150 HydrophobicContact CE-CD2 3.92Å; M142-F150 HydrophobicContact CE-CE2 4.36Å; M142-F150 HydrophobicContact CE-CG 3.86Å; M142-F150 HydrophobicContact SD-CB 3.9Å; M142-F150 HydrophobicContact SD-CD1 4.26Å; M142-F150 HydrophobicContact SD-CG 4.02Å
143	D	97.7	Very high	96.6	Very high	88 Å²	88	70.1 Å²	70.1	47%	0.471	38%	0.38	S	S	.	.			trans	-74.3	179.1	162.4	77	30.2	0	0	0	112.1	S145 E146 S147	D143-S145 VanDerWaalsContact C-N 3.33Å; D143-S145 PolarHBondContact O-N 2.97Å; D143-S145 WeakPolarHBondContact OD1-CA 3.28Å; D143-S145 WeakPolarHBondContact OD1-CB 3.49Å; D143-S145 PolarHBondContact OD1-N 2.82Å; D143-E146 PolarHBondContact N-OE2 3.17Å; D143-E146 WeakPolarHBondContact OD1-CG 3.34Å; D143-E146 PolarHBondContact OD1-N 3.46Å; D143-S147 VanDerWaalsContact O-CB 3.27Å; D143-S147 WeakPolarHBondContact O-CB 3.47Å; D143-S147 PolarHBondContact O-N 3.32Å
144	N	96.9	Very high	96.6	Very high	154 Å²	154	70.3 Å²	70.3	82%	0.824	38%	0.381	S	S	*	.	H	α-helix	trans	-63.2	-37	-177.8	-71.1	-25.3	0	0	0	113.2	D148	N144-D148 PolarHBondContact O-N 3.18Å; N144-D148 VanDerWaalsContact O-N 3.11Å
145	S	97.6	Very high	96.7	Very high	78 Å²	78	74 Å²	74	55%	0.545	39%	0.39	S	S	.	.	H	α-helix	trans	-71.8	-46.5	-179.3	-177.6	0	0	0	0	110.4	D143 S147 D148 L149	D143-S145 VanDerWaalsContact C-N 3.33Å; D143-S145 PolarHBondContact O-N 2.97Å; D143-S145 WeakPolarHBondContact OD1-CA 3.28Å; D143-S145 WeakPolarHBondContact OD1-CB 3.49Å; D143-S145 PolarHBondContact OD1-N 2.82Å; S145-S147 VanDerWaalsContact C-N 3.33Å; S145-S147 PolarHBondContact O-N 3.2Å; S145-D148 PolarHBondContact O-N 3.14Å; S145-L149 WeakPolarHBondContact O-CG 3.24Å; S145-L149 PolarHBondContact O-N 3.07Å
146	E	97.4	Very high	96.7	Very high	99 Å²	99	75.5 Å²	75.5	46%	0.463	40%	0.401	S	S	.	.	H	α-helix	trans	-60.3	-43	175.3	-67.7	177	138.8	0	0	111.5	M142 D143 D148 L149 F150	M142-E146 WeakPolarHBondContact CA-OE2 3.22Å; M142-E146 HydrophobicContact CB-CB 3.89Å; M142-E146 HydrophobicContact CG-CB 4.15Å; D143-E146 PolarHBondContact N-OE2 3.17Å; D143-E146 WeakPolarHBondContact OD1-CG 3.34Å; D143-E146 PolarHBondContact OD1-N 3.46Å; E146-D148 PolarHBondContact O-N 3.48Å; E146-L149 PolarHBondContact O-N 3Å; E146-F150 VanDerWaalsContact O-CB 3.26Å; E146-F150 WeakPolarHBondContact O-CB 3.21Å; E146-F150 PolarHBondContact O-N 3.31Å
147	S	95.6	Very high	97	Very high	35 Å²	35	71.4 Å²	71.4	25%	0.245	38%	0.38	C	S	.	.	H	α-helix	trans	-62.9	-40.5	177.1	177.8	0	0	0	0	112.3	D143 S145 V151	D143-S147 VanDerWaalsContact O-CB 3.27Å; D143-S147 WeakPolarHBondContact O-CB 3.47Å; D143-S147 PolarHBondContact O-N 3.32Å; S145-S147 VanDerWaalsContact C-N 3.33Å; S145-S147 PolarHBondContact O-N 3.2Å; S147-V151 WeakPolarHBondContact O-CG2 3.45Å; S147-V151 PolarHBondContact O-N 2.89Å
148	D	96.6	Very high	97.1	Very high	101 Å²	101	63.2 Å²	63.2	54%	0.54	34%	0.344	S	S	.	.	H	α-helix	trans	-64.9	-49.2	177.5	-175	51.8	0	0	0	111.4	N144 S145 E146 F150 V151 Q152	N144-D148 PolarHBondContact O-N 3.18Å; N144-D148 VanDerWaalsContact O-N 3.11Å; S145-D148 PolarHBondContact O-N 3.14Å; E146-D148 PolarHBondContact O-N 3.48Å; D148-F150 VanDerWaalsContact C-N 3.29Å; D148-F150 PolarHBondContact O-N 3.44Å; D148-V151 PolarHBondContact O-N 3.41Å; D148-Q152 WeakPolarHBondContact O-CB 3.39Å; D148-Q152 PolarHBondContact O-N 3.5Å
149	L	97.4	Very high	97.2	Very high	100 Å²	100	63.6 Å²	63.6	52%	0.524	35%	0.352	S	S	.	.	H	α-helix	trans	-59.3	-40.1	176.6	-70.4	174.3	0	0	0	112.1	S145 E146 Q152 S153	S145-L149 WeakPolarHBondContact O-CG 3.24Å; S145-L149 PolarHBondContact O-N 3.07Å; E146-L149 PolarHBondContact O-N 3Å; L149-Q152 PolarHBondContact O-N 3.35Å; L149-S153 WeakPolarHBondContact O-CB 3.38Å; L149-S153 PolarHBondContact O-N 3.49Å
150	F	97.3	Very high	97.4	Very high	5 Å²	5	64.5 Å²	64.5	2%	0.022	36%	0.358	C	S	.	.	H	α-helix	trans	-64.6	-46.5	177.2	-177.1	-103.5	0	0	0	111.9	L96 H98 A134 R139 M142 E146 D148 Q152 S153 L154	L96-F150 WeakPolarHBondContact O-CZ 3.42Å; H98-F150 AromaticContact CE1-CD2 3.58Å; H98-F150 AromaticContact NE2-CD2 3.82Å; A134-F150 HydrophobicContact CB-CE1 4.36Å; R139-F150 HydrophobicContact CG-CD1 4.35Å; R139-F150 HydrophobicContact CG-CE1 4.21Å; M142-F150 HydrophobicContact CE-CB 4.22Å; M142-F150 HydrophobicContact CE-CD1 4.26Å; M142-F150 HydrophobicContact CE-CD2 3.92Å; M142-F150 HydrophobicContact CE-CE2 4.36Å; M142-F150 HydrophobicContact CE-CG 3.86Å; M142-F150 HydrophobicContact SD-CB 3.9Å; M142-F150 HydrophobicContact SD-CD1 4.26Å; M142-F150 HydrophobicContact SD-CG 4.02Å; E146-F150 VanDerWaalsContact O-CB 3.26Å; E146-F150 WeakPolarHBondContact O-CB 3.21Å; E146-F150 PolarHBondContact O-N 3.31Å; D148-F150 VanDerWaalsContact C-N 3.29Å; D148-F150 PolarHBondContact O-N 3.44Å; F150-Q152 VanDerWaalsContact C-N 3.32Å; F150-Q152 PolarHBondContact O-N 2.94Å; F150-S153 WeakPolarHBondContact O-CB 3.47Å; F150-S153 PolarHBondContact O-N 2.99Å; F150-S153 VanDerWaalsContact O-N 3.16Å; F150-L154 HydrophobicContact CD1-CD1 4.14Å; F150-L154 HydrophobicContact CD1-CG 4.45Å; F150-L154 HydrophobicContact CE1-CD1 3.66Å; F150-L154 HydrophobicContact CE1-CD2 4.46Å; F150-L154 HydrophobicContact CE1-CG 4.06Å; F150-L154 HydrophobicContact CZ-CD1 4.28Å; F150-L154 HydrophobicContact CZ-CD2 4.27Å; F150-L154 HydrophobicContact CZ-CG 4.3Å; F150-L154 PolarHBondContact O-N 3.45Å
151	V	97	Very high	97.5	Very high	25 Å²	25	60.6 Å²	60.6	15%	0.152	33%	0.325	C	S	.	.	H	α-helix	trans	-65.7	-36.7	177	173.8	0	0	0	0	111.3	S147 D148 S153 L154 R155	S147-V151 WeakPolarHBondContact O-CG2 3.45Å; S147-V151 PolarHBondContact O-N 2.89Å; D148-V151 PolarHBondContact O-N 3.41Å; V151-S153 VanDerWaalsContact C-N 3.33Å; V151-L154 PolarHBondContact O-N 2.95Å; V151-R155 PolarHBondContact O-N 3.48Å
152	Q	97.4	Very high	97.6	Very high	105 Å²	105	54.3 Å²	54.3	49%	0.491	30%	0.295	S	S	.	.	H	α-helix	trans	-60.8	-42.4	171.7	-172.5	-175.1	19.8	0	0	111.5	D148 L149 F150 R155 S156	D148-Q152 WeakPolarHBondContact O-CB 3.39Å; D148-Q152 PolarHBondContact O-N 3.5Å; L149-Q152 PolarHBondContact O-N 3.35Å; F150-Q152 VanDerWaalsContact C-N 3.32Å; F150-Q152 PolarHBondContact O-N 2.94Å; Q152-R155 PolarHBondContact O-N 3.17Å; Q152-S156 WeakPolarHBondContact O-CB 3.45Å; Q152-S156 PolarHBondContact O-N 3.29Å
153	S	97.7	Very high	97.7	Very high	30 Å²	30	58.1 Å²	58.1	21%	0.21	32%	0.32	C	S	.	.	H	α-helix	trans	-61.3	-43.9	175.5	-174.1	0	0	0	0	111.9	R105 L149 F150 V151 R155 S156 L157	R105-S153 PolarHBondContact NH1-OG 2.84Å; L149-S153 WeakPolarHBondContact O-CB 3.38Å; L149-S153 PolarHBondContact O-N 3.49Å; F150-S153 WeakPolarHBondContact O-CB 3.47Å; F150-S153 PolarHBondContact O-N 2.99Å; F150-S153 VanDerWaalsContact O-N 3.16Å; V151-S153 VanDerWaalsContact C-N 3.33Å; S153-R155 PolarHBondContact O-N 3.49Å; S153-S156 WeakPolarHBondContact O-CB 3.12Å; S153-S156 PolarHBondContact O-N 3.43Å; S153-L157 PolarHBondContact O-N 3.29Å
154	L	98.1	Very high	97.7	Very high	7 Å²	7	54 Å²	54	4%	0.037	30%	0.298	C	S	.	.	H	α-helix	trans	-59.3	-47.9	173.7	-68.6	179.2	0	0	0	111.7	L96 V101 A134 F150 V151 S156 L157 M158 A211	L96-L154 HydrophobicContact CB-CD2 3.87Å; L96-L154 HydrophobicContact CD1-CD2 3.95Å; V101-L154 HydrophobicContact CG2-CD2 3.46Å; V101-L154 VanDerWaalsContact CG2-CD2 3.46Å; A134-L154 HydrophobicContact CB-CD1 4.1Å; F150-L154 HydrophobicContact CD1-CD1 4.14Å; F150-L154 HydrophobicContact CD1-CG 4.45Å; F150-L154 HydrophobicContact CE1-CD1 3.66Å; F150-L154 HydrophobicContact CE1-CD2 4.46Å; F150-L154 HydrophobicContact CE1-CG 4.06Å; F150-L154 HydrophobicContact CZ-CD1 4.28Å; F150-L154 HydrophobicContact CZ-CD2 4.27Å; F150-L154 HydrophobicContact CZ-CG 4.3Å; F150-L154 PolarHBondContact O-N 3.45Å; V151-L154 PolarHBondContact O-N 2.95Å; L154-S156 VanDerWaalsContact C-N 3.3Å; L154-S156 PolarHBondContact O-N 2.98Å; L154-L157 WeakPolarHBondContact O-CB 3.31Å; L154-L157 PolarHBondContact O-N 2.65Å; L154-M158 WeakPolarHBondContact O-CG 3.21Å; L154-M158 PolarHBondContact O-N 3.46Å; L154-A211 HydrophobicContact CB-CB 3.92Å
155	R	98.3	Very high	97.7	Very high	102 Å²	102	49.1 Å²	49.1	39%	0.385	28%	0.275	S	S	.	.	H	α-helix	trans	-60.1	-42.1	177.9	-169.7	-177.3	-54.4	116.6	6.2	111.8	V151 Q152 S153 M158 S159 G210	V151-R155 PolarHBondContact O-N 3.48Å; Q152-R155 PolarHBondContact O-N 3.17Å; S153-R155 PolarHBondContact O-N 3.49Å; R155-M158 PolarHBondContact O-N 3.25Å; R155-S159 WeakPolarHBondContact O-CB 3.33Å; R155-S159 PolarHBondContact O-N 3.39Å; R155-S159 PolarHBondContact O-OG 3.45Å; R155-G210 PolarHBondContact NE-O 3.4Å; R155-G210 PolarHBondContact NH2-O 3.15Å
156	S	98	Very high	97.7	Very high	44 Å²	44	45.6 Å²	45.6	31%	0.308	25%	0.25	S	C	.	.	H	α-helix	trans	-60.2	-47.4	176	-174	0	0	0	0	111.2	Q152 S153 L154 M158 S159 Q160	Q152-S156 WeakPolarHBondContact O-CB 3.45Å; Q152-S156 PolarHBondContact O-N 3.29Å; S153-S156 WeakPolarHBondContact O-CB 3.12Å; S153-S156 PolarHBondContact O-N 3.43Å; L154-S156 VanDerWaalsContact C-N 3.3Å; L154-S156 PolarHBondContact O-N 2.98Å; S156-M158 PolarHBondContact O-N 3.03Å; S156-S159 PolarHBondContact O-N 3.07Å; S156-Q160 VanDerWaalsContact O-CG 3.29Å; S156-Q160 WeakPolarHBondContact O-CG 3.16Å; S156-Q160 PolarHBondContact O-N 3.02Å
157	L	98.3	Very high	97.8	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-56.3	-48.9	174.5	167.8	60	0	0	0	112	V101 M104 R105 V108 S153 L154 S159 Q160 A161	V101-L157 HydrophobicContact CG1-CD2 4.2Å; V101-L157 HydrophobicContact CG2-CD2 4.5Å; M104-L157 HydrophobicContact CB-CD1 4.13Å; M104-L157 HydrophobicContact CB-CD2 4.08Å; M104-L157 HydrophobicContact CG-CD1 3.53Å; M104-L157 HydrophobicContact CG-CD2 3.87Å; M104-L157 HydrophobicContact CG-CG 4.28Å; R105-L157 HydrophobicContact CG-CB 3.84Å; R105-L157 HydrophobicContact CG-CD1 3.71Å; R105-L157 HydrophobicContact CG-CG 4.2Å; V108-L157 HydrophobicContact CG2-CD1 4.29Å; S153-L157 PolarHBondContact O-N 3.29Å; L154-L157 WeakPolarHBondContact O-CB 3.31Å; L154-L157 PolarHBondContact O-N 2.65Å; L157-S159 VanDerWaalsContact C-N 3.3Å; L157-S159 PolarHBondContact O-N 3.35Å; L157-Q160 PolarHBondContact O-N 3.06Å; L157-A161 PolarHBondContact O-N 2.84Å
158	M	98.4	Very high	98	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-62.6	-39.2	179.2	-57.3	-43.4	175.4	0	0	111.9	L96 L154 R155 S156 A161 A162 G179 E182 L183 A186 A211	L96-M158 HydrophobicContact CD1-CE 3.81Å; L154-M158 WeakPolarHBondContact O-CG 3.21Å; L154-M158 PolarHBondContact O-N 3.46Å; R155-M158 PolarHBondContact O-N 3.25Å; S156-M158 PolarHBondContact O-N 3.03Å; M158-A161 PolarHBondContact O-N 3.49Å; M158-A162 WeakPolarHBondContact O-CB 3.46Å; M158-A162 PolarHBondContact O-N 3.33Å; M158-G179 WeakPolarHBondContact CE-O 3.48Å; M158-E182 HydrophobicContact CE-CB 4.36Å; M158-L183 HydrophobicContact CE-CB 3.93Å; M158-L183 WeakPolarHBondContact SD-CA 3.33Å; M158-L183 HydrophobicContact SD-CB 3.74Å; M158-L183 HydrophobicContact SD-CD1 3.84Å; M158-L183 HydrophobicContact SD-CG 4.41Å; M158-A186 HydrophobicContact CB-CB 4.12Å; M158-A186 WeakPolarHBondContact O-CB 3.39Å; M158-A211 WeakPolarHBondContact CB-O 3.49Å; M158-A211 HydrophobicContact CE-CB 4.23Å; M158-A211 HydrophobicContact CG-CB 3.69Å; M158-A211 WeakPolarHBondContact CG-O 3.37Å
159	S	98.3	Very high	98.1	Very high	53 Å²	53	35 Å²	35	37%	0.371	19%	0.194	S	C	.	.	H	α-helix	trans	-65.7	-40.9	175.4	-66.1	0	0	0	0	112.1	R155 S156 L157 A162 V163	R155-S159 WeakPolarHBondContact O-CB 3.33Å; R155-S159 PolarHBondContact O-N 3.39Å; R155-S159 PolarHBondContact O-OG 3.45Å; S156-S159 PolarHBondContact O-N 3.07Å; L157-S159 VanDerWaalsContact C-N 3.3Å; L157-S159 PolarHBondContact O-N 3.35Å; S159-A162 PolarHBondContact O-N 3.29Å; S159-V163 WeakPolarHBondContact O-CG2 3.35Å; S159-V163 PolarHBondContact O-N 3.37Å; S159-V163 VanDerWaalsContact O-N 3.15Å
160	Q	98.2	Very high	98.1	Very high	63 Å²	63	30.2 Å²	30.2	29%	0.294	17%	0.169	S	C	.	.	H	α-helix	trans	-61.7	-43.4	175.3	-72.4	177.1	-16.4	0	0	111.7	V108 S156 L157 V163 L164	V108-Q160 HydrophobicContact CG1-CB 3.82Å; S156-Q160 VanDerWaalsContact O-CG 3.29Å; S156-Q160 WeakPolarHBondContact O-CG 3.16Å; S156-Q160 PolarHBondContact O-N 3.02Å; L157-Q160 PolarHBondContact O-N 3.06Å; Q160-V163 PolarHBondContact O-N 2.83Å; Q160-L164 PolarHBondContact O-N 2.85Å
161	A	98.4	Very high	98.2	Very high	0 Å²	0	30 Å²	30	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-63.7	-40.9	176	0	0	0	0	0	112.2	F122 L157 M158 V163 L164 L183 A186	F122-A161 HydrophobicContact CZ-CB 4.45Å; L157-A161 PolarHBondContact O-N 2.84Å; M158-A161 PolarHBondContact O-N 3.49Å; A161-V163 VanDerWaalsContact C-N 3.31Å; A161-V163 PolarHBondContact O-N 2.86Å; A161-L164 WeakPolarHBondContact O-CB 3.24Å; A161-L164 PolarHBondContact O-N 2.88Å; A161-L183 HydrophobicContact CB-CD1 4.46Å; A161-A186 HydrophobicContact CB-CB 4.46Å
162	A	98.4	Very high	98.3	Very high	19 Å²	19	28.8 Å²	28.8	16%	0.157	16%	0.161	C	C	.	.	H	α-helix	trans	-65.8	-30.9	179.9	0	0	0	0	0	113.6	M158 S159 A186	M158-A162 WeakPolarHBondContact O-CB 3.46Å; M158-A162 PolarHBondContact O-N 3.33Å; S159-A162 PolarHBondContact O-N 3.29Å; A162-A186 WeakPolarHBondContact CA-O 3.34Å; A162-A186 HydrophobicContact CB-CB 4.26Å; A162-A186 WeakPolarHBondContact CB-O 3.44Å
163	V	97.8	Very high	98.4	Very high	111 Å²	111	24.7 Å²	24.7	67%	0.673	14%	0.143	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.8	10.4	-179.6	-54.8	0	0	0	0	113.7	S159 Q160 A161	S159-V163 WeakPolarHBondContact O-CG2 3.35Å; S159-V163 PolarHBondContact O-N 3.37Å; S159-V163 VanDerWaalsContact O-N 3.15Å; Q160-V163 PolarHBondContact O-N 2.83Å; A161-V163 VanDerWaalsContact C-N 3.31Å; A161-V163 PolarHBondContact O-N 2.86Å
164	L	98.6	Very high	98.4	Very high	1 Å²	1	23.5 Å²	23.5	1%	0.005	14%	0.135	C	C	.	.			trans	-53.2	132.7	169.9	-83.4	172.5	0	0	0	109.8	V108 L111 F122 Q160 A161 T166 T168 K283	V108-L164 HydrophobicContact CG1-CD1 4.34Å; V108-L164 HydrophobicContact CG1-CD2 4.18Å; V108-L164 HydrophobicContact CG1-CG 4.19Å; L111-L164 HydrophobicContact CB-CD2 3.9Å; F122-L164 HydrophobicContact CE2-CD1 4.5Å; F122-L164 HydrophobicContact CZ-CD1 4.23Å; Q160-L164 PolarHBondContact O-N 2.85Å; A161-L164 WeakPolarHBondContact O-CB 3.24Å; A161-L164 PolarHBondContact O-N 2.88Å; L164-T166 PolarHBondContact O-N 2.98Å; L164-T168 HydrophobicContact CB-CG2 4.07Å; L164-T168 HydrophobicContact CD1-CG2 3.73Å; L164-K283 WeakPolarHBondContact O-CE 3.22Å; L164-K283 PolarHBondContact O-NZ 3.4Å
165	P	97.5	Very high	98.4	Very high	53 Å²	53	25.2 Å²	25.2	34%	0.344	15%	0.145	S	C	.	.	S	Bend	trans	-61.9	-32.4	-177.8	-24.4	34	0	0	0	112.7	R280	P165-R280 HydrophobicContact CB-CG 4.29Å; P165-R280 VanDerWaalsContact O-CG 3.31Å; P165-R280 WeakPolarHBondContact O-CG 3.34Å
166	T	97.9	Very high	98.5	Very high	3 Å²	3	20.3 Å²	20.3	2%	0.018	13%	0.127	C	C	.	.	S	Bend	trans	-83.1	151	-179.1	50.5	0	0	0	0	111.7	V117 L164 K283	V117-T166 HydrophobicContact CB-CG2 4.19Å; V117-T166 HydrophobicContact CG1-CG2 4.05Å; V117-T166 WeakPolarHBondContact O-CG2 3.32Å; L164-T166 PolarHBondContact O-N 2.98Å; T166-K283 PolarHBondContact O-NZ 3.44Å
167	P	98.8	Very high	98.5	Very high	12 Å²	12	18.9 Å²	18.9	8%	0.078	12%	0.116	C	C	.	.			trans	-53.2	136.1	167	-28.7	34.9	0	0	0	112.6	R118 V120 D188 I271 V279	R118-P167 WeakPolarHBondContact O-CD 3.46Å; V120-P167 PolarHBondContact N-O 3.4Å; P167-D188 VanDerWaalsContact CA-OD2 3.27Å; P167-D188 WeakPolarHBondContact CA-OD2 3.38Å; P167-I271 HydrophobicContact CB-CD1 4.3Å; P167-I271 HydrophobicContact CG-CG2 4.16Å; P167-V279 HydrophobicContact CG-CG1 3.32Å
168	T	98.9	Very high	98.5	Very high	0 Å²	0	19 Å²	19	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	137.7	178	56.8	0	0	0	0	111.2	V120 F122 L164 C187 D188 L189	V120-T168 HydrophobicContact CB-CG2 4.21Å; V120-T168 CarbonylContact O-C 3.1Å; V120-T168 VanDerWaalsContact O-CA 3.29Å; V120-T168 WeakPolarHBondContact O-CA 3.41Å; F122-T168 HydrophobicContact CE2-CG2 3.98Å; L164-T168 HydrophobicContact CB-CG2 4.07Å; L164-T168 HydrophobicContact CD1-CG2 3.73Å; T168-C187 WeakPolarHBondContact OG1-CA 3.48Å; T168-D188 PolarHBondContact N-OD2 3.14Å; T168-D188 PolarHBondContact O-N 3.25Å; T168-D188 PolarHBondContact OG1-N 2.94Å; T168-D188 PolarHBondContact OG1-OD2 3.1Å; T168-L189 PolarHBondContact O-N 3.24Å
169	V	98.9	Very high	98.5	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	126.3	177.7	-167	0	0	0	0	109.8	V119 V120 I121 F122 L189 T191 A264 L267	V119-V169 HydrophobicContact CG1-CG2 4.13Å; V120-V169 PolarHBondContact O-N 2.73Å; I121-V169 CarbonylContact C-O 3.58Å; I121-V169 WeakPolarHBondContact CA-O 3.37Å; I121-V169 HydrophobicContact CG1-CB 4.37Å; F122-V169 PolarHBondContact N-O 3.4Å; V169-L189 CarbonylContact C-O 3.42Å; V169-L189 WeakPolarHBondContact CA-O 3.38Å; V169-L189 HydrophobicContact CG1-CB 4.27Å; V169-L189 HydrophobicContact CG2-CB 4.26Å; V169-L189 HydrophobicContact CG2-CD1 4.45Å; V169-T191 HydrophobicContact CG1-CG2 4.26Å; V169-A264 HydrophobicContact CB-CB 4.36Å; V169-A264 HydrophobicContact CG1-CB 3.63Å; V169-L267 HydrophobicContact CG1-CD2 4.33Å
170	A	98.9	Very high	98.5	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	119.4	168.7	0	0	0	0	0	110.4	F130 A184 C187 L189 R190 T191	F130-A170 HydrophobicContact CZ-CB 4.03Å; A170-A184 HydrophobicContact CB-CB 3.74Å; A170-C187 HydrophobicContact CB-CB 4.02Å; A170-L189 PolarHBondContact N-O 2.95Å; A170-R190 HydrophobicContact CB-CG 4.12Å; A170-R190 WeakPolarHBondContact O-CA 3.47Å; A170-T191 PolarHBondContact O-N 2.74Å
171	A	98.9	Very high	98.6	Very high	1 Å²	1	13.9 Å²	13.9	1%	0.008	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	99.3	177.8	0	0	0	0	0	111.1	I121 F122 R123 F130 D173 A264	I121-A171 HydrophobicContact CG2-CB 4.16Å; F122-A171 PolarHBondContact O-N 3.07Å; R123-A171 HydrophobicContact CB-CB 4.13Å; F130-A171 WeakPolarHBondContact CD2-O 3.44Å; F130-A171 WeakPolarHBondContact CE2-O 3.34Å; A171-D173 PolarHBondContact O-N 3Å; A171-A264 HydrophobicContact CB-CB 3.88Å
172	M	98.9	Very high	98.6	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	85.1	-173.2	-63.1	178.9	-69.9	0	0	112	F130 G174 A176 A184 R190 T191 A192 S193 A196 M198 V247	F130-M172 HydrophobicContact CB-CB 4.49Å; F130-M172 HydrophobicContact CB-CG 4.31Å; F130-M172 HydrophobicContact CD1-CG 4.01Å; F130-M172 HydrophobicContact CD2-CB 4.49Å; F130-M172 HydrophobicContact CD2-CG 3.92Å; F130-M172 HydrophobicContact CE1-CG 4.29Å; F130-M172 HydrophobicContact CE2-CG 4.17Å; F130-M172 HydrophobicContact CG-CB 4.44Å; F130-M172 HydrophobicContact CG-CG 3.82Å; F130-M172 HydrophobicContact CZ-CG 4.36Å; M172-G174 PolarHBondContact O-N 2.89Å; M172-A176 HydrophobicContact CG-CB 4.34Å; M172-A176 HydrophobicContact SD-CB 3.79Å; M172-A184 HydrophobicContact CE-CB 4.31Å; M172-A184 HydrophobicContact CG-CB 4.47Å; M172-A184 HydrophobicContact SD-CB 3.57Å; M172-A184 VanDerWaalsContact SD-CB 3.57Å; M172-R190 HydrophobicContact CE-CB 3.92Å; M172-R190 HydrophobicContact CE-CG 4.05Å; M172-T191 PolarHBondContact N-O 3.39Å; M172-A192 HydrophobicContact CB-CB 4.32Å; M172-A192 HydrophobicContact CE-CB 4.34Å; M172-A192 WeakPolarHBondContact O-CA 3.41Å; M172-S193 PolarHBondContact O-N 2.73Å; M172-A196 WeakPolarHBondContact O-CB 3.23Å; M172-M198 HydrophobicContact CE-SD 3.5Å; M172-M198 VanDerWaalsContact CE-SD 3.5Å; M172-M198 HydrophobicContact SD-CG 4.1Å; M172-M198 HydrophobicContact SD-SD 3.81Å; M172-V247 HydrophobicContact CE-CG1 3.56Å
173	D	98.8	Very high	98.6	Very high	19 Å²	19	13.2 Å²	13.2	10%	0.102	8%	0.083	C	C	.	.	S	Bend	trans	-77.8	-6	174.7	-81.5	-63.1	0	0	0	114.4	A171 Q253 G257 D258 A259 A260 Y261	A171-D173 PolarHBondContact O-N 3Å; D173-Q253 PolarHBondContact O-NE2 2.94Å; D173-Q253 PolarHBondContact OD1-NE2 3.33Å; D173-G257 VanDerWaalsContact CB-O 3.29Å; D173-G257 WeakPolarHBondContact CB-O 3.5Å; D173-D258 VanDerWaalsContact CG-CA 3.49Å; D173-D258 WeakPolarHBondContact OD1-CA 3.39Å; D173-D258 WeakPolarHBondContact OD2-CA 3.35Å; D173-A259 PolarHBondContact OD1-N 2.97Å; D173-A260 HydrophobicContact CB-CB 4.42Å; D173-A260 WeakPolarHBondContact OD1-CB 3.28Å; D173-A260 PolarHBondContact OD1-N 2.79Å; D173-Y261 PolarHBondContact OD2-N 3.23Å
174	G	98.5	Very high	98.7	Very high	5 Å²	5	8 Å²	8	5%	0.052	5%	0.051	C	C	.	.	S	Bend	trans	-160.6	-156.1	-172.9	0	0	0	0	0	113.7	G128 M172 A176	G128-G174 VanDerWaalsContact O-CA 3.31Å; G128-G174 WeakPolarHBondContact O-CA 3.23Å; M172-G174 PolarHBondContact O-N 2.89Å; G174-A176 PolarHBondContact O-N 3.12Å
175	V	98.8	Very high	98.7	Very high	42 Å²	42	8.3 Å²	8.3	26%	0.255	5%	0.053	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	123.4	-173.7	178.8	0	0	0	0	112.1	G128 F130 C131 L177 Q197	G128-V175 PolarHBondContact O-N 2.92Å; F130-V175 WeakPolarHBondContact CA-O 3.44Å; F130-V175 WeakPolarHBondContact CB-O 3.4Å; F130-V175 PolarHBondContact N-O 2.96Å; C131-V175 PolarHBondContact N-O 3.1Å; V175-L177 HydrophobicContact CG1-CD1 3.37Å; V175-L177 HydrophobicContact CG1-CD2 4.41Å; V175-L177 HydrophobicContact CG1-CG 3.47Å; V175-L177 VanDerWaalsContact CG1-CG 3.47Å; V175-Q197 CarbonylContact C-O 3.36Å; V175-Q197 WeakPolarHBondContact CA-O 3.35Å; V175-Q197 HydrophobicContact CG2-CB 4.38Å
176	A	98.8	Very high	98.8	Very high	0 Å²	0	6 Å²	6	0%	0	4%	0.038	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	99.2	174	0	0	0	0	0	110	F130 C131 M172 G174 Q197 M198 G199	F130-A176 HydrophobicContact CB-CB 4.01Å; F130-A176 HydrophobicContact CD1-CB 3.8Å; F130-A176 HydrophobicContact CG-CB 4.28Å; C131-A176 WeakPolarHBondContact O-CA 3.38Å; M172-A176 HydrophobicContact CG-CB 4.34Å; M172-A176 HydrophobicContact SD-CB 3.79Å; G174-A176 PolarHBondContact O-N 3.12Å; A176-Q197 PolarHBondContact N-O 3.36Å; A176-M198 HydrophobicContact CB-CG 4.06Å; A176-M198 VanDerWaalsContact O-CA 3.3Å; A176-M198 WeakPolarHBondContact O-CA 3.43Å; A176-G199 PolarHBondContact O-N 2.83Å
177	L	98.8	Very high	98.8	Very high	13 Å²	13	6 Å²	6	7%	0.068	4%	0.038	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	145	-172	-62.7	172.6	0	0	0	112.2	C131 A132 G133 V175 G179 G180 G199 I201 R235	C131-L177 PolarHBondContact O-N 2.9Å; A132-L177 CarbonylContact C-O 3.5Å; G133-L177 WeakPolarHBondContact CA-O 3.49Å; G133-L177 PolarHBondContact N-O 2.78Å; G133-L177 VanDerWaalsContact N-O 3.12Å; V175-L177 HydrophobicContact CG1-CD1 3.37Å; V175-L177 HydrophobicContact CG1-CD2 4.41Å; V175-L177 HydrophobicContact CG1-CG 3.47Å; V175-L177 VanDerWaalsContact CG1-CG 3.47Å; L177-G179 PolarHBondContact O-N 2.98Å; L177-G180 PolarHBondContact O-N 3.12Å; L177-G199 WeakPolarHBondContact CA-O 3.43Å; L177-I201 HydrophobicContact CB-CD1 4.26Å; L177-I201 HydrophobicContact CD1-CD1 4.01Å; L177-I201 HydrophobicContact CD2-CD1 4.43Å; L177-I201 HydrophobicContact CD2-CG2 4.15Å; L177-I201 HydrophobicContact CG-CD1 4.46Å; L177-R235 HydrophobicContact CD2-CG 3.95Å
178	G	98.6	Very high	98.8	Very high	5 Å²	5	7.4 Å²	7.4	5%	0.052	5%	0.045	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.2	-121.3	179.6	0	0	0	0	0	111.8	G180 L181 E182 G199 E202	G178-G180 PolarHBondContact O-N 3.45Å; G178-L181 CarbonylContact O-C 3.59Å; G178-L181 WeakPolarHBondContact O-CA 3.37Å; G178-L181 PolarHBondContact O-N 2.87Å; G178-E182 WeakPolarHBondContact O-CG 3.38Å; G178-E182 PolarHBondContact O-N 3.35Å; G178-G199 PolarHBondContact N-O 3.21Å; G178-E202 WeakPolarHBondContact CA-OE1 3.38Å
179	G	98.5	Very high	98.8	Very high	4 Å²	4	9.3 Å²	9.3	4%	0.041	6%	0.055	C	C	.	.	H	α-helix	trans	-48.2	-30	174.6	0	0	0	0	0	115.7	M158 L177 E182 L183	M158-G179 WeakPolarHBondContact CE-O 3.48Å; L177-G179 PolarHBondContact O-N 2.98Å; G179-E182 WeakPolarHBondContact CA-OE2 3.23Å; G179-E182 PolarHBondContact O-N 3.37Å; G179-L183 PolarHBondContact O-N 2.99Å
180	G	98.8	Very high	98.8	Very high	0 Å²	0	10.1 Å²	10.1	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-70.4	-39.7	174.9	0	0	0	0	0	113.5	F130 C131 L177 G178 A184	F130-G180 WeakPolarHBondContact CE1-O 3.24Å; C131-G180 VanDerWaalsContact CB-CA 3.47Å; C131-G180 WeakPolarHBondContact SG-CA 3.31Å; L177-G180 PolarHBondContact O-N 3.12Å; G178-G180 PolarHBondContact O-N 3.45Å; G180-A184 PolarHBondContact O-N 3.45Å
181	L	98.9	Very high	98.8	Very high	3 Å²	3	10.1 Å²	10.1	2%	0.016	6%	0.058	C	C	.	.	H	α-helix	trans	-71.6	-34.6	169.8	-178.5	58.6	0	0	0	110.7	G178 L183 A184 L185 M198 L200 L246	G178-L181 CarbonylContact O-C 3.59Å; G178-L181 WeakPolarHBondContact O-CA 3.37Å; G178-L181 PolarHBondContact O-N 2.87Å; L181-L183 VanDerWaalsContact C-N 3.29Å; L181-L183 PolarHBondContact O-N 2.86Å; L181-A184 HydrophobicContact CD1-CB 4.39Å; L181-A184 PolarHBondContact O-N 3.25Å; L181-A184 VanDerWaalsContact O-N 3.15Å; L181-L185 HydrophobicContact CD1-CG 4.34Å; L181-L185 HydrophobicContact CG-CD1 4.17Å; L181-L185 HydrophobicContact CG-CG 4.25Å; L181-L185 WeakPolarHBondContact O-CB 3.35Å; L181-L185 VanDerWaalsContact O-CG 3.23Å; L181-L185 WeakPolarHBondContact O-CG 3.49Å; L181-L185 PolarHBondContact O-N 3.06Å; L181-M198 HydrophobicContact CD1-CB 4.32Å; L181-M198 HydrophobicContact CD1-CG 4.32Å; L181-M198 HydrophobicContact CD2-CB 4.4Å; L181-L200 HydrophobicContact CB-CD2 4.1Å; L181-L200 HydrophobicContact CD2-CD2 4.06Å; L181-L200 HydrophobicContact CD2-CG 4.03Å; L181-L200 HydrophobicContact CG-CD2 4.26Å; L181-L246 HydrophobicContact CD1-CD1 4.43Å
182	E	98.9	Very high	98.8	Very high	5 Å²	5	10.1 Å²	10.1	2%	0.023	6%	0.058	C	C	.	.	H	α-helix	trans	-62.8	-34.2	174.9	-63.1	-177.6	114.1	0	0	112.5	M158 G178 G179 L185 A186 L200 P209 G210 A211 G212 G213	M158-E182 HydrophobicContact CE-CB 4.36Å; G178-E182 WeakPolarHBondContact O-CG 3.38Å; G178-E182 PolarHBondContact O-N 3.35Å; G179-E182 WeakPolarHBondContact CA-OE2 3.23Å; G179-E182 PolarHBondContact O-N 3.37Å; E182-L185 PolarHBondContact O-N 2.72Å; E182-A186 PolarHBondContact O-N 2.98Å; E182-L200 HydrophobicContact CG-CD2 3.82Å; E182-P209 VanDerWaalsContact OE1-C 3.28Å; E182-G210 PolarHBondContact OE1-N 3.06Å; E182-A211 HydrophobicContact CB-CB 4.28Å; E182-A211 VanDerWaalsContact OE1-C 3.31Å; E182-A211 WeakPolarHBondContact OE1-CA 3.43Å; E182-A211 PolarHBondContact OE1-N 2.77Å; E182-A211 VanDerWaalsContact OE2-CB 3.23Å; E182-A211 WeakPolarHBondContact OE2-CB 3.47Å; E182-A211 PolarHBondContact OE2-N 2.89Å; E182-G212 PolarHBondContact OE1-N 2.71Å; E182-G213 WeakPolarHBondContact OE1-CA 3.23Å; E182-G213 PolarHBondContact OE1-N 3.22Å
183	L	98.9	Very high	98.8	Very high	1 Å²	1	10.1 Å²	10.1	1%	0.005	6%	0.058	C	C	.	.	H	α-helix	trans	-65.4	-45.1	170.1	179.4	61.4	0	0	0	111.8	M87 M104 M158 A161 G179 L181 L185 A186 C187	M87-L183 HydrophobicContact SD-CD2 3.97Å; M104-L183 HydrophobicContact CE-CD2 4.37Å; M158-L183 HydrophobicContact CE-CB 3.93Å; M158-L183 WeakPolarHBondContact SD-CA 3.33Å; M158-L183 HydrophobicContact SD-CB 3.74Å; M158-L183 HydrophobicContact SD-CD1 3.84Å; M158-L183 HydrophobicContact SD-CG 4.41Å; A161-L183 HydrophobicContact CB-CD1 4.46Å; G179-L183 PolarHBondContact O-N 2.99Å; L181-L183 VanDerWaalsContact C-N 3.29Å; L181-L183 PolarHBondContact O-N 2.86Å; L183-L185 VanDerWaalsContact C-N 3.32Å; L183-L185 PolarHBondContact O-N 3.2Å; L183-A186 WeakPolarHBondContact O-CB 3.19Å; L183-A186 PolarHBondContact O-N 2.93Å; L183-A186 VanDerWaalsContact O-N 3.12Å; L183-C187 PolarHBondContact O-N 3.3Å; L183-C187 PolarHBondContact O-SG 3.04Å
184	A	98.9	Very high	98.8	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-64.8	-36	176.5	0	0	0	0	0	112.6	F130 A170 M172 G180 L181 A186 C187 R190	F130-A184 HydrophobicContact CE1-CB 4.11Å; A170-A184 HydrophobicContact CB-CB 3.74Å; M172-A184 HydrophobicContact CE-CB 4.31Å; M172-A184 HydrophobicContact CG-CB 4.47Å; M172-A184 HydrophobicContact SD-CB 3.57Å; M172-A184 VanDerWaalsContact SD-CB 3.57Å; G180-A184 PolarHBondContact O-N 3.45Å; L181-A184 HydrophobicContact CD1-CB 4.39Å; L181-A184 PolarHBondContact O-N 3.25Å; L181-A184 VanDerWaalsContact O-N 3.15Å; A184-A186 VanDerWaalsContact C-N 3.26Å; A184-A186 PolarHBondContact O-N 3.25Å; A184-C187 WeakPolarHBondContact O-CB 3.34Å; A184-C187 PolarHBondContact O-N 2.94Å; A184-R190 HydrophobicContact CB-CG 4.31Å; A184-R190 WeakPolarHBondContact O-CD 3.37Å; A184-R190 WeakPolarHBondContact O-CG 3.47Å; A184-R190 PolarHBondContact O-NH1 2.94Å
185	L	98.9	Very high	98.7	Very high	8 Å²	8	14.2 Å²	14.2	4%	0.042	9%	0.086	C	C	.	.	H	α-helix	trans	-68.8	-24.1	173.5	-71.8	172.4	0	0	0	112.7	L181 E182 L183 C187 R216 L217 M220 L246	L181-L185 HydrophobicContact CD1-CG 4.34Å; L181-L185 HydrophobicContact CG-CD1 4.17Å; L181-L185 HydrophobicContact CG-CG 4.25Å; L181-L185 WeakPolarHBondContact O-CB 3.35Å; L181-L185 VanDerWaalsContact O-CG 3.23Å; L181-L185 WeakPolarHBondContact O-CG 3.49Å; L181-L185 PolarHBondContact O-N 3.06Å; E182-L185 PolarHBondContact O-N 2.72Å; L183-L185 VanDerWaalsContact C-N 3.32Å; L183-L185 PolarHBondContact O-N 3.2Å; L185-C187 VanDerWaalsContact C-N 3.33Å; L185-R216 HydrophobicContact CB-CB 4Å; L185-R216 HydrophobicContact CD1-CB 4.44Å; L185-R216 WeakPolarHBondContact O-CD 3.49Å; L185-L217 HydrophobicContact CD1-CB 4.11Å; L185-L217 HydrophobicContact CD2-CD1 4.44Å; L185-M220 HydrophobicContact CD2-CE 3.42Å; L185-M220 VanDerWaalsContact CD2-CE 3.42Å; L185-M220 HydrophobicContact CD2-SD 3.64Å; L185-L246 HydrophobicContact CD2-CD1 3.75Å
186	A	98.8	Very high	98.7	Very high	4 Å²	4	12.3 Å²	12.3	3%	0.033	8%	0.075	C	C	.	.	H	α-helix	trans	-78.6	-18	172.8	0	0	0	0	0	112.8	M158 A161 A162 E182 L183 A184	M158-A186 HydrophobicContact CB-CB 4.12Å; M158-A186 WeakPolarHBondContact O-CB 3.39Å; A161-A186 HydrophobicContact CB-CB 4.46Å; A162-A186 WeakPolarHBondContact CA-O 3.34Å; A162-A186 HydrophobicContact CB-CB 4.26Å; A162-A186 WeakPolarHBondContact CB-O 3.44Å; E182-A186 PolarHBondContact O-N 2.98Å; L183-A186 WeakPolarHBondContact O-CB 3.19Å; L183-A186 PolarHBondContact O-N 2.93Å; L183-A186 VanDerWaalsContact O-N 3.12Å; A184-A186 VanDerWaalsContact C-N 3.26Å; A184-A186 PolarHBondContact O-N 3.25Å
187	C	98.9	Very high	98.7	Very high	5 Å²	5	15.6 Å²	15.6	3%	0.034	9%	0.09	C	C	.	.	S	Bend	trans	-75.3	155.2	172.4	-62.3	0	0	0	0	111.1	F122 T168 A170 L183 A184 L185 R190	F122-C187 VanDerWaalsContact CD2-SG 3.52Å; T168-C187 WeakPolarHBondContact OG1-CA 3.48Å; A170-C187 HydrophobicContact CB-CB 4.02Å; L183-C187 PolarHBondContact O-N 3.3Å; L183-C187 PolarHBondContact O-SG 3.04Å; A184-C187 WeakPolarHBondContact O-CB 3.34Å; A184-C187 PolarHBondContact O-N 2.94Å; L185-C187 VanDerWaalsContact C-N 3.33Å; C187-R190 PolarHBondContact O-NH1 3.11Å
188	D	98.9	Very high	98.7	Very high	40 Å²	40	15 Å²	15	21%	0.214	9%	0.087	C	C	.	.	S	Bend	trans	-68.1	-46.6	177.6	-54.7	-53.3	0	0	0	110	P167 T168 R190 K283	P167-D188 VanDerWaalsContact CA-OD2 3.27Å; P167-D188 WeakPolarHBondContact CA-OD2 3.38Å; T168-D188 PolarHBondContact N-OD2 3.14Å; T168-D188 PolarHBondContact O-N 3.25Å; T168-D188 PolarHBondContact OG1-N 2.94Å; T168-D188 PolarHBondContact OG1-OD2 3.1Å; D188-R190 PolarHBondContact O-NH1 3.26Å; D188-R190 PolarHBondContact O-NH2 3.28Å; D188-K283 VanDerWaalsContact CG-NZ 3.32Å; D188-K283 WeakPolarHBondContact OD1-CE 3.41Å; D188-K283 IonicContact OD1-NZ 3.93Å; D188-K283 PolarHBondContact OD1-NZ 3.24Å; D188-K283 VanDerWaalsContact OD1-NZ 3.15Å; D188-K283 WeakPolarHBondContact OD2-CE 3.29Å; D188-K283 IonicContact OD2-NZ 3.17Å; D188-K283 PolarHBondContact OD2-NZ 3.07Å
189	L	98.9	Very high	98.7	Very high	41 Å²	41	15 Å²	15	22%	0.215	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	152.4	-174.4	-53.4	173.2	0	0	0	111.1	T168 V169 A170 N248 L267 I271	T168-L189 PolarHBondContact O-N 3.24Å; V169-L189 CarbonylContact C-O 3.42Å; V169-L189 WeakPolarHBondContact CA-O 3.38Å; V169-L189 HydrophobicContact CG1-CB 4.27Å; V169-L189 HydrophobicContact CG2-CB 4.26Å; V169-L189 HydrophobicContact CG2-CD1 4.45Å; A170-L189 PolarHBondContact N-O 2.95Å; L189-N248 WeakPolarHBondContact CA-OD1 3.49Å; L189-L267 HydrophobicContact CB-CD2 4.01Å; L189-L267 HydrophobicContact CD1-CD1 4.46Å; L189-L267 HydrophobicContact CD1-CD2 3.69Å; L189-L267 HydrophobicContact CD1-CG 4.09Å; L189-L267 HydrophobicContact CG-CD2 4.4Å; L189-I271 HydrophobicContact CD1-CD1 4.02Å
190	R	98.9	Very high	98.7	Very high	17 Å²	17	15 Å²	15	6%	0.064	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	130.3	179.6	-74.8	155.4	-65.1	-65.3	-11.4	110.5	A170 M172 A184 C187 D188 M220 L246 V247 N248 R249	A170-R190 HydrophobicContact CB-CG 4.12Å; A170-R190 WeakPolarHBondContact O-CA 3.47Å; M172-R190 HydrophobicContact CE-CB 3.92Å; M172-R190 HydrophobicContact CE-CG 4.05Å; A184-R190 HydrophobicContact CB-CG 4.31Å; A184-R190 WeakPolarHBondContact O-CD 3.37Å; A184-R190 WeakPolarHBondContact O-CG 3.47Å; A184-R190 PolarHBondContact O-NH1 2.94Å; C187-R190 PolarHBondContact O-NH1 3.11Å; D188-R190 PolarHBondContact O-NH1 3.26Å; D188-R190 PolarHBondContact O-NH2 3.28Å; R190-M220 VanDerWaalsContact CZ-SD 3.59Å; R190-M220 PolarHBondContact NE-SD 2.86Å; R190-M220 VanDerWaalsContact NE-SD 3.39Å; R190-L246 VanDerWaalsContact CD-O 3.24Å; R190-L246 WeakPolarHBondContact CD-O 3.37Å; R190-L246 PolarHBondContact NE-O 3.4Å; R190-V247 HydrophobicContact CB-CB 4.08Å; R190-V247 HydrophobicContact CB-CG1 3.96Å; R190-N248 PolarHBondContact N-OD1 3.36Å; R190-N248 WeakPolarHBondContact O-CB 3.41Å; R190-N248 PolarHBondContact O-N 2.92Å; R190-R249 PolarHBondContact O-N 2.88Å
191	T	98.9	Very high	98.7	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	147.5	166.1	64	0	0	0	0	109.1	V169 A170 M172 R249 A260 E263 A264 L267	V169-T191 HydrophobicContact CG1-CG2 4.26Å; A170-T191 PolarHBondContact O-N 2.74Å; M172-T191 PolarHBondContact N-O 3.39Å; T191-R249 WeakPolarHBondContact CA-O 3.22Å; T191-R249 HydrophobicContact CG2-CB 4.3Å; T191-A260 PolarHBondContact OG1-O 2.8Å; T191-E263 HydrophobicContact CG2-CB 4.24Å; T191-E263 HydrophobicContact CG2-CG 3.98Å; T191-A264 HydrophobicContact CG2-CB 4.21Å; T191-L267 HydrophobicContact CG2-CD2 4.34Å
192	A	98.9	Very high	98.6	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	149.7	179.1	0	0	0	0	0	112.3	M172 A196 M198 V247 R249 A250 V251	M172-A192 HydrophobicContact CB-CB 4.32Å; M172-A192 HydrophobicContact CE-CB 4.34Å; M172-A192 WeakPolarHBondContact O-CA 3.41Å; A192-A196 HydrophobicContact CB-CB 4.43Å; A192-M198 HydrophobicContact CB-CE 4.04Å; A192-V247 HydrophobicContact CB-CG1 4.08Å; A192-V247 HydrophobicContact CB-CG2 4.36Å; A192-R249 PolarHBondContact N-O 2.88Å; A192-A250 CarbonylContact O-C 3.51Å; A192-A250 VanDerWaalsContact O-CA 3.23Å; A192-A250 WeakPolarHBondContact O-CA 3.37Å; A192-V251 PolarHBondContact O-N 3.24Å
193	S	98.7	Very high	98.6	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	142.2	159.6	156.7	0	0	0	0	108.9	M172 S195 A196 G238 V251 Q253	M172-S193 PolarHBondContact O-N 2.73Å; S193-S195 PolarHBondContact O-N 2.95Å; S193-S195 VanDerWaalsContact O-N 3.12Å; S193-S195 PolarHBondContact OG-N 2.82Å; S193-S195 VanDerWaalsContact OG-N 3.1Å; S193-S195 PolarHBondContact OG-OG 3.41Å; S193-A196 WeakPolarHBondContact O-CB 3.38Å; S193-A196 PolarHBondContact O-N 2.85Å; S193-G238 WeakPolarHBondContact O-CA 3.4Å; S193-V251 CarbonylContact C-O 3.54Å; S193-V251 WeakPolarHBondContact CA-O 3.33Å; S193-Q253 WeakPolarHBondContact OG-CB 3.32Å
194	T	98.4	Very high	98.5	Very high	40 Å²	40	22.8 Å²	22.8	25%	0.245	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-28.1	174.4	54.2	0	0	0	0	112.5	G238 Q239 A250 V251	T194-G238 PolarHBondContact O-N 3.34Å; T194-Q239 HydrophobicContact CG2-CB 4.36Å; T194-A250 HydrophobicContact CG2-CB 4.24Å; T194-V251 PolarHBondContact N-O 3.33Å
195	S	96.5	Very high	98.2	Very high	71 Å²	71	28.4 Å²	28.4	50%	0.497	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89	-9.7	177.2	66.3	0	0	0	0	114.5	S193 Q197	S193-S195 PolarHBondContact O-N 2.95Å; S193-S195 VanDerWaalsContact O-N 3.12Å; S193-S195 PolarHBondContact OG-N 2.82Å; S193-S195 VanDerWaalsContact OG-N 3.1Å; S193-S195 PolarHBondContact OG-OG 3.41Å; S195-Q197 PolarHBondContact O-NE2 3.09Å
196	A	98.4	Very high	98	Very high	2 Å²	2	31.6 Å²	31.6	2%	0.017	19%	0.188	C	C	.	.			trans	-57.7	146.6	176.2	0	0	0	0	0	110.9	M172 A192 S193 G237 G238	M172-A196 WeakPolarHBondContact O-CB 3.23Å; A192-A196 HydrophobicContact CB-CB 4.43Å; S193-A196 WeakPolarHBondContact O-CB 3.38Å; S193-A196 PolarHBondContact O-N 2.85Å; A196-G237 CarbonylContact O-C 3.58Å; A196-G237 VanDerWaalsContact O-CA 3.23Å; A196-G237 WeakPolarHBondContact O-CA 3.45Å; A196-G238 PolarHBondContact O-N 3Å; A196-G238 VanDerWaalsContact O-N 3.07Å
197	Q	98.8	Very high	97.9	Very high	69 Å²	69	34.5 Å²	34.5	32%	0.322	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	121.7	-177.9	-66.3	-64.7	-61.5	0	0	110	V175 A176 S195	V175-Q197 CarbonylContact C-O 3.36Å; V175-Q197 WeakPolarHBondContact CA-O 3.35Å; V175-Q197 HydrophobicContact CG2-CB 4.38Å; A176-Q197 PolarHBondContact N-O 3.36Å; S195-Q197 PolarHBondContact O-NE2 3.09Å
198	M	98.8	Very high	97.7	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	142	-175.7	-71.9	164.6	-81.3	0	0	111.3	M172 A176 L181 A192 R235 V236 A241 L246 V247	M172-M198 HydrophobicContact CE-SD 3.5Å; M172-M198 VanDerWaalsContact CE-SD 3.5Å; M172-M198 HydrophobicContact SD-CG 4.1Å; M172-M198 HydrophobicContact SD-SD 3.81Å; A176-M198 HydrophobicContact CB-CG 4.06Å; A176-M198 VanDerWaalsContact O-CA 3.3Å; A176-M198 WeakPolarHBondContact O-CA 3.43Å; L181-M198 HydrophobicContact CD1-CB 4.32Å; L181-M198 HydrophobicContact CD1-CG 4.32Å; L181-M198 HydrophobicContact CD2-CB 4.4Å; A192-M198 HydrophobicContact CB-CE 4.04Å; M198-R235 CarbonylContact O-C 3.54Å; M198-R235 WeakPolarHBondContact O-CA 3.11Å; M198-V236 HydrophobicContact CB-CG2 4.25Å; M198-V236 PolarHBondContact N-O 3.25Å; M198-V236 PolarHBondContact O-N 3.2Å; M198-A241 HydrophobicContact CE-CB 3.3Å; M198-A241 HydrophobicContact SD-CB 4.09Å; M198-L246 HydrophobicContact CB-CD2 4.31Å; M198-L246 HydrophobicContact SD-CD2 4.25Å; M198-V247 HydrophobicContact CE-CG1 4.31Å; M198-V247 HydrophobicContact SD-CG1 3.87Å
199	G	98.6	Very high	97.6	Very high	6 Å²	6	38 Å²	38	6%	0.062	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	176.8	149.5	171.3	0	0	0	0	0	115.1	A176 L177 G178	A176-G199 PolarHBondContact O-N 2.83Å; L177-G199 WeakPolarHBondContact CA-O 3.43Å; G178-G199 PolarHBondContact N-O 3.21Å
200	L	98.8	Very high	97.6	Very high	2 Å²	2	37 Å²	37	1%	0.01	22%	0.221	C	C	.	.			trans	-92.8	100.7	167.4	-62.5	-176	0	0	0	108.1	L181 E182 E202 P209 L217 I230	L181-L200 HydrophobicContact CB-CD2 4.1Å; L181-L200 HydrophobicContact CD2-CD2 4.06Å; L181-L200 HydrophobicContact CD2-CG 4.03Å; L181-L200 HydrophobicContact CG-CD2 4.26Å; E182-L200 HydrophobicContact CG-CD2 3.82Å; L200-E202 WeakPolarHBondContact CA-OE2 3.26Å; L200-E202 WeakPolarHBondContact CB-OE2 2.86Å; L200-P209 HydrophobicContact CB-CG 3.86Å; L200-P209 HydrophobicContact CD1-CB 3.9Å; L200-P209 HydrophobicContact CD1-CG 3.85Å; L200-P209 HydrophobicContact CD2-CB 4.37Å; L200-P209 HydrophobicContact CG-CB 4.49Å; L200-P209 HydrophobicContact CG-CG 4.3Å; L200-L217 HydrophobicContact CD1-CB 4.21Å; L200-L217 HydrophobicContact CD1-CD2 3.74Å; L200-L217 HydrophobicContact CG-CD2 4.39Å; L200-I230 HydrophobicContact CB-CG1 4.17Å; L200-I230 HydrophobicContact CD1-CD1 4.13Å; L200-I230 HydrophobicContact CD1-CG1 4Å
201	I	98	Very high	97.5	Very high	14 Å²	14	36.3 Å²	36.3	7%	0.072	22%	0.218	C	C	.	.			trans	-107	10.6	-167.8	67.2	175.2	0	0	0	113.3	L177 T203 T204 G233 R235	L177-I201 HydrophobicContact CB-CD1 4.26Å; L177-I201 HydrophobicContact CD1-CD1 4.01Å; L177-I201 HydrophobicContact CD2-CD1 4.43Å; L177-I201 HydrophobicContact CD2-CG2 4.15Å; L177-I201 HydrophobicContact CG-CD1 4.46Å; I201-T203 VanDerWaalsContact C-N 3.3Å; I201-T203 PolarHBondContact O-N 3.44Å; I201-T204 WeakPolarHBondContact O-CB 3.28Å; I201-T204 PolarHBondContact O-N 3.44Å; I201-T204 PolarHBondContact O-OG1 2.92Å; I201-G233 WeakPolarHBondContact CG2-O 3.29Å; I201-R235 HydrophobicContact CG2-CG 4.21Å
202	E	98.4	Very high	97.5	Very high	22 Å²	22	36.9 Å²	36.9	10%	0.103	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-59.5	-38.1	-170.7	-74	85.3	166.4	0	0	112.6	G178 L200 T204 R205 G206 L207 P209	G178-E202 WeakPolarHBondContact CA-OE1 3.38Å; L200-E202 WeakPolarHBondContact CA-OE2 3.26Å; L200-E202 WeakPolarHBondContact CB-OE2 2.86Å; E202-T204 PolarHBondContact O-N 3.02Å; E202-R205 CarbonylContact O-C 3.46Å; E202-R205 WeakPolarHBondContact O-CA 3.47Å; E202-R205 PolarHBondContact O-N 3Å; E202-G206 PolarHBondContact O-N 3.37Å; E202-L207 CarbonylContact C-O 3.51Å; E202-L207 HydrophobicContact CB-CB 3.83Å; E202-L207 WeakPolarHBondContact CB-O 3.45Å; E202-L207 HydrophobicContact CG-CB 4.37Å; E202-L207 WeakPolarHBondContact O-CB 3.3Å; E202-L207 PolarHBondContact O-N 3.07Å; E202-P209 HydrophobicContact CB-CG 4.35Å; E202-P209 HydrophobicContact CG-CG 4.39Å
203	T	97.9	Very high	97.5	Very high	51 Å²	51	36.9 Å²	36.9	31%	0.313	22%	0.224	S	C	.	.	G	3₁₀ helix	trans	-61.3	-31.7	-179.6	52.2	0	0	0	0	112.6	I201 R205 G206 L207 I230	I201-T203 VanDerWaalsContact C-N 3.3Å; I201-T203 PolarHBondContact O-N 3.44Å; T203-R205 PolarHBondContact O-N 2.95Å; T203-R205 VanDerWaalsContact O-N 3.07Å; T203-G206 PolarHBondContact O-N 3.11Å; T203-G206 VanDerWaalsContact O-N 3.13Å; T203-L207 WeakPolarHBondContact CA-O 3.33Å; T203-L207 PolarHBondContact N-O 3.37Å; T203-L207 VanDerWaalsContact N-O 3.14Å; T203-I230 WeakPolarHBondContact CB-O 3.3Å; T203-I230 HydrophobicContact CG2-CG2 4.02Å; T203-I230 WeakPolarHBondContact CG2-O 3.35Å; T203-I230 PolarHBondContact OG1-O 3.38Å
204	T	96.3	Very high	97.5	Very high	86 Å²	86	38.6 Å²	38.6	53%	0.528	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	-65.5	-9.8	174.2	71.4	0	0	0	0	113.5	I201 E202	I201-T204 WeakPolarHBondContact O-CB 3.28Å; I201-T204 PolarHBondContact O-N 3.44Å; I201-T204 PolarHBondContact O-OG1 2.92Å; E202-T204 PolarHBondContact O-N 3.02Å
205	R	94.1	Very high	97.5	Very high	118 Å²	118	41.8 Å²	41.8	45%	0.445	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-121.5	14.9	178.8	-66.9	171.6	-179.6	69.3	4.8	112.6	E202 T203 L207	E202-R205 CarbonylContact O-C 3.46Å; E202-R205 WeakPolarHBondContact O-CA 3.47Å; E202-R205 PolarHBondContact O-N 3Å; T203-R205 PolarHBondContact O-N 2.95Å; T203-R205 VanDerWaalsContact O-N 3.07Å; R205-L207 VanDerWaalsContact C-N 3.28Å; R205-L207 HydrophobicContact CB-CD1 4.28Å; R205-L207 HydrophobicContact CB-CG 4.48Å; R205-L207 PolarHBondContact O-N 3.3Å
206	G	94.3	Very high	97.6	Very high	75 Å²	75	40.7 Å²	40.7	77%	0.773	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	69.1	24.6	-177	0	0	0	0	0	114	E202 T203	E202-G206 PolarHBondContact O-N 3.37Å; T203-G206 PolarHBondContact O-N 3.11Å; T203-G206 VanDerWaalsContact O-N 3.13Å
207	L	95.4	Very high	97.6	Very high	65 Å²	65	40.7 Å²	40.7	34%	0.34	23%	0.233	S	C	.	.			trans	-118.1	168	-178.6	-61.9	170.5	0	0	0	111.1	E202 T203 R205	E202-L207 CarbonylContact C-O 3.51Å; E202-L207 HydrophobicContact CB-CB 3.83Å; E202-L207 WeakPolarHBondContact CB-O 3.45Å; E202-L207 HydrophobicContact CG-CB 4.37Å; E202-L207 WeakPolarHBondContact O-CB 3.3Å; E202-L207 PolarHBondContact O-N 3.07Å; T203-L207 WeakPolarHBondContact CA-O 3.33Å; T203-L207 PolarHBondContact N-O 3.37Å; T203-L207 VanDerWaalsContact N-O 3.14Å; R205-L207 VanDerWaalsContact C-N 3.28Å; R205-L207 HydrophobicContact CB-CD1 4.28Å; R205-L207 HydrophobicContact CB-CG 4.48Å; R205-L207 PolarHBondContact O-N 3.3Å
208	L	95.3	Very high	97.6	Very high	118 Å²	118	38.7 Å²	38.7	62%	0.618	23%	0.225	S	C	*	.			trans	-113.3	147.6	170.3	-179.3	75.3	0	0	0	109.5	G210	L208-G210 PolarHBondContact O-N 3.02Å
209	P	98.3	Very high	97.6	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.006	25%	0.251	C	S	.	.			trans	-57.2	106.7	167	-22.1	34.2	0	0	0	110.7	E182 L200 E202 I230	E182-P209 VanDerWaalsContact OE1-C 3.28Å; L200-P209 HydrophobicContact CB-CG 3.86Å; L200-P209 HydrophobicContact CD1-CB 3.9Å; L200-P209 HydrophobicContact CD1-CG 3.85Å; L200-P209 HydrophobicContact CD2-CB 4.37Å; L200-P209 HydrophobicContact CG-CB 4.49Å; L200-P209 HydrophobicContact CG-CG 4.3Å; E202-P209 HydrophobicContact CB-CG 4.35Å; E202-P209 HydrophobicContact CG-CG 4.39Å; P209-I230 HydrophobicContact CG-CD1 4.45Å; P209-I230 HydrophobicContact CG-CG1 4.34Å; P209-I230 HydrophobicContact CG-CG2 4.23Å
210	G	97.5	Very high	97.5	Very high	21 Å²	21	47.7 Å²	47.7	22%	0.216	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100	-17.4	-162.3	0	0	0	0	0	115	R155 E182 L208	R155-G210 PolarHBondContact NE-O 3.4Å; R155-G210 PolarHBondContact NH2-O 3.15Å; E182-G210 PolarHBondContact OE1-N 3.06Å; L208-G210 PolarHBondContact O-N 3.02Å
211	A	98.1	Very high	97.5	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.008	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	19.4	-177.7	0	0	0	0	0	113.2	L154 M158 E182 R216	L154-A211 HydrophobicContact CB-CB 3.92Å; M158-A211 WeakPolarHBondContact CB-O 3.49Å; M158-A211 HydrophobicContact CE-CB 4.23Å; M158-A211 HydrophobicContact CG-CB 3.69Å; M158-A211 WeakPolarHBondContact CG-O 3.37Å; E182-A211 HydrophobicContact CB-CB 4.28Å; E182-A211 VanDerWaalsContact OE1-C 3.31Å; E182-A211 WeakPolarHBondContact OE1-CA 3.43Å; E182-A211 PolarHBondContact OE1-N 2.77Å; E182-A211 VanDerWaalsContact OE2-CB 3.23Å; E182-A211 WeakPolarHBondContact OE2-CB 3.47Å; E182-A211 PolarHBondContact OE2-N 2.89Å; A211-R216 PolarHBondContact O-NH1 3.2Å
212	G	98.1	Very high	97.5	Very high	12 Å²	12	49.6 Å²	49.6	12%	0.124	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	110.8	2.8	171.7	0	0	0	0	0	114.9	E182 S214 Q215 R216	E182-G212 PolarHBondContact OE1-N 2.71Å; G212-S214 VanDerWaalsContact C-N 3.28Å; G212-S214 PolarHBondContact O-N 2.72Å; G212-Q215 PolarHBondContact O-N 3.23Å; G212-R216 PolarHBondContact O-N 2.89Å
213	G	98.6	Very high	97.5	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-58.8	-37.8	177.3	0	0	0	0	0	112.9	E182 Q215 L217	E182-G213 WeakPolarHBondContact OE1-CA 3.23Å; E182-G213 PolarHBondContact OE1-N 3.22Å; G213-Q215 PolarHBondContact O-N 2.84Å; G213-Q215 VanDerWaalsContact O-N 3.12Å; G213-L217 WeakPolarHBondContact O-CB 3.32Å; G213-L217 PolarHBondContact O-N 3.28Å; G213-L217 VanDerWaalsContact O-N 3.11Å
214	S	98.5	Very high	97.5	Very high	36 Å²	36	55.8 Å²	55.8	25%	0.252	32%	0.319	S	S	.	.	H	α-helix	trans	-64.4	-13	174.1	61.3	0	0	0	0	114.2	G212 P218	G212-S214 VanDerWaalsContact C-N 3.28Å; G212-S214 PolarHBondContact O-N 2.72Å; S214-P218 VanDerWaalsContact O-CG 3.3Å; S214-P218 WeakPolarHBondContact O-CG 3.02Å
215	Q	98.8	Very high	97.6	Very high	107 Å²	107	53.3 Å²	53.3	50%	0.5	30%	0.302	S	S	.	.	H	α-helix	trans	-110.4	-43.5	-179.5	-56.6	-52.9	-48.2	0	0	112.6	G212 G213 P218 R219	G212-Q215 PolarHBondContact O-N 3.23Å; G213-Q215 PolarHBondContact O-N 2.84Å; G213-Q215 VanDerWaalsContact O-N 3.12Å; Q215-P218 WeakPolarHBondContact O-CG 3.33Å; Q215-R219 WeakPolarHBondContact O-CD 3.24Å; Q215-R219 WeakPolarHBondContact O-CG 3.31Å; Q215-R219 PolarHBondContact O-NH1 2.92Å
216	R	98.7	Very high	97.9	Very high	49 Å²	49	47.8 Å²	47.8	19%	0.185	28%	0.282	C	S	.	.	H	α-helix	trans	-79.6	-38.6	-176.5	-62.8	-169.6	-174.6	91.8	2	112.7	L185 A211 G212 R219 M220	L185-R216 HydrophobicContact CB-CB 4Å; L185-R216 HydrophobicContact CD1-CB 4.44Å; L185-R216 WeakPolarHBondContact O-CD 3.49Å; A211-R216 PolarHBondContact O-NH1 3.2Å; G212-R216 PolarHBondContact O-N 2.89Å; R216-R219 PolarHBondContact O-N 2.81Å; R216-M220 PolarHBondContact O-N 3.18Å
217	L	98.8	Very high	98.1	Very high	2 Å²	2	49.4 Å²	49.4	1%	0.01	27%	0.268	C	S	.	.	H	α-helix	trans	-59.9	-50.8	177.4	-174.5	63.5	0	0	0	112.7	L185 L200 G213 R219 M220 V221 A226 L229 I230 L246	L185-L217 HydrophobicContact CD1-CB 4.11Å; L185-L217 HydrophobicContact CD2-CD1 4.44Å; L200-L217 HydrophobicContact CD1-CB 4.21Å; L200-L217 HydrophobicContact CD1-CD2 3.74Å; L200-L217 HydrophobicContact CG-CD2 4.39Å; G213-L217 WeakPolarHBondContact O-CB 3.32Å; G213-L217 PolarHBondContact O-N 3.28Å; G213-L217 VanDerWaalsContact O-N 3.11Å; L217-R219 VanDerWaalsContact C-N 3.28Å; L217-R219 PolarHBondContact O-N 3.16Å; L217-M220 WeakPolarHBondContact O-CB 3.09Å; L217-M220 PolarHBondContact O-N 2.89Å; L217-V221 HydrophobicContact CD1-CG1 4.11Å; L217-V221 HydrophobicContact CD1-CG2 3.86Å; L217-V221 HydrophobicContact CG-CG2 4.02Å; L217-V221 PolarHBondContact O-N 2.9Å; L217-A226 HydrophobicContact CB-CB 4.37Å; L217-A226 HydrophobicContact CD2-CB 4.07Å; L217-A226 HydrophobicContact CG-CB 3.82Å; L217-L229 HydrophobicContact CD1-CD1 4.48Å; L217-L229 HydrophobicContact CD2-CB 4.28Å; L217-L229 HydrophobicContact CD2-CD1 4.23Å; L217-I230 HydrophobicContact CD2-CD1 4.14Å; L217-I230 HydrophobicContact CD2-CG1 4.04Å; L217-L246 HydrophobicContact CD1-CD1 3.77Å
218	P	98.6	Very high	98.2	Very high	26 Å²	26	50.4 Å²	50.4	17%	0.169	27%	0.271	C	S	.	.	H	α-helix	trans	-64.9	-27.4	179.8	24	-34.1	0	0	0	114.3	S214 Q215 M220 G222 V223 A226	S214-P218 VanDerWaalsContact O-CG 3.3Å; S214-P218 WeakPolarHBondContact O-CG 3.02Å; Q215-P218 WeakPolarHBondContact O-CG 3.33Å; P218-M220 PolarHBondContact O-N 2.88Å; P218-G222 CarbonylContact O-C 3.59Å; P218-G222 WeakPolarHBondContact O-CA 3.21Å; P218-G222 PolarHBondContact O-N 2.91Å; P218-G222 VanDerWaalsContact O-N 3.07Å; P218-V223 HydrophobicContact CB-CG2 4.22Å; P218-A226 VanDerWaalsContact CA-CB 3.49Å; P218-A226 HydrophobicContact CB-CB 3.73Å; P218-A226 HydrophobicContact CG-CB 4.44Å
219	R	98.4	Very high	98.4	Very high	143 Å²	143	45.1 Å²	45.1	54%	0.54	24%	0.243	S	C	.	.	H	α-helix	trans	-68.1	-23.5	172.3	-75.3	172	171.4	68.4	-0.5	112.7	Q215 R216 L217 E291	Q215-R219 WeakPolarHBondContact O-CD 3.24Å; Q215-R219 WeakPolarHBondContact O-CG 3.31Å; Q215-R219 PolarHBondContact O-NH1 2.92Å; R216-R219 PolarHBondContact O-N 2.81Å; L217-R219 VanDerWaalsContact C-N 3.28Å; L217-R219 PolarHBondContact O-N 3.16Å; R219-E291 IonicContact CZ-OE1 3.76Å; R219-E291 IonicContact CZ-OE2 3.19Å; R219-E291 IonicContact NE-OE1 2.69Å; R219-E291 PolarHBondContact NE-OE1 3.4Å; R219-E291 IonicContact NE-OE2 3.09Å; R219-E291 IonicContact NH2-OE1 3.31Å; R219-E291 IonicContact NH2-OE2 2.63Å; R219-E291 PolarHBondContact NH2-OE2 2.93Å
220	M	96.4	Very high	98.4	Very high	53 Å²	53	45.9 Å²	45.9	26%	0.261	25%	0.247	S	C	.	.	H	α-helix	trans	-95.7	-47.1	-174.8	-165.6	170.2	-56.7	0	0	112.7	L185 R190 R216 L217 P218 G245 L246	L185-M220 HydrophobicContact CD2-CE 3.42Å; L185-M220 VanDerWaalsContact CD2-CE 3.42Å; L185-M220 HydrophobicContact CD2-SD 3.64Å; R190-M220 VanDerWaalsContact CZ-SD 3.59Å; R190-M220 PolarHBondContact NE-SD 2.86Å; R190-M220 VanDerWaalsContact NE-SD 3.39Å; R216-M220 PolarHBondContact O-N 3.18Å; L217-M220 WeakPolarHBondContact O-CB 3.09Å; L217-M220 PolarHBondContact O-N 2.89Å; P218-M220 PolarHBondContact O-N 2.88Å; M220-G245 WeakPolarHBondContact CG-O 3.2Å; M220-L246 HydrophobicContact SD-CD1 3.93Å
221	V	98.1	Very high	98.5	Very high	19 Å²	19	51.8 Å²	51.8	12%	0.115	27%	0.267	C	S	.	.	H	α-helix	trans	-111.3	3.4	-173.2	-50.6	0	0	0	0	113	L217 L225 A226 L229 L244 L246	L217-V221 HydrophobicContact CD1-CG1 4.11Å; L217-V221 HydrophobicContact CD1-CG2 3.86Å; L217-V221 HydrophobicContact CG-CG2 4.02Å; L217-V221 PolarHBondContact O-N 2.9Å; V221-L225 HydrophobicContact CB-CD2 3.8Å; V221-L225 HydrophobicContact CB-CG 4.3Å; V221-L225 HydrophobicContact CG2-CB 4.19Å; V221-L225 HydrophobicContact CG2-CD2 4.05Å; V221-L225 HydrophobicContact CG2-CG 3.97Å; V221-A226 HydrophobicContact CG2-CB 4.02Å; V221-L229 HydrophobicContact CG2-CD1 4.38Å; V221-L244 WeakPolarHBondContact CG1-O 3.28Å; V221-L246 HydrophobicContact CG1-CB 4.05Å; V221-L246 HydrophobicContact CG1-CD1 4.42Å
222	G	98.5	Very high	98.5	Very high	36 Å²	36	55.5 Å²	55.5	37%	0.371	29%	0.29	S	S	.	.			trans	82.6	154.4	-173.6	0	0	0	0	0	113.7	P218 T224 A226	P218-G222 CarbonylContact O-C 3.59Å; P218-G222 WeakPolarHBondContact O-CA 3.21Å; P218-G222 PolarHBondContact O-N 2.91Å; P218-G222 VanDerWaalsContact O-N 3.07Å; G222-T224 PolarHBondContact O-N 2.83Å; G222-A226 VanDerWaalsContact O-CB 3.28Å; G222-A226 WeakPolarHBondContact O-CB 3.34Å; G222-A226 PolarHBondContact O-N 2.94Å
223	V	98.6	Very high	98.5	Very high	84 Å²	84	55.4 Å²	55.4	51%	0.509	29%	0.288	S	S	.	.	H	α-helix	trans	-61.5	-43.7	-172	177	0	0	0	0	112.9	P218 K227	P218-V223 HydrophobicContact CB-CG2 4.22Å; V223-K227 HydrophobicContact CG1-CD 4.15Å; V223-K227 HydrophobicContact CG1-CG 4.49Å; V223-K227 WeakPolarHBondContact O-CB 3.34Å; V223-K227 WeakPolarHBondContact O-CG 3.27Å; V223-K227 PolarHBondContact O-N 2.82Å
224	T	98.6	Very high	98.4	Very high	119 Å²	119	59.6 Å²	59.6	73%	0.73	30%	0.304	S	S	*	.	H	α-helix	trans	-64.7	-48.5	-175.3	-55.5	0	0	0	0	111.6	G222 K227 E228	G222-T224 PolarHBondContact O-N 2.83Å; T224-K227 PolarHBondContact O-N 3.35Å; T224-E228 PolarHBondContact O-N 3.42Å
225	L	98.6	Very high	98.4	Very high	34 Å²	34	64.1 Å²	64.1	18%	0.178	32%	0.316	C	S	.	.	H	α-helix	trans	-69.5	-39.4	179.8	177.8	59.5	0	0	0	111.6	V221 K227 E228 L229 L244	V221-L225 HydrophobicContact CB-CD2 3.8Å; V221-L225 HydrophobicContact CB-CG 4.3Å; V221-L225 HydrophobicContact CG2-CB 4.19Å; V221-L225 HydrophobicContact CG2-CD2 4.05Å; V221-L225 HydrophobicContact CG2-CG 3.97Å; L225-K227 VanDerWaalsContact C-N 3.32Å; L225-K227 PolarHBondContact O-N 2.88Å; L225-E228 WeakPolarHBondContact O-CB 3.29Å; L225-E228 PolarHBondContact O-N 3.46Å; L225-L229 HydrophobicContact CD1-CD1 4.38Å; L225-L229 HydrophobicContact CD1-CG 4.28Å; L225-L229 HydrophobicContact CG-CD1 4.2Å; L225-L229 WeakPolarHBondContact O-CG 3.4Å; L225-L229 PolarHBondContact O-N 2.81Å; L225-L244 HydrophobicContact CD1-CD1 4.45Å; L225-L244 HydrophobicContact CD1-CD2 4.2Å; L225-L244 HydrophobicContact CD2-CB 4Å; L225-L244 HydrophobicContact CD2-CD1 4.22Å; L225-L244 HydrophobicContact CD2-CD2 3.53Å; L225-L244 HydrophobicContact CD2-CG 4.07Å; L225-L244 HydrophobicContact CG-CD2 4.49Å
226	A	98.8	Very high	98.4	Very high	2 Å²	2	59.4 Å²	59.4	2%	0.017	29%	0.294	C	S	.	.	H	α-helix	trans	-60.6	-42.1	174.1	0	0	0	0	0	112	L217 P218 V221 G222 L229 I230	L217-A226 HydrophobicContact CB-CB 4.37Å; L217-A226 HydrophobicContact CD2-CB 4.07Å; L217-A226 HydrophobicContact CG-CB 3.82Å; P218-A226 VanDerWaalsContact CA-CB 3.49Å; P218-A226 HydrophobicContact CB-CB 3.73Å; P218-A226 HydrophobicContact CG-CB 4.44Å; V221-A226 HydrophobicContact CG2-CB 4.02Å; G222-A226 VanDerWaalsContact O-CB 3.28Å; G222-A226 WeakPolarHBondContact O-CB 3.34Å; G222-A226 PolarHBondContact O-N 2.94Å; A226-L229 PolarHBondContact O-N 3.18Å; A226-I230 WeakPolarHBondContact O-CB 3.46Å; A226-I230 VanDerWaalsContact O-CG1 3.26Å; A226-I230 WeakPolarHBondContact O-CG1 3.22Å; A226-I230 PolarHBondContact O-N 2.77Å
227	K	98.8	Very high	98.4	Very high	110 Å²	110	57.8 Å²	57.8	48%	0.478	29%	0.293	S	S	.	.	H	α-helix	trans	-60.5	-46.5	173.1	-79.9	178.4	177.5	178.6	0	111.4	V223 T224 L225 L229 I230 F231	V223-K227 HydrophobicContact CG1-CD 4.15Å; V223-K227 HydrophobicContact CG1-CG 4.49Å; V223-K227 WeakPolarHBondContact O-CB 3.34Å; V223-K227 WeakPolarHBondContact O-CG 3.27Å; V223-K227 PolarHBondContact O-N 2.82Å; T224-K227 PolarHBondContact O-N 3.35Å; L225-K227 VanDerWaalsContact C-N 3.32Å; L225-K227 PolarHBondContact O-N 2.88Å; K227-L229 PolarHBondContact O-N 3.33Å; K227-I230 PolarHBondContact O-N 3.46Å; K227-F231 HydrophobicContact CB-CD2 4.18Å; K227-F231 HydrophobicContact CB-CE1 4.39Å; K227-F231 HydrophobicContact CB-CE2 3.82Å; K227-F231 HydrophobicContact CB-CZ 3.95Å; K227-F231 HydrophobicContact CD-CE2 4.21Å; K227-F231 HydrophobicContact CD-CZ 4.03Å; K227-F231 HydrophobicContact CG-CE1 4.3Å; K227-F231 HydrophobicContact CG-CE2 4.12Å; K227-F231 HydrophobicContact CG-CZ 3.8Å; K227-F231 WeakPolarHBondContact O-CB 3.31Å; K227-F231 WeakPolarHBondContact O-CD1 3.33Å; K227-F231 WeakPolarHBondContact O-CD2 3.34Å; K227-F231 WeakPolarHBondContact O-CG 3.43Å; K227-F231 PolarHBondContact O-N 3.48Å
228	E	98.6	Very high	98.4	Very high	85 Å²	85	57.7 Å²	57.7	40%	0.397	29%	0.293	S	S	.	.	H	α-helix	trans	-56.7	-52	177	-171.2	-169.2	133.9	0	0	111.2	T224 L225 I230 F231 T232 R234	T224-E228 PolarHBondContact O-N 3.42Å; L225-E228 WeakPolarHBondContact O-CB 3.29Å; L225-E228 PolarHBondContact O-N 3.46Å; E228-I230 PolarHBondContact O-N 3.02Å; E228-F231 PolarHBondContact O-N 3.35Å; E228-T232 WeakPolarHBondContact O-CG2 3.14Å; E228-T232 PolarHBondContact O-N 2.5Å; E228-T232 PolarHBondContact O-OG1 2.99Å; E228-T232 VanDerWaalsContact O-OG1 3.06Å; E228-R234 IonicContact OE1-CZ 3.64Å; E228-R234 IonicContact OE1-NE 3.67Å; E228-R234 PolarHBondContact OE1-NE 2.77Å; E228-R234 IonicContact OE1-NH1 3.69Å; E228-R234 IonicContact OE1-NH2 3.66Å; E228-R234 PolarHBondContact OE1-NH2 3Å
229	L	98.6	Very high	98.4	Very high	8 Å²	8	60.4 Å²	60.4	4%	0.042	30%	0.303	C	S	.	.	H	α-helix	trans	-58.5	-45.7	179.7	-68.4	170.7	0	0	0	112.4	L217 V221 L225 A226 K227 G233 R234 V236	L217-L229 HydrophobicContact CD1-CD1 4.48Å; L217-L229 HydrophobicContact CD2-CB 4.28Å; L217-L229 HydrophobicContact CD2-CD1 4.23Å; V221-L229 HydrophobicContact CG2-CD1 4.38Å; L225-L229 HydrophobicContact CD1-CD1 4.38Å; L225-L229 HydrophobicContact CD1-CG 4.28Å; L225-L229 HydrophobicContact CG-CD1 4.2Å; L225-L229 WeakPolarHBondContact O-CG 3.4Å; L225-L229 PolarHBondContact O-N 2.81Å; A226-L229 PolarHBondContact O-N 3.18Å; K227-L229 PolarHBondContact O-N 3.33Å; L229-G233 VanDerWaalsContact O-CA 3.29Å; L229-G233 WeakPolarHBondContact O-CA 3.49Å; L229-G233 PolarHBondContact O-N 2.96Å; L229-R234 HydrophobicContact CD2-CG 3.72Å; L229-R234 PolarHBondContact O-N 3.44Å; L229-V236 HydrophobicContact CD2-CG1 3.79Å
230	I	98.8	Very high	98.4	Very high	16 Å²	16	56.2 Å²	56.2	8%	0.082	29%	0.293	C	S	.	.	H	α-helix	trans	-72	-44.2	-178.9	-68	168.9	0	0	0	111.3	L200 T203 P209 L217 A226 K227 E228 G233	L200-I230 HydrophobicContact CB-CG1 4.17Å; L200-I230 HydrophobicContact CD1-CD1 4.13Å; L200-I230 HydrophobicContact CD1-CG1 4Å; T203-I230 WeakPolarHBondContact CB-O 3.3Å; T203-I230 HydrophobicContact CG2-CG2 4.02Å; T203-I230 WeakPolarHBondContact CG2-O 3.35Å; T203-I230 PolarHBondContact OG1-O 3.38Å; P209-I230 HydrophobicContact CG-CD1 4.45Å; P209-I230 HydrophobicContact CG-CG1 4.34Å; P209-I230 HydrophobicContact CG-CG2 4.23Å; L217-I230 HydrophobicContact CD2-CD1 4.14Å; L217-I230 HydrophobicContact CD2-CG1 4.04Å; A226-I230 WeakPolarHBondContact O-CB 3.46Å; A226-I230 VanDerWaalsContact O-CG1 3.26Å; A226-I230 WeakPolarHBondContact O-CG1 3.22Å; A226-I230 PolarHBondContact O-N 2.77Å; K227-I230 PolarHBondContact O-N 3.46Å; E228-I230 PolarHBondContact O-N 3.02Å; I230-G233 PolarHBondContact O-N 3.31Å
231	F	98.6	Very high	98.5	Very high	145 Å²	145	53.7 Å²	53.7	64%	0.636	28%	0.281	S	S	*	.	H	α-helix	trans	-66.3	-42.2	-176.8	-67.5	-7.6	0	0	0	111.6	K227 E228 G233	K227-F231 HydrophobicContact CB-CD2 4.18Å; K227-F231 HydrophobicContact CB-CE1 4.39Å; K227-F231 HydrophobicContact CB-CE2 3.82Å; K227-F231 HydrophobicContact CB-CZ 3.95Å; K227-F231 HydrophobicContact CD-CE2 4.21Å; K227-F231 HydrophobicContact CD-CZ 4.03Å; K227-F231 HydrophobicContact CG-CE1 4.3Å; K227-F231 HydrophobicContact CG-CE2 4.12Å; K227-F231 HydrophobicContact CG-CZ 3.8Å; K227-F231 WeakPolarHBondContact O-CB 3.31Å; K227-F231 WeakPolarHBondContact O-CD1 3.33Å; K227-F231 WeakPolarHBondContact O-CD2 3.34Å; K227-F231 WeakPolarHBondContact O-CG 3.43Å; K227-F231 PolarHBondContact O-N 3.48Å; E228-F231 PolarHBondContact O-N 3.35Å; F231-G233 VanDerWaalsContact C-N 3.34Å
232	T	98.6	Very high	98.5	Very high	80 Å²	80	55.7 Å²	55.7	49%	0.491	29%	0.291	S	S	.	.	H	α-helix	trans	-82.6	-17	177.8	72	0	0	0	0	112.4	E228 R234	E228-T232 WeakPolarHBondContact O-CG2 3.14Å; E228-T232 PolarHBondContact O-N 2.5Å; E228-T232 PolarHBondContact O-OG1 2.99Å; E228-T232 VanDerWaalsContact O-OG1 3.06Å; T232-R234 PolarHBondContact O-N 3.12Å; T232-R234 VanDerWaalsContact OG1-CB 3.27Å; T232-R234 WeakPolarHBondContact OG1-CB 3.31Å; T232-R234 VanDerWaalsContact OG1-CG 3.28Å; T232-R234 WeakPolarHBondContact OG1-CG 3.21Å; T232-R234 PolarHBondContact OG1-N 2.86Å
233	G	98.2	Very high	98.5	Very high	9 Å²	9	60.3 Å²	60.3	9%	0.093	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.8	31.4	-170	0	0	0	0	0	112.8	I201 L229 I230 F231	I201-G233 WeakPolarHBondContact CG2-O 3.29Å; L229-G233 VanDerWaalsContact O-CA 3.29Å; L229-G233 WeakPolarHBondContact O-CA 3.49Å; L229-G233 PolarHBondContact O-N 2.96Å; I230-G233 PolarHBondContact O-N 3.31Å; F231-G233 VanDerWaalsContact C-N 3.34Å
234	R	97.8	Very high	98.5	Very high	89 Å²	89	58.4 Å²	58.4	34%	0.336	29%	0.289	S	S	.	.			trans	-76.3	150.8	-175.3	71	-178.5	178.5	134.5	-1.4	110.7	E228 L229 T232	E228-R234 IonicContact OE1-CZ 3.64Å; E228-R234 IonicContact OE1-NE 3.67Å; E228-R234 PolarHBondContact OE1-NE 2.77Å; E228-R234 IonicContact OE1-NH1 3.69Å; E228-R234 IonicContact OE1-NH2 3.66Å; E228-R234 PolarHBondContact OE1-NH2 3Å; L229-R234 HydrophobicContact CD2-CG 3.72Å; L229-R234 PolarHBondContact O-N 3.44Å; T232-R234 PolarHBondContact O-N 3.12Å; T232-R234 VanDerWaalsContact OG1-CB 3.27Å; T232-R234 WeakPolarHBondContact OG1-CB 3.31Å; T232-R234 VanDerWaalsContact OG1-CG 3.28Å; T232-R234 WeakPolarHBondContact OG1-CG 3.21Å; T232-R234 PolarHBondContact OG1-N 2.86Å
235	R	98.5	Very high	98.5	Very high	130 Å²	130	54.6 Å²	54.6	49%	0.491	27%	0.274	S	S	.	.			trans	-97.6	146.5	173	-57.6	177.2	-167.7	170.3	6.1	109.7	L177 M198 I201	L177-R235 HydrophobicContact CD2-CG 3.95Å; M198-R235 CarbonylContact O-C 3.54Å; M198-R235 WeakPolarHBondContact O-CA 3.11Å; I201-R235 HydrophobicContact CG2-CG 4.21Å
236	V	98.4	Very high	98.5	Very high	8 Å²	8	53.1 Å²	53.1	5%	0.048	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	145.1	174.6	-62.9	0	0	0	0	110.2	M198 L229 T240 A241 L244 L246	M198-V236 HydrophobicContact CB-CG2 4.25Å; M198-V236 PolarHBondContact N-O 3.25Å; M198-V236 PolarHBondContact O-N 3.2Å; L229-V236 HydrophobicContact CD2-CG1 3.79Å; V236-T240 HydrophobicContact CB-CG2 4.2Å; V236-T240 HydrophobicContact CG1-CG2 4.21Å; V236-A241 HydrophobicContact CG2-CB 4.25Å; V236-L244 HydrophobicContact CG1-CD1 4.2Å; V236-L246 HydrophobicContact CG2-CD2 4.14Å
237	G	98.4	Very high	98.5	Very high	16 Å²	16	53.3 Å²	53.3	17%	0.165	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	166.5	171.9	0	0	0	0	0	112	A196 Q239 T240 A241	A196-G237 CarbonylContact O-C 3.58Å; A196-G237 VanDerWaalsContact O-CA 3.23Å; A196-G237 WeakPolarHBondContact O-CA 3.45Å; G237-Q239 VanDerWaalsContact C-N 3.32Å; G237-Q239 PolarHBondContact O-N 2.69Å; G237-T240 PolarHBondContact O-N 3.12Å; G237-A241 VanDerWaalsContact O-CB 3.31Å; G237-A241 WeakPolarHBondContact O-CB 3Å; G237-A241 PolarHBondContact O-N 3.46Å
238	G	98.4	Very high	98.5	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-59.8	-39.3	176.9	0	0	0	0	0	114	S193 T194 A196 A241 L242	S193-G238 WeakPolarHBondContact O-CA 3.4Å; T194-G238 PolarHBondContact O-N 3.34Å; A196-G238 PolarHBondContact O-N 3Å; A196-G238 VanDerWaalsContact O-N 3.07Å; G238-A241 WeakPolarHBondContact O-CB 3.13Å; G238-A241 PolarHBondContact O-N 3.04Å; G238-L242 PolarHBondContact O-N 3.43Å
239	Q	98.4	Very high	98.5	Very high	83 Å²	83	50.9 Å²	50.9	39%	0.388	26%	0.257	S	S	.	.	H	α-helix	trans	-63.9	-50.6	177.6	-177.3	55.7	42	0	0	111.6	T194 G237 A241 L242 E243	T194-Q239 HydrophobicContact CG2-CB 4.36Å; G237-Q239 VanDerWaalsContact C-N 3.32Å; G237-Q239 PolarHBondContact O-N 2.69Å; Q239-A241 VanDerWaalsContact C-N 3.28Å; Q239-A241 PolarHBondContact O-N 3.15Å; Q239-L242 WeakPolarHBondContact O-CB 3.18Å; Q239-L242 PolarHBondContact O-N 3.31Å; Q239-L242 VanDerWaalsContact O-N 3.14Å; Q239-E243 PolarHBondContact NE2-OE1 2.93Å; Q239-E243 PolarHBondContact O-N 3.37Å
240	T	98.6	Very high	98.5	Very high	54 Å²	54	51.7 Å²	51.7	33%	0.331	27%	0.265	S	S	.	.	H	α-helix	trans	-60.7	-39.3	174.1	-54.4	0	0	0	0	111.2	V236 G237 L242 E243 L244	V236-T240 HydrophobicContact CB-CG2 4.2Å; V236-T240 HydrophobicContact CG1-CG2 4.21Å; G237-T240 PolarHBondContact O-N 3.12Å; T240-L242 VanDerWaalsContact C-N 3.25Å; T240-L242 PolarHBondContact O-N 3.02Å; T240-E243 WeakPolarHBondContact O-CB 3.29Å; T240-E243 PolarHBondContact O-N 3.35Å; T240-E243 VanDerWaalsContact O-N 3.15Å; T240-L244 HydrophobicContact CG2-CD1 3.92Å; T240-L244 HydrophobicContact CG2-CG 4.12Å; T240-L244 VanDerWaalsContact O-CG 3.23Å; T240-L244 WeakPolarHBondContact O-CG 3.27Å; T240-L244 PolarHBondContact O-N 3.2Å
241	A	98.6	Very high	98.5	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-60.6	-34.8	177.3	0	0	0	0	0	112.7	M198 V236 G237 G238 Q239 G245 L246 V247	M198-A241 HydrophobicContact CE-CB 3.3Å; M198-A241 HydrophobicContact SD-CB 4.09Å; V236-A241 HydrophobicContact CG2-CB 4.25Å; G237-A241 VanDerWaalsContact O-CB 3.31Å; G237-A241 WeakPolarHBondContact O-CB 3Å; G237-A241 PolarHBondContact O-N 3.46Å; G238-A241 WeakPolarHBondContact O-CB 3.13Å; G238-A241 PolarHBondContact O-N 3.04Å; Q239-A241 VanDerWaalsContact C-N 3.28Å; Q239-A241 PolarHBondContact O-N 3.15Å; A241-G245 PolarHBondContact O-N 3.45Å; A241-L246 HydrophobicContact CB-CB 4.07Å; A241-L246 HydrophobicContact CB-CD2 4.03Å; A241-L246 HydrophobicContact CB-CG 4.35Å; A241-L246 WeakPolarHBondContact O-CA 3.49Å; A241-L246 WeakPolarHBondContact O-CB 3.47Å; A241-L246 PolarHBondContact O-N 3.23Å; A241-V247 HydrophobicContact CB-CG1 4.11Å; A241-V247 HydrophobicContact CB-CG2 4.07Å; A241-V247 PolarHBondContact O-N 3.4Å
242	L	98.7	Very high	98.5	Very high	62 Å²	62	53.5 Å²	53.5	33%	0.325	28%	0.278	S	S	.	.	H	α-helix	trans	-65.7	-46.9	173.4	178.9	64.7	0	0	0	110.8	G238 Q239 T240 L244 G245 V247 N248 A250	G238-L242 PolarHBondContact O-N 3.43Å; Q239-L242 WeakPolarHBondContact O-CB 3.18Å; Q239-L242 PolarHBondContact O-N 3.31Å; Q239-L242 VanDerWaalsContact O-N 3.14Å; T240-L242 VanDerWaalsContact C-N 3.25Å; T240-L242 PolarHBondContact O-N 3.02Å; L242-L244 PolarHBondContact O-N 3.5Å; L242-G245 PolarHBondContact O-N 3.15Å; L242-V247 HydrophobicContact CB-CG2 3.97Å; L242-V247 HydrophobicContact CD1-CG2 4.46Å; L242-V247 WeakPolarHBondContact CD1-O 3.4Å; L242-N248 WeakPolarHBondContact CD1-O 3.36Å; L242-A250 HydrophobicContact CB-CB 3.96Å; L242-A250 HydrophobicContact CD2-CB 4.04Å
243	E	98.4	Very high	98.4	Very high	132 Å²	132	52.4 Å²	52.4	62%	0.617	27%	0.267	S	S	*	.	H	α-helix	trans	-60.3	-33.9	178.5	-68.1	161.8	-166.5	0	0	112.8	Q239 T240 G245	Q239-E243 PolarHBondContact NE2-OE1 2.93Å; Q239-E243 PolarHBondContact O-N 3.37Å; T240-E243 WeakPolarHBondContact O-CB 3.29Å; T240-E243 PolarHBondContact O-N 3.35Å; T240-E243 VanDerWaalsContact O-N 3.15Å; E243-G245 VanDerWaalsContact C-N 3.31Å
244	L	98	Very high	98.4	Very high	44 Å²	44	54.4 Å²	54.4	23%	0.23	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-6.8	177.3	-60.7	178.6	0	0	0	113.6	V221 L225 V236 T240 L242 L246	V221-L244 WeakPolarHBondContact CG1-O 3.28Å; L225-L244 HydrophobicContact CD1-CD1 4.45Å; L225-L244 HydrophobicContact CD1-CD2 4.2Å; L225-L244 HydrophobicContact CD2-CB 4Å; L225-L244 HydrophobicContact CD2-CD1 4.22Å; L225-L244 HydrophobicContact CD2-CD2 3.53Å; L225-L244 HydrophobicContact CD2-CG 4.07Å; L225-L244 HydrophobicContact CG-CD2 4.49Å; V236-L244 HydrophobicContact CG1-CD1 4.2Å; T240-L244 HydrophobicContact CG2-CD1 3.92Å; T240-L244 HydrophobicContact CG2-CG 4.12Å; T240-L244 VanDerWaalsContact O-CG 3.23Å; T240-L244 WeakPolarHBondContact O-CG 3.27Å; T240-L244 PolarHBondContact O-N 3.2Å; L242-L244 PolarHBondContact O-N 3.5Å; L244-L246 VanDerWaalsContact C-N 3.29Å; L244-L246 PolarHBondContact O-N 2.8Å
245	G	98	Very high	98.4	Very high	40 Å²	40	60 Å²	60	41%	0.412	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.4	14.4	-173.5	0	0	0	0	0	114.6	M220 A241 L242 E243	M220-G245 WeakPolarHBondContact CG-O 3.2Å; A241-G245 PolarHBondContact O-N 3.45Å; L242-G245 PolarHBondContact O-N 3.15Å; E243-G245 VanDerWaalsContact C-N 3.31Å
246	L	98.5	Very high	98.3	Very high	2 Å²	2	58.2 Å²	58.2	1%	0.01	31%	0.313	C	S	.	.	S	Bend	trans	-73.5	-30.6	176.8	178.9	61.2	0	0	0	111.9	L181 L185 R190 M198 L217 M220 V221 V236 A241 L244	L181-L246 HydrophobicContact CD1-CD1 4.43Å; L185-L246 HydrophobicContact CD2-CD1 3.75Å; R190-L246 VanDerWaalsContact CD-O 3.24Å; R190-L246 WeakPolarHBondContact CD-O 3.37Å; R190-L246 PolarHBondContact NE-O 3.4Å; M198-L246 HydrophobicContact CB-CD2 4.31Å; M198-L246 HydrophobicContact SD-CD2 4.25Å; L217-L246 HydrophobicContact CD1-CD1 3.77Å; M220-L246 HydrophobicContact SD-CD1 3.93Å; V221-L246 HydrophobicContact CG1-CB 4.05Å; V221-L246 HydrophobicContact CG1-CD1 4.42Å; V236-L246 HydrophobicContact CG2-CD2 4.14Å; A241-L246 HydrophobicContact CB-CB 4.07Å; A241-L246 HydrophobicContact CB-CD2 4.03Å; A241-L246 HydrophobicContact CB-CG 4.35Å; A241-L246 WeakPolarHBondContact O-CA 3.49Å; A241-L246 WeakPolarHBondContact O-CB 3.47Å; A241-L246 PolarHBondContact O-N 3.23Å; L244-L246 VanDerWaalsContact C-N 3.29Å; L244-L246 PolarHBondContact O-N 2.8Å
247	V	98.8	Very high	98.3	Very high	6 Å²	6	59.2 Å²	59.2	4%	0.036	33%	0.325	C	S	.	.			trans	-126	152.4	175.4	-55.9	0	0	0	0	111	M172 R190 A192 M198 A241 L242 A250	M172-V247 HydrophobicContact CE-CG1 3.56Å; R190-V247 HydrophobicContact CB-CB 4.08Å; R190-V247 HydrophobicContact CB-CG1 3.96Å; A192-V247 HydrophobicContact CB-CG1 4.08Å; A192-V247 HydrophobicContact CB-CG2 4.36Å; M198-V247 HydrophobicContact CE-CG1 4.31Å; M198-V247 HydrophobicContact SD-CG1 3.87Å; A241-V247 HydrophobicContact CB-CG1 4.11Å; A241-V247 HydrophobicContact CB-CG2 4.07Å; A241-V247 PolarHBondContact O-N 3.4Å; L242-V247 HydrophobicContact CB-CG2 3.97Å; L242-V247 HydrophobicContact CD1-CG2 4.46Å; L242-V247 WeakPolarHBondContact CD1-O 3.4Å; V247-A250 HydrophobicContact CG2-CB 4.49Å
248	N	98.7	Very high	98.3	Very high	76 Å²	76	59.9 Å²	59.9	41%	0.406	33%	0.325	S	S	.	.	S	Bend	trans	-79.8	-37.4	179.7	-60.3	85.4	0	0	0	111.9	L189 R190 L242	L189-N248 WeakPolarHBondContact CA-OD1 3.49Å; R190-N248 PolarHBondContact N-OD1 3.36Å; R190-N248 WeakPolarHBondContact O-CB 3.41Å; R190-N248 PolarHBondContact O-N 2.92Å; L242-N248 WeakPolarHBondContact CD1-O 3.36Å
249	R	98.6	Very high	98.3	Very high	69 Å²	69	60.1 Å²	60.1	26%	0.26	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	137.7	-179.2	-56.8	-170.8	-177.7	177.6	0.7	110.3	R190 T191 A192 E263 E270	R190-R249 PolarHBondContact O-N 2.88Å; T191-R249 WeakPolarHBondContact CA-O 3.22Å; T191-R249 HydrophobicContact CG2-CB 4.3Å; A192-R249 PolarHBondContact N-O 2.88Å; R249-E263 HydrophobicContact CB-CG 3.88Å; R249-E263 WeakPolarHBondContact CD-OE1 3.41Å; R249-E263 HydrophobicContact CG-CG 4.5Å; R249-E263 IonicContact CZ-OE1 3.63Å; R249-E263 IonicContact NE-OE1 2.95Å; R249-E263 IonicContact NH1-OE1 2.82Å; R249-E263 PolarHBondContact NH1-OE1 3.48Å; R249-E270 IonicContact CZ-OE1 2.85Å; R249-E270 VanDerWaalsContact CZ-OE1 3.32Å; R249-E270 IonicContact NH1-OE1 3.67Å; R249-E270 PolarHBondContact NH1-OE1 3.39Å; R249-E270 VanDerWaalsContact NH2-CD 3.27Å; R249-E270 IonicContact NH2-OE1 2.82Å; R249-E270 PolarHBondContact NH2-OE1 3.4Å; R249-E270 IonicContact NH2-OE2 3.52Å; R249-E270 PolarHBondContact NH2-OE2 3.1Å
250	A	98.6	Very high	98.3	Very high	25 Å²	25	56.1 Å²	56.1	21%	0.207	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	137.6	170.3	0	0	0	0	0	110	A192 T194 L242 V247	A192-A250 CarbonylContact O-C 3.51Å; A192-A250 VanDerWaalsContact O-CA 3.23Å; A192-A250 WeakPolarHBondContact O-CA 3.37Å; T194-A250 HydrophobicContact CG2-CB 4.24Å; L242-A250 HydrophobicContact CB-CB 3.96Å; L242-A250 HydrophobicContact CD2-CB 4.04Å; V247-A250 HydrophobicContact CG2-CB 4.49Å
251	V	98.7	Very high	98.3	Very high	41 Å²	41	55 Å²	55	25%	0.248	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	143.8	-173.4	49.9	0	0	0	0	110.2	A192 S193 T194 Q253 A259 E263	A192-V251 PolarHBondContact O-N 3.24Å; S193-V251 CarbonylContact C-O 3.54Å; S193-V251 WeakPolarHBondContact CA-O 3.33Å; T194-V251 PolarHBondContact N-O 3.33Å; V251-Q253 PolarHBondContact O-N 3.44Å; V251-A259 HydrophobicContact CG1-CB 4.05Å; V251-A259 HydrophobicContact CG2-CB 4.2Å; V251-E263 HydrophobicContact CG1-CB 4.01Å; V251-E263 HydrophobicContact CG1-CG 4.45Å
252	E	98.6	Very high	98.3	Very high	158 Å²	158	59.6 Å²	59.6	74%	0.738	32%	0.318	S	S	*	.	P	Polyproline II helix	trans	-60.4	137.7	176	-68.3	-171.3	164.8	0	0	111.6	N254 A259	E252-N254 PolarHBondContact O-N 2.84Å; E252-A259 VanDerWaalsContact O-CB 3.24Å; E252-A259 WeakPolarHBondContact O-CB 3.35Å
253	Q	98.3	Very high	98.3	Very high	57 Å²	57	59 Å²	59	27%	0.266	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-66.2	134	-179.4	-165.2	47.5	-79.7	0	0	110.5	D173 S193 V251 A259	D173-Q253 PolarHBondContact O-NE2 2.94Å; D173-Q253 PolarHBondContact OD1-NE2 3.33Å; S193-Q253 WeakPolarHBondContact OG-CB 3.32Å; V251-Q253 PolarHBondContact O-N 3.44Å; Q253-A259 VanDerWaalsContact OE1-CB 3.22Å
254	N	97.9	Very high	98.4	Very high	50 Å²	50	52.7 Å²	52.7	27%	0.267	28%	0.284	S	S	.	.	P	Polyproline II helix	trans	-90.6	171.1	175.6	69.3	37.8	0	0	0	110.9	E252 S256 G257 D258 A259 K262	E252-N254 PolarHBondContact O-N 2.84Å; N254-S256 PolarHBondContact O-N 2.63Å; N254-S256 WeakPolarHBondContact OD1-CA 3.46Å; N254-S256 WeakPolarHBondContact OD1-CB 3.47Å; N254-S256 PolarHBondContact OD1-N 2.89Å; N254-G257 PolarHBondContact O-N 2.69Å; N254-G257 VanDerWaalsContact O-N 3.1Å; N254-G257 PolarHBondContact OD1-N 2.99Å; N254-D258 PolarHBondContact ND2-OD1 3Å; N254-D258 PolarHBondContact OD1-N 2.92Å; N254-D258 PolarHBondContact OD1-OD1 2.97Å; N254-D258 VanDerWaalsContact OD1-OD1 3.11Å; N254-A259 HydrophobicContact CB-CB 4.3Å; N254-A259 WeakPolarHBondContact ND2-CA 3.47Å; N254-A259 PolarHBondContact ND2-N 2.8Å; N254-K262 PolarHBondContact ND2-NZ 2.83Å
255	Q	97.2	Very high	98.4	Very high	208 Å²	208	51.3 Å²	51.3	97%	0.972	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-27.5	-178.7	-64.6	176.5	0.1	0	0	113.5	G257	Q255-G257 VanDerWaalsContact C-N 3.3Å
256	S	97.1	Very high	98.4	Very high	92 Å²	92	51 Å²	51	64%	0.643	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-10.9	178.7	-53.2	0	0	0	0	113.2	N254 D258	N254-S256 PolarHBondContact O-N 2.63Å; N254-S256 WeakPolarHBondContact OD1-CA 3.46Å; N254-S256 WeakPolarHBondContact OD1-CB 3.47Å; N254-S256 PolarHBondContact OD1-N 2.89Å; S256-D258 VanDerWaalsContact C-N 3.34Å
257	G	97.8	Very high	98.5	Very high	29 Å²	29	51.7 Å²	51.7	30%	0.299	27%	0.274	S	S	.	.	S	Bend	trans	71.1	26.2	-179.9	0	0	0	0	0	114.2	D173 N254 Q255	D173-G257 VanDerWaalsContact CB-O 3.29Å; D173-G257 WeakPolarHBondContact CB-O 3.5Å; N254-G257 PolarHBondContact O-N 2.69Å; N254-G257 VanDerWaalsContact O-N 3.1Å; N254-G257 PolarHBondContact OD1-N 2.99Å; Q255-G257 VanDerWaalsContact C-N 3.3Å
258	D	98.5	Very high	98.5	Very high	30 Å²	30	51.4 Å²	51.4	16%	0.16	27%	0.272	C	S	.	.			trans	-130.7	21	-173.9	75.6	-13.8	0	0	0	113.9	D173 N254 S256 A260 Y261 K262	D173-D258 VanDerWaalsContact CG-CA 3.49Å; D173-D258 WeakPolarHBondContact OD1-CA 3.39Å; D173-D258 WeakPolarHBondContact OD2-CA 3.35Å; N254-D258 PolarHBondContact ND2-OD1 3Å; N254-D258 PolarHBondContact OD1-N 2.92Å; N254-D258 PolarHBondContact OD1-OD1 2.97Å; N254-D258 VanDerWaalsContact OD1-OD1 3.11Å; S256-D258 VanDerWaalsContact C-N 3.34Å; D258-A260 PolarHBondContact O-N 2.9Å; D258-Y261 HydrophobicContact CB-CD1 4.21Å; D258-Y261 WeakPolarHBondContact O-CB 3.41Å; D258-Y261 PolarHBondContact O-N 3.16Å; D258-K262 PolarHBondContact O-N 2.89Å; D258-K262 VanDerWaalsContact OD1-CE 3.23Å; D258-K262 WeakPolarHBondContact OD1-CE 3.35Å; D258-K262 IonicContact OD1-NZ 2.73Å; D258-K262 PolarHBondContact OD1-NZ 3.14Å; D258-K262 VanDerWaalsContact OD2-CE 3.32Å; D258-K262 WeakPolarHBondContact OD2-CE 3.46Å; D258-K262 IonicContact OD2-NZ 3.35Å; D258-K262 PolarHBondContact OD2-NZ 3.31Å
259	A	98.6	Very high	98.5	Very high	4 Å²	4	52.2 Å²	52.2	3%	0.033	27%	0.269	C	S	.	.	H	α-helix	trans	-60.6	-42.6	-176.9	0	0	0	0	0	113.1	D173 V251 E252 Q253 N254 Y261 K262 E263	D173-A259 PolarHBondContact OD1-N 2.97Å; V251-A259 HydrophobicContact CG1-CB 4.05Å; V251-A259 HydrophobicContact CG2-CB 4.2Å; E252-A259 VanDerWaalsContact O-CB 3.24Å; E252-A259 WeakPolarHBondContact O-CB 3.35Å; Q253-A259 VanDerWaalsContact OE1-CB 3.22Å; N254-A259 HydrophobicContact CB-CB 4.3Å; N254-A259 WeakPolarHBondContact ND2-CA 3.47Å; N254-A259 PolarHBondContact ND2-N 2.8Å; A259-Y261 VanDerWaalsContact C-N 3.31Å; A259-Y261 PolarHBondContact O-N 3.34Å; A259-K262 PolarHBondContact O-N 3.15Å; A259-E263 PolarHBondContact O-N 2.96Å
260	A	98.8	Very high	98.4	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-64.3	-39	177.7	0	0	0	0	0	111.2	D173 T191 D258 E263 A264	D173-A260 HydrophobicContact CB-CB 4.42Å; D173-A260 WeakPolarHBondContact OD1-CB 3.28Å; D173-A260 PolarHBondContact OD1-N 2.79Å; T191-A260 PolarHBondContact OG1-O 2.8Å; D258-A260 PolarHBondContact O-N 2.9Å; A260-E263 PolarHBondContact O-N 3.3Å; A260-A264 WeakPolarHBondContact O-CB 3.45Å; A260-A264 PolarHBondContact O-N 3.35Å
261	Y	98.8	Very high	98.5	Very high	31 Å²	31	54.2 Å²	54.2	12%	0.122	28%	0.278	C	S	.	.	H	α-helix	trans	-62.6	-45.2	172.8	161.7	-108.2	0	0	0	112.7	E84 I121 R123 D173 D258 A259 E263 A264 L265	E84-Y261 HydrophobicContact CG-CE2 4.45Å; E84-Y261 WeakPolarHBondContact OE1-CE2 3.49Å; E84-Y261 PolarHBondContact OE1-OH 3.42Å; I121-Y261 HydrophobicContact CG2-CD2 4.35Å; R123-Y261 HydrophobicContact CB-CD2 4.43Å; R123-Y261 VanDerWaalsContact CD-CD2 3.49Å; R123-Y261 HydrophobicContact CG-CD2 4.41Å; D173-Y261 PolarHBondContact OD2-N 3.23Å; D258-Y261 HydrophobicContact CB-CD1 4.21Å; D258-Y261 WeakPolarHBondContact O-CB 3.41Å; D258-Y261 PolarHBondContact O-N 3.16Å; A259-Y261 VanDerWaalsContact C-N 3.31Å; A259-Y261 PolarHBondContact O-N 3.34Å; Y261-E263 PolarHBondContact O-N 2.71Å; Y261-A264 WeakPolarHBondContact O-CB 3.47Å; Y261-A264 PolarHBondContact O-N 2.99Å; Y261-A264 VanDerWaalsContact O-N 3.12Å; Y261-L265 PolarHBondContact O-N 2.95Å
262	K	98.8	Very high	98.4	Very high	96 Å²	96	53.1 Å²	53.1	42%	0.417	27%	0.271	S	S	.	.	H	α-helix	trans	-59.6	-39.2	175.6	-74.2	174.4	176.5	145.9	0	111.7	N254 D258 A259 L265 A266	N254-K262 PolarHBondContact ND2-NZ 2.83Å; D258-K262 PolarHBondContact O-N 2.89Å; D258-K262 VanDerWaalsContact OD1-CE 3.23Å; D258-K262 WeakPolarHBondContact OD1-CE 3.35Å; D258-K262 IonicContact OD1-NZ 2.73Å; D258-K262 PolarHBondContact OD1-NZ 3.14Å; D258-K262 VanDerWaalsContact OD2-CE 3.32Å; D258-K262 WeakPolarHBondContact OD2-CE 3.46Å; D258-K262 IonicContact OD2-NZ 3.35Å; D258-K262 PolarHBondContact OD2-NZ 3.31Å; A259-K262 PolarHBondContact O-N 3.15Å; K262-L265 PolarHBondContact O-N 3.24Å; K262-A266 PolarHBondContact O-N 3.2Å
263	E	98.8	Very high	98.4	Very high	48 Å²	48	48.9 Å²	48.9	22%	0.224	26%	0.257	C	S	.	.	H	α-helix	trans	-67.2	-39.6	174.6	-168.1	56.7	-140.7	0	0	112.3	T191 R249 V251 A259 A260 Y261 L265 A266 L267	T191-E263 HydrophobicContact CG2-CB 4.24Å; T191-E263 HydrophobicContact CG2-CG 3.98Å; R249-E263 HydrophobicContact CB-CG 3.88Å; R249-E263 WeakPolarHBondContact CD-OE1 3.41Å; R249-E263 HydrophobicContact CG-CG 4.5Å; R249-E263 IonicContact CZ-OE1 3.63Å; R249-E263 IonicContact NE-OE1 2.95Å; R249-E263 IonicContact NH1-OE1 2.82Å; R249-E263 PolarHBondContact NH1-OE1 3.48Å; V251-E263 HydrophobicContact CG1-CB 4.01Å; V251-E263 HydrophobicContact CG1-CG 4.45Å; A259-E263 PolarHBondContact O-N 2.96Å; A260-E263 PolarHBondContact O-N 3.3Å; Y261-E263 PolarHBondContact O-N 2.71Å; E263-L265 VanDerWaalsContact C-N 3.31Å; E263-L265 PolarHBondContact O-N 3.06Å; E263-A266 PolarHBondContact O-N 3.27Å; E263-L267 WeakPolarHBondContact O-CB 3.35Å; E263-L267 PolarHBondContact O-N 2.87Å
264	A	98.9	Very high	98.4	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-63.3	-38.7	174	0	0	0	0	0	111.9	I121 V169 A171 T191 A260 Y261 L267 A268	I121-A264 HydrophobicContact CD1-CB 4.32Å; I121-A264 HydrophobicContact CG2-CB 4.05Å; V169-A264 HydrophobicContact CB-CB 4.36Å; V169-A264 HydrophobicContact CG1-CB 3.63Å; A171-A264 HydrophobicContact CB-CB 3.88Å; T191-A264 HydrophobicContact CG2-CB 4.21Å; A260-A264 WeakPolarHBondContact O-CB 3.45Å; A260-A264 PolarHBondContact O-N 3.35Å; Y261-A264 WeakPolarHBondContact O-CB 3.47Å; Y261-A264 PolarHBondContact O-N 2.99Å; Y261-A264 VanDerWaalsContact O-N 3.12Å; A264-L267 PolarHBondContact O-N 2.85Å; A264-A268 WeakPolarHBondContact O-CB 2.93Å; A264-A268 PolarHBondContact O-N 3.47Å
265	L	98.8	Very high	98.4	Very high	15 Å²	15	49.1 Å²	49.1	8%	0.079	26%	0.258	C	S	.	.	H	α-helix	trans	-67	-40.3	176.3	-172.4	64.5	0	0	0	111.4	L75 I82 I121 Y261 K262 E263 A268 R269	L75-L265 HydrophobicContact CD1-CD1 3.57Å; I82-L265 HydrophobicContact CD1-CD1 3.79Å; I82-L265 HydrophobicContact CG2-CD1 4.43Å; I121-L265 HydrophobicContact CD1-CD1 4.3Å; Y261-L265 PolarHBondContact O-N 2.95Å; K262-L265 PolarHBondContact O-N 3.24Å; E263-L265 VanDerWaalsContact C-N 3.31Å; E263-L265 PolarHBondContact O-N 3.06Å; L265-A268 PolarHBondContact O-N 2.62Å; L265-R269 VanDerWaalsContact O-CG 3.28Å; L265-R269 WeakPolarHBondContact O-CG 3.47Å; L265-R269 PolarHBondContact O-N 3.44Å
266	A	98.8	Very high	98.4	Very high	33 Å²	33	39.7 Å²	39.7	27%	0.273	22%	0.216	S	C	.	.	H	α-helix	trans	-60.7	-48.2	172.9	0	0	0	0	0	111.5	K262 E263 A268 R269 E270	K262-A266 PolarHBondContact O-N 3.2Å; E263-A266 PolarHBondContact O-N 3.27Å; A266-A268 VanDerWaalsContact C-N 3.32Å; A266-A268 PolarHBondContact O-N 3.2Å; A266-R269 WeakPolarHBondContact O-CB 3.33Å; A266-R269 PolarHBondContact O-N 2.95Å; A266-R269 VanDerWaalsContact O-N 3.12Å; A266-E270 PolarHBondContact O-N 2.92Å; A266-E270 VanDerWaalsContact O-N 3.09Å
267	L	98.6	Very high	98.4	Very high	18 Å²	18	37.4 Å²	37.4	9%	0.094	19%	0.194	C	C	.	.	H	α-helix	trans	-60.6	-40.3	175.9	-176.2	61.9	0	0	0	112.2	V169 L189 T191 E263 A264 R269 E270 I271	V169-L267 HydrophobicContact CG1-CD2 4.33Å; L189-L267 HydrophobicContact CB-CD2 4.01Å; L189-L267 HydrophobicContact CD1-CD1 4.46Å; L189-L267 HydrophobicContact CD1-CD2 3.69Å; L189-L267 HydrophobicContact CD1-CG 4.09Å; L189-L267 HydrophobicContact CG-CD2 4.4Å; T191-L267 HydrophobicContact CG2-CD2 4.34Å; E263-L267 WeakPolarHBondContact O-CB 3.35Å; E263-L267 PolarHBondContact O-N 2.87Å; A264-L267 PolarHBondContact O-N 2.85Å; L267-R269 VanDerWaalsContact C-N 3.33Å; L267-R269 PolarHBondContact O-N 3.2Å; L267-E270 WeakPolarHBondContact O-CB 3.48Å; L267-E270 PolarHBondContact O-N 3.21Å; L267-I271 WeakPolarHBondContact O-CG1 3.41Å; L267-I271 PolarHBondContact O-N 3.39Å
268	A	98.8	Very high	98.4	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-64.1	-37.7	175.1	0	0	0	0	0	112.1	I82 V119 I121 A264 L265 A266 E270 I271 L272	I82-A268 HydrophobicContact CD1-CB 3.57Å; I82-A268 HydrophobicContact CG1-CB 4.07Å; I82-A268 HydrophobicContact CG2-CB 4.5Å; V119-A268 HydrophobicContact CB-CB 4.14Å; V119-A268 HydrophobicContact CG1-CB 3.73Å; V119-A268 HydrophobicContact CG2-CB 4.32Å; I121-A268 HydrophobicContact CD1-CB 4.01Å; A264-A268 WeakPolarHBondContact O-CB 2.93Å; A264-A268 PolarHBondContact O-N 3.47Å; L265-A268 PolarHBondContact O-N 2.62Å; A266-A268 VanDerWaalsContact C-N 3.32Å; A266-A268 PolarHBondContact O-N 3.2Å; A268-E270 VanDerWaalsContact C-N 3.29Å; A268-E270 PolarHBondContact O-N 3.14Å; A268-I271 PolarHBondContact O-N 2.88Å; A268-I271 VanDerWaalsContact O-N 3.11Å; A268-L272 WeakPolarHBondContact O-CG 3.32Å; A268-L272 PolarHBondContact O-N 3.31Å
269	R	98.7	Very high	98.4	Very high	93 Å²	93	37.9 Å²	37.9	35%	0.351	20%	0.196	S	C	.	.	H	α-helix	trans	-66.7	-26	174.2	-72.4	166.5	177.4	158.3	2.6	113.5	D79 I82 L265 A266 L267 I271 L272 P273	D79-R269 WeakPolarHBondContact OD1-CG 3.2Å; D79-R269 IonicContact OD1-CZ 3.32Å; D79-R269 IonicContact OD1-NE 2.77Å; D79-R269 PolarHBondContact OD1-NE 2.99Å; D79-R269 IonicContact OD1-NH2 2.65Å; D79-R269 PolarHBondContact OD1-NH2 2.87Å; D79-R269 IonicContact OD2-CZ 2.81Å; D79-R269 IonicContact OD2-NE 3.58Å; D79-R269 IonicContact OD2-NH2 2.87Å; D79-R269 PolarHBondContact OD2-NH2 2.94Å; I82-R269 HydrophobicContact CD1-CG 4.42Å; L265-R269 VanDerWaalsContact O-CG 3.28Å; L265-R269 WeakPolarHBondContact O-CG 3.47Å; L265-R269 PolarHBondContact O-N 3.44Å; A266-R269 WeakPolarHBondContact O-CB 3.33Å; A266-R269 PolarHBondContact O-N 2.95Å; A266-R269 VanDerWaalsContact O-N 3.12Å; L267-R269 VanDerWaalsContact C-N 3.33Å; L267-R269 PolarHBondContact O-N 3.2Å; R269-I271 VanDerWaalsContact C-N 3.32Å; R269-L272 HydrophobicContact CG-CD1 4.48Å; R269-P273 WeakPolarHBondContact O-CD 3.39Å
270	E	98.6	Very high	98.4	Very high	103 Å²	103	39.9 Å²	39.9	48%	0.481	20%	0.202	S	C	.	.	H	α-helix	trans	-71.5	-29.5	171.3	-65.8	170.5	-134.8	0	0	111.9	R249 A266 L267 A268 Q274	R249-E270 IonicContact CZ-OE1 2.85Å; R249-E270 VanDerWaalsContact CZ-OE1 3.32Å; R249-E270 IonicContact NH1-OE1 3.67Å; R249-E270 PolarHBondContact NH1-OE1 3.39Å; R249-E270 VanDerWaalsContact NH2-CD 3.27Å; R249-E270 IonicContact NH2-OE1 2.82Å; R249-E270 PolarHBondContact NH2-OE1 3.4Å; R249-E270 IonicContact NH2-OE2 3.52Å; R249-E270 PolarHBondContact NH2-OE2 3.1Å; A266-E270 PolarHBondContact O-N 2.92Å; A266-E270 VanDerWaalsContact O-N 3.09Å; L267-E270 WeakPolarHBondContact O-CB 3.48Å; L267-E270 PolarHBondContact O-N 3.21Å; A268-E270 VanDerWaalsContact C-N 3.29Å; A268-E270 PolarHBondContact O-N 3.14Å; E270-Q274 PolarHBondContact O-NE2 3.34Å
271	I	98.6	Very high	98.4	Very high	33 Å²	33	40.8 Å²	40.8	17%	0.169	21%	0.207	C	C	.	.	H	α-helix	trans	-85	-35.6	179.8	-61.9	166.6	0	0	0	111.7	V119 P167 L189 L267 A268 R269 P273 Q274 V279	V119-I271 HydrophobicContact CG2-CB 3.95Å; V119-I271 HydrophobicContact CG2-CG2 3.72Å; P167-I271 HydrophobicContact CB-CD1 4.3Å; P167-I271 HydrophobicContact CG-CG2 4.16Å; L189-I271 HydrophobicContact CD1-CD1 4.02Å; L267-I271 WeakPolarHBondContact O-CG1 3.41Å; L267-I271 PolarHBondContact O-N 3.39Å; A268-I271 PolarHBondContact O-N 2.88Å; A268-I271 VanDerWaalsContact O-N 3.11Å; R269-I271 VanDerWaalsContact C-N 3.32Å; I271-P273 VanDerWaalsContact C-N 3.34Å; I271-Q274 WeakPolarHBondContact O-CB 3.44Å; I271-Q274 WeakPolarHBondContact O-CG 3.42Å; I271-Q274 PolarHBondContact O-N 3.36Å; I271-V279 HydrophobicContact CG2-CG1 4.37Å
272	L	98.1	Very high	98.4	Very high	18 Å²	18	41.6 Å²	41.6	9%	0.094	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.8	-41.4	-176.1	-87.5	-177.9	0	0	0	115.8	I82 R118 A268 R269 Q274	I82-L272 HydrophobicContact CD1-CD1 3.55Å; I82-L272 HydrophobicContact CD1-CG 4.01Å; I82-L272 HydrophobicContact CG1-CD1 3.78Å; I82-L272 HydrophobicContact CG1-CD2 3.91Å; I82-L272 HydrophobicContact CG1-CG 3.89Å; R118-L272 HydrophobicContact CB-CD2 3.88Å; R118-L272 HydrophobicContact CG-CD2 4.44Å; R118-L272 PolarHBondContact NH1-O 2.89Å; A268-L272 WeakPolarHBondContact O-CG 3.32Å; A268-L272 PolarHBondContact O-N 3.31Å; R269-L272 HydrophobicContact CG-CD1 4.48Å; L272-Q274 PolarHBondContact O-N 3.12Å
273	P	97.6	Very high	98.4	Very high	68 Å²	68	38 Å²	38	44%	0.442	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-11.3	-179	-19.4	33.4	0	0	0	113.9	R269 I271 Y329	R269-P273 WeakPolarHBondContact O-CD 3.39Å; I271-P273 VanDerWaalsContact C-N 3.34Å; P273-Y329 WeakPolarHBondContact O-CD2 3.14Å; P273-Y329 WeakPolarHBondContact O-CE2 3.4Å
274	Q	98.4	Very high	98.4	Very high	98 Å²	98	39 Å²	39	46%	0.458	21%	0.209	S	C	.	.	S	Bend	trans	-78.8	156.4	-177.9	-48.5	-47.7	-19.6	0	0	111.9	E270 I271 L272 P276 V279 Y329	E270-Q274 PolarHBondContact O-NE2 3.34Å; I271-Q274 WeakPolarHBondContact O-CB 3.44Å; I271-Q274 WeakPolarHBondContact O-CG 3.42Å; I271-Q274 PolarHBondContact O-N 3.36Å; L272-Q274 PolarHBondContact O-N 3.12Å; Q274-P276 VanDerWaalsContact O-CD 3.3Å; Q274-P276 WeakPolarHBondContact O-CD 3.23Å; Q274-P276 VanDerWaalsContact O-N 3.14Å; Q274-V279 HydrophobicContact CB-CG2 3.63Å; Q274-Y329 VanDerWaalsContact C-CD2 3.49Å
275	A	98.1	Very high	98.4	Very high	14 Å²	14	39.8 Å²	39.8	12%	0.116	22%	0.215	C	C	.	.			trans	-64	112.3	178.1	0	0	0	0	0	110	F277 A278 V279 D313 Y329	A275-F277 VanDerWaalsContact C-N 3.3Å; A275-F277 PolarHBondContact O-N 3.46Å; A275-A278 HydrophobicContact CB-CB 3.99Å; A275-A278 PolarHBondContact O-N 3.1Å; A275-V279 WeakPolarHBondContact O-CG2 3.5Å; A275-V279 PolarHBondContact O-N 3.03Å; A275-D313 HydrophobicContact CB-CB 3.96Å; A275-Y329 VanDerWaalsContact CA-CD2 3.46Å; A275-Y329 HydrophobicContact CB-CD1 3.91Å; A275-Y329 HydrophobicContact CB-CD2 3.84Å; A275-Y329 HydrophobicContact CB-CE1 4.1Å; A275-Y329 HydrophobicContact CB-CE2 4.02Å; A275-Y329 HydrophobicContact CB-CG 3.77Å
276	P	97.1	Very high	98.4	Very high	11 Å²	11	44 Å²	44	7%	0.071	24%	0.237	C	C	.	.	H	α-helix	trans	-64	-35.5	-167.2	24.6	-34.6	0	0	0	112.1	R118 Q274 V279 R280 D313 G331	R118-P276 HydrophobicContact CG-CB 4.3Å; Q274-P276 VanDerWaalsContact O-CD 3.3Å; Q274-P276 WeakPolarHBondContact O-CD 3.23Å; Q274-P276 VanDerWaalsContact O-N 3.14Å; P276-V279 PolarHBondContact O-N 3.41Å; P276-R280 VanDerWaalsContact O-CG 3.24Å; P276-R280 WeakPolarHBondContact O-CG 3.5Å; P276-R280 PolarHBondContact O-N 2.91Å; P276-R280 VanDerWaalsContact O-N 3.07Å; P276-D313 WeakPolarHBondContact CD-OD2 3.22Å; P276-G331 VanDerWaalsContact CG-CA 3.45Å
277	F	97.3	Very high	98.4	Very high	43 Å²	43	45.4 Å²	45.4	19%	0.189	24%	0.24	C	C	.	.	H	α-helix	trans	-65.8	-41	176.1	-169.3	-91.6	0	0	0	112.2	A275 R280 M281 R307 V308 T311	A275-F277 VanDerWaalsContact C-N 3.3Å; A275-F277 PolarHBondContact O-N 3.46Å; F277-R280 PolarHBondContact O-N 3.45Å; F277-M281 HydrophobicContact CD1-CG 3.96Å; F277-M281 HydrophobicContact CE1-CG 3.56Å; F277-M281 HydrophobicContact CE1-SD 4.2Å; F277-M281 HydrophobicContact CZ-CE 4.47Å; F277-M281 HydrophobicContact CZ-CG 4.09Å; F277-M281 HydrophobicContact CZ-SD 4.18Å; F277-M281 WeakPolarHBondContact O-CG 3.29Å; F277-M281 PolarHBondContact O-N 2.81Å; F277-R307 HydrophobicContact CE1-CB 3.85Å; F277-R307 WeakPolarHBondContact CE1-O 3.46Å; F277-R307 HydrophobicContact CZ-CB 4.05Å; F277-V308 HydrophobicContact CD1-CG2 4.23Å; F277-V308 HydrophobicContact CE1-CG2 4.36Å; F277-T311 HydrophobicContact CD1-CG2 3.76Å; F277-T311 HydrophobicContact CE1-CG2 4.16Å; F277-T311 HydrophobicContact CG-CG2 4.32Å
278	A	98.4	Very high	98.4	Very high	34 Å²	34	51 Å²	51	28%	0.281	26%	0.259	S	S	.	.	H	α-helix	trans	-64.8	-41.3	177.3	0	0	0	0	0	111.7	A275 R280 M281 A282 V308	A275-A278 HydrophobicContact CB-CB 3.99Å; A275-A278 PolarHBondContact O-N 3.1Å; A278-R280 PolarHBondContact O-N 2.94Å; A278-M281 PolarHBondContact O-N 2.69Å; A278-A282 WeakPolarHBondContact O-CB 3.48Å; A278-A282 PolarHBondContact O-N 3.15Å; A278-V308 HydrophobicContact CB-CG1 4.13Å; A278-V308 HydrophobicContact CB-CG2 4.37Å
279	V	98.6	Very high	98.4	Very high	35 Å²	35	51.4 Å²	51.4	21%	0.212	26%	0.264	C	S	.	.	H	α-helix	trans	-61.6	-43.3	175.7	175.4	0	0	0	0	111.6	P167 I271 Q274 A275 P276 M281 A282 K283	P167-V279 HydrophobicContact CG-CG1 3.32Å; I271-V279 HydrophobicContact CG2-CG1 4.37Å; Q274-V279 HydrophobicContact CB-CG2 3.63Å; A275-V279 WeakPolarHBondContact O-CG2 3.5Å; A275-V279 PolarHBondContact O-N 3.03Å; P276-V279 PolarHBondContact O-N 3.41Å; V279-M281 VanDerWaalsContact C-N 3.34Å; V279-M281 PolarHBondContact O-N 3.05Å; V279-A282 PolarHBondContact O-N 2.9Å; V279-K283 PolarHBondContact O-N 3.01Å
280	R	98.3	Very high	98.3	Very high	47 Å²	47	51.7 Å²	51.7	18%	0.177	28%	0.276	C	S	.	.	H	α-helix	trans	-60.7	-42.7	175.2	-66.9	172.8	-177	170	6.5	111.6	S115 V117 P165 P276 F277 A278 K283 E284	S115-R280 PolarHBondContact O-NH2 3.19Å; V117-R280 PolarHBondContact O-NH2 2.9Å; P165-R280 HydrophobicContact CB-CG 4.29Å; P165-R280 VanDerWaalsContact O-CG 3.31Å; P165-R280 WeakPolarHBondContact O-CG 3.34Å; P276-R280 VanDerWaalsContact O-CG 3.24Å; P276-R280 WeakPolarHBondContact O-CG 3.5Å; P276-R280 PolarHBondContact O-N 2.91Å; P276-R280 VanDerWaalsContact O-N 3.07Å; F277-R280 PolarHBondContact O-N 3.45Å; A278-R280 PolarHBondContact O-N 2.94Å; R280-K283 PolarHBondContact O-N 3.13Å; R280-E284 PolarHBondContact O-N 2.96Å; R280-E284 VanDerWaalsContact O-N 3.07Å
281	M	98.5	Very high	98.3	Very high	18 Å²	18	51.8 Å²	51.8	9%	0.089	28%	0.276	C	S	.	.	H	α-helix	trans	-68.9	-35.7	177.7	-70.5	-56.8	90.5	0	0	112.4	F277 A278 V279 E284 A285 C304 R307 V308	F277-M281 HydrophobicContact CD1-CG 3.96Å; F277-M281 HydrophobicContact CE1-CG 3.56Å; F277-M281 HydrophobicContact CE1-SD 4.2Å; F277-M281 HydrophobicContact CZ-CE 4.47Å; F277-M281 HydrophobicContact CZ-CG 4.09Å; F277-M281 HydrophobicContact CZ-SD 4.18Å; F277-M281 WeakPolarHBondContact O-CG 3.29Å; F277-M281 PolarHBondContact O-N 2.81Å; A278-M281 PolarHBondContact O-N 2.69Å; V279-M281 VanDerWaalsContact C-N 3.34Å; V279-M281 PolarHBondContact O-N 3.05Å; M281-E284 PolarHBondContact O-N 3.25Å; M281-A285 WeakPolarHBondContact O-CB 3.44Å; M281-A285 PolarHBondContact O-N 2.89Å; M281-C304 HydrophobicContact CB-CB 4.17Å; M281-C304 HydrophobicContact SD-CB 4.48Å; M281-R307 HydrophobicContact SD-CB 4.18Å; M281-V308 HydrophobicContact CB-CG2 3.94Å; M281-V308 HydrophobicContact CG-CG2 3.9Å
282	A	98.8	Very high	98.3	Very high	48 Å²	48	53.4 Å²	53.4	40%	0.397	29%	0.288	S	S	.	.	H	α-helix	trans	-63.3	-45.1	173.8	0	0	0	0	0	111.2	A278 V279 E284 A285 I286	A278-A282 WeakPolarHBondContact O-CB 3.48Å; A278-A282 PolarHBondContact O-N 3.15Å; V279-A282 PolarHBondContact O-N 2.9Å; A282-E284 PolarHBondContact O-N 2.88Å; A282-A285 PolarHBondContact O-N 2.96Å; A282-I286 WeakPolarHBondContact O-CB 3.07Å; A282-I286 WeakPolarHBondContact O-CD1 3.34Å; A282-I286 VanDerWaalsContact O-CG1 3.24Å; A282-I286 WeakPolarHBondContact O-CG1 3.31Å; A282-I286 PolarHBondContact O-N 3.4Å
283	K	98.8	Very high	98.3	Very high	20 Å²	20	57.1 Å²	57.1	9%	0.087	31%	0.308	C	S	.	.	H	α-helix	trans	-58.1	-48.5	174.7	177.2	172.3	176	166.5	0	112	L164 T166 D188 V279 R280 A285 I286 N287	L164-K283 WeakPolarHBondContact O-CE 3.22Å; L164-K283 PolarHBondContact O-NZ 3.4Å; T166-K283 PolarHBondContact O-NZ 3.44Å; D188-K283 VanDerWaalsContact CG-NZ 3.32Å; D188-K283 WeakPolarHBondContact OD1-CE 3.41Å; D188-K283 IonicContact OD1-NZ 3.93Å; D188-K283 PolarHBondContact OD1-NZ 3.24Å; D188-K283 VanDerWaalsContact OD1-NZ 3.15Å; D188-K283 WeakPolarHBondContact OD2-CE 3.29Å; D188-K283 IonicContact OD2-NZ 3.17Å; D188-K283 PolarHBondContact OD2-NZ 3.07Å; V279-K283 PolarHBondContact O-N 3.01Å; R280-K283 PolarHBondContact O-N 3.13Å; K283-A285 PolarHBondContact O-N 3.34Å; K283-I286 PolarHBondContact O-N 3.29Å; K283-N287 VanDerWaalsContact O-CB 3.32Å; K283-N287 WeakPolarHBondContact O-CB 2.94Å; K283-N287 PolarHBondContact O-N 3.3Å
284	E	98.6	Very high	98.4	Very high	71 Å²	71	60 Å²	60	33%	0.332	32%	0.318	S	S	.	.	H	α-helix	trans	-59	-47.4	177.4	176.1	70.7	177.8	0	0	111.8	R280 M281 A282 I286 R288	R280-E284 PolarHBondContact O-N 2.96Å; R280-E284 VanDerWaalsContact O-N 3.07Å; M281-E284 PolarHBondContact O-N 3.25Å; A282-E284 PolarHBondContact O-N 2.88Å; E284-I286 PolarHBondContact O-N 2.87Å; E284-R288 WeakPolarHBondContact O-CB 3.24Å; E284-R288 PolarHBondContact O-N 3.23Å; E284-R288 VanDerWaalsContact O-N 3.09Å; E284-R288 WeakPolarHBondContact OE1-CD 3.44Å; E284-R288 IonicContact OE1-CZ 2.67Å; E284-R288 IonicContact OE1-NE 2.94Å; E284-R288 IonicContact OE1-NH1 2.65Å; E284-R288 PolarHBondContact OE1-NH1 2.98Å
285	A	98.8	Very high	98.4	Very high	15 Å²	15	57.1 Å²	57.1	12%	0.124	31%	0.314	C	S	.	.	H	α-helix	trans	-61.1	-44.9	179.8	0	0	0	0	0	112	M281 A282 K283 G289 C304	M281-A285 WeakPolarHBondContact O-CB 3.44Å; M281-A285 PolarHBondContact O-N 2.89Å; A282-A285 PolarHBondContact O-N 2.96Å; K283-A285 PolarHBondContact O-N 3.34Å; A285-G289 VanDerWaalsContact O-CA 3.31Å; A285-G289 WeakPolarHBondContact O-CA 3.41Å; A285-G289 PolarHBondContact O-N 2.93Å; A285-C304 HydrophobicContact CB-CB 4Å
286	I	98.8	Very high	98.4	Very high	104 Å²	104	58.9 Å²	58.9	53%	0.533	33%	0.326	S	S	.	.	H	α-helix	trans	-64.6	-58.6	177.6	-67.7	164	0	0	0	109.6	A282 K283 E284 R288 G289 V290	A282-I286 WeakPolarHBondContact O-CB 3.07Å; A282-I286 WeakPolarHBondContact O-CD1 3.34Å; A282-I286 VanDerWaalsContact O-CG1 3.24Å; A282-I286 WeakPolarHBondContact O-CG1 3.31Å; A282-I286 PolarHBondContact O-N 3.4Å; K283-I286 PolarHBondContact O-N 3.29Å; E284-I286 PolarHBondContact O-N 2.87Å; I286-R288 VanDerWaalsContact C-N 3.26Å; I286-R288 PolarHBondContact O-N 3.5Å; I286-G289 PolarHBondContact O-N 3.02Å; I286-G289 VanDerWaalsContact O-N 3.12Å; I286-V290 HydrophobicContact CG2-CG1 4.2Å; I286-V290 WeakPolarHBondContact O-CG1 3.32Å; I286-V290 PolarHBondContact O-N 2.99Å
287	N	98.5	Very high	98.5	Very high	63 Å²	63	59.1 Å²	59.1	34%	0.337	33%	0.329	S	S	.	.	H	α-helix	trans	-59	-37.7	-171.2	-76.4	-1.1	0	0	0	112.9	K283	K283-N287 VanDerWaalsContact O-CB 3.32Å; K283-N287 WeakPolarHBondContact O-CB 2.94Å; K283-N287 PolarHBondContact O-N 3.3Å
288	R	98.5	Very high	98.5	Very high	134 Å²	134	62.2 Å²	62.2	51%	0.506	35%	0.345	S	S	.	.	H	α-helix	trans	-84.8	-34.7	177.5	-66.2	179.7	62.8	-171.6	-2.2	112.7	E284 I286 E291 I300	E284-R288 WeakPolarHBondContact O-CB 3.24Å; E284-R288 PolarHBondContact O-N 3.23Å; E284-R288 VanDerWaalsContact O-N 3.09Å; E284-R288 WeakPolarHBondContact OE1-CD 3.44Å; E284-R288 IonicContact OE1-CZ 2.67Å; E284-R288 IonicContact OE1-NE 2.94Å; E284-R288 IonicContact OE1-NH1 2.65Å; E284-R288 PolarHBondContact OE1-NH1 2.98Å; I286-R288 VanDerWaalsContact C-N 3.26Å; I286-R288 PolarHBondContact O-N 3.5Å; R288-E291 PolarHBondContact O-N 3.47Å; R288-I300 HydrophobicContact CB-CD1 4.12Å; R288-I300 HydrophobicContact CB-CG2 4.2Å
289	G	98.6	Very high	98.6	Very high	10 Å²	10	63.1 Å²	63.1	10%	0.103	35%	0.352	C	S	.	.	H	α-helix	trans	-63.7	-38.7	-179.5	0	0	0	0	0	112.8	A285 I286 E291 V292 A297	A285-G289 VanDerWaalsContact O-CA 3.31Å; A285-G289 WeakPolarHBondContact O-CA 3.41Å; A285-G289 PolarHBondContact O-N 2.93Å; I286-G289 PolarHBondContact O-N 3.02Å; I286-G289 VanDerWaalsContact O-N 3.12Å; G289-E291 PolarHBondContact O-N 3.01Å; G289-V292 WeakPolarHBondContact O-CG2 3.43Å; G289-V292 PolarHBondContact O-N 2.78Å; G289-A297 WeakPolarHBondContact O-CB 3.41Å
290	V	97.7	Very high	98.6	Very high	99 Å²	99	62.6 Å²	62.6	60%	0.6	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-17.1	-178.5	-41	0	0	0	0	113.7	I286	I286-V290 HydrophobicContact CG2-CG1 4.2Å; I286-V290 WeakPolarHBondContact O-CG1 3.32Å; I286-V290 PolarHBondContact O-N 2.99Å
291	E	98	Very high	98.6	Very high	104 Å²	104	66.2 Å²	66.2	49%	0.486	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	4.7	-176.4	-60.7	-65	142.2	0	0	112.9	R219 R288 G289	R219-E291 IonicContact CZ-OE1 3.76Å; R219-E291 IonicContact CZ-OE2 3.19Å; R219-E291 IonicContact NE-OE1 2.69Å; R219-E291 PolarHBondContact NE-OE1 3.4Å; R219-E291 IonicContact NE-OE2 3.09Å; R219-E291 IonicContact NH2-OE1 3.31Å; R219-E291 IonicContact NH2-OE2 2.63Å; R219-E291 PolarHBondContact NH2-OE2 2.93Å; R288-E291 PolarHBondContact O-N 3.47Å; G289-E291 PolarHBondContact O-N 3.01Å
292	V	98.6	Very high	98.6	Very high	68 Å²	68	74.9 Å²	74.9	41%	0.412	40%	0.399	S	S	.	.	S	Bend	trans	-132.3	173.8	-179.4	-61.2	0	0	0	0	111.7	G289 A297 I300	G289-V292 WeakPolarHBondContact O-CG2 3.43Å; G289-V292 PolarHBondContact O-N 2.78Å; V292-A297 HydrophobicContact CG2-CB 4.01Å; V292-I300 HydrophobicContact CG2-CD1 3.9Å
293	D	98.5	Very high	98.6	Very high	96 Å²	96	78.4 Å²	78.4	51%	0.513	41%	0.411	S	S	.	.			trans	-66.4	157.7	172.6	75.5	92.9	0	0	0	111.5	G295 S296 A297	D293-G295 PolarHBondContact O-N 3.28Å; D293-G295 VanDerWaalsContact O-N 3.17Å; D293-G295 WeakPolarHBondContact OD1-CA 3.49Å; D293-G295 PolarHBondContact OD1-N 3Å; D293-S296 PolarHBondContact O-N 2.96Å; D293-S296 VanDerWaalsContact O-N 3.15Å; D293-S296 PolarHBondContact OD1-N 3.5Å; D293-S296 VanDerWaalsContact OD1-N 3.11Å; D293-S296 WeakPolarHBondContact OD2-CB 3.43Å; D293-S296 PolarHBondContact OD2-OG 2.9Å; D293-A297 WeakPolarHBondContact O-CB 3.25Å; D293-A297 PolarHBondContact O-N 3.36Å
294	I	98.5	Very high	98.6	Very high	129 Å²	129	78 Å²	78	66%	0.662	41%	0.41	S	S	*	.	H	α-helix	trans	-59.4	-32.2	-174.6	-168	59.2	0	0	0	113.4	A297 M298	I294-A297 PolarHBondContact O-N 3.47Å; I294-M298 HydrophobicContact CG1-CE 4.17Å; I294-M298 WeakPolarHBondContact O-CE 3.29Å; I294-M298 WeakPolarHBondContact O-CG 3.43Å; I294-M298 PolarHBondContact O-N 3.43Å
295	G	98.8	Very high	98.6	Very high	36 Å²	36	82 Å²	82	37%	0.371	42%	0.423	S	S	.	.	H	α-helix	trans	-66.9	-48.7	177.2	0	0	0	0	0	111.5	D293 A297 M298 A299	D293-G295 PolarHBondContact O-N 3.28Å; D293-G295 VanDerWaalsContact O-N 3.17Å; D293-G295 WeakPolarHBondContact OD1-CA 3.49Å; D293-G295 PolarHBondContact OD1-N 3Å; G295-A297 VanDerWaalsContact C-N 3.33Å; G295-A297 PolarHBondContact O-N 3.49Å; G295-M298 PolarHBondContact O-N 3Å; G295-A299 PolarHBondContact O-N 3.32Å
296	S	98.8	Very high	98.6	Very high	51 Å²	51	83.7 Å²	83.7	36%	0.357	44%	0.437	S	S	.	.	H	α-helix	trans	-61.9	-39.1	172.9	-62.6	0	0	0	0	112.2	D293 A299 I300	D293-S296 PolarHBondContact O-N 2.96Å; D293-S296 VanDerWaalsContact O-N 3.15Å; D293-S296 PolarHBondContact OD1-N 3.5Å; D293-S296 VanDerWaalsContact OD1-N 3.11Å; D293-S296 WeakPolarHBondContact OD2-CB 3.43Å; D293-S296 PolarHBondContact OD2-OG 2.9Å; S296-A299 WeakPolarHBondContact O-CB 3.47Å; S296-A299 PolarHBondContact O-N 2.94Å; S296-I300 WeakPolarHBondContact O-CG1 3.47Å; S296-I300 PolarHBondContact O-N 3.05Å
297	A	98.8	Very high	98.5	Very high	16 Å²	16	85.4 Å²	85.4	13%	0.132	44%	0.437	C	S	.	.	H	α-helix	trans	-62.3	-45.8	178.3	0	0	0	0	0	112.1	G289 V292 D293 I294 G295 A299 I300 E301	G289-A297 WeakPolarHBondContact O-CB 3.41Å; V292-A297 HydrophobicContact CG2-CB 4.01Å; D293-A297 WeakPolarHBondContact O-CB 3.25Å; D293-A297 PolarHBondContact O-N 3.36Å; I294-A297 PolarHBondContact O-N 3.47Å; G295-A297 VanDerWaalsContact C-N 3.33Å; G295-A297 PolarHBondContact O-N 3.49Å; A297-A299 VanDerWaalsContact C-N 3.28Å; A297-A299 PolarHBondContact O-N 3.22Å; A297-I300 WeakPolarHBondContact O-CB 3.19Å; A297-I300 PolarHBondContact O-N 3.18Å; A297-I300 VanDerWaalsContact O-N 3.16Å; A297-E301 PolarHBondContact O-N 2.92Å
298	M	98.8	Very high	98.5	Very high	108 Å²	108	83.5 Å²	83.5	53%	0.532	43%	0.428	S	S	.	.	H	α-helix	trans	-64.3	-32.3	175.8	-71	-178	-68.2	0	0	112.4	I294 G295 E301 R302	I294-M298 HydrophobicContact CG1-CE 4.17Å; I294-M298 WeakPolarHBondContact O-CE 3.29Å; I294-M298 WeakPolarHBondContact O-CG 3.43Å; I294-M298 PolarHBondContact O-N 3.43Å; G295-M298 PolarHBondContact O-N 3Å; M298-E301 PolarHBondContact O-N 2.83Å; M298-R302 WeakPolarHBondContact O-CB 3.22Å; M298-R302 PolarHBondContact O-N 3.36Å
299	A	98.8	Very high	98.5	Very high	53 Å²	53	81.2 Å²	81.2	44%	0.438	42%	0.424	S	S	.	.	H	α-helix	trans	-66.9	-41.4	172.9	0	0	0	0	0	111.9	G295 S296 A297 R302 L303	G295-A299 PolarHBondContact O-N 3.32Å; S296-A299 WeakPolarHBondContact O-CB 3.47Å; S296-A299 PolarHBondContact O-N 2.94Å; A297-A299 VanDerWaalsContact C-N 3.28Å; A297-A299 PolarHBondContact O-N 3.22Å; A299-R302 PolarHBondContact O-N 3.19Å; A299-L303 WeakPolarHBondContact O-CG 3.4Å; A299-L303 PolarHBondContact O-N 3.15Å; A299-L303 VanDerWaalsContact O-N 3.1Å
300	I	98.8	Very high	98.5	Very high	24 Å²	24	85.2 Å²	85.2	12%	0.123	45%	0.449	C	S	.	.	H	α-helix	trans	-61.9	-46.1	173.6	-67.4	164.7	0	0	0	110.6	R288 V292 S296 A297 R302 L303 C304	R288-I300 HydrophobicContact CB-CD1 4.12Å; R288-I300 HydrophobicContact CB-CG2 4.2Å; V292-I300 HydrophobicContact CG2-CD1 3.9Å; S296-I300 WeakPolarHBondContact O-CG1 3.47Å; S296-I300 PolarHBondContact O-N 3.05Å; A297-I300 WeakPolarHBondContact O-CB 3.19Å; A297-I300 PolarHBondContact O-N 3.18Å; A297-I300 VanDerWaalsContact O-N 3.16Å; I300-R302 VanDerWaalsContact C-N 3.35Å; I300-R302 PolarHBondContact O-N 3.36Å; I300-L303 PolarHBondContact O-N 2.96Å; I300-C304 PolarHBondContact O-N 2.75Å; I300-C304 PolarHBondContact O-SG 3.46Å
301	E	98.8	Very high	98.5	Very high	124 Å²	124	81 Å²	81	58%	0.579	42%	0.423	S	S	*	.	H	α-helix	trans	-56.8	-48.3	176.5	-175.9	-174.8	98.7	0	0	111.1	A297 M298 L303 C304 Y305	A297-E301 PolarHBondContact O-N 2.92Å; M298-E301 PolarHBondContact O-N 2.83Å; E301-L303 VanDerWaalsContact C-N 3.3Å; E301-L303 PolarHBondContact O-N 3.47Å; E301-C304 PolarHBondContact O-N 3.25Å; E301-C304 VanDerWaalsContact O-N 3.17Å; E301-Y305 WeakPolarHBondContact O-CB 3.41Å; E301-Y305 PolarHBondContact O-N 3.26Å
302	R	98.8	Very high	98.5	Very high	200 Å²	200	83.5 Å²	83.5	76%	0.755	43%	0.428	S	S	*	.	H	α-helix	trans	-55.9	-43.3	176.4	177.4	-178	170.5	130	-0.1	112.2	M298 A299 I300 Y305 A306	M298-R302 WeakPolarHBondContact O-CB 3.22Å; M298-R302 PolarHBondContact O-N 3.36Å; A299-R302 PolarHBondContact O-N 3.19Å; I300-R302 VanDerWaalsContact C-N 3.35Å; I300-R302 PolarHBondContact O-N 3.36Å; R302-Y305 PolarHBondContact O-N 2.85Å; R302-A306 WeakPolarHBondContact O-CB 3.27Å; R302-A306 PolarHBondContact O-N 3.03Å
303	L	98.6	Very high	98.5	Very high	122 Å²	122	80.5 Å²	80.5	64%	0.639	41%	0.409	S	S	*	.	H	α-helix	trans	-66	-42.1	178.6	-69.9	172.2	0	0	0	111.8	A299 I300 E301 A306 R307	A299-L303 WeakPolarHBondContact O-CG 3.4Å; A299-L303 PolarHBondContact O-N 3.15Å; A299-L303 VanDerWaalsContact O-N 3.1Å; I300-L303 PolarHBondContact O-N 2.96Å; E301-L303 VanDerWaalsContact C-N 3.3Å; E301-L303 PolarHBondContact O-N 3.47Å; L303-A306 PolarHBondContact O-N 3.16Å; L303-R307 PolarHBondContact O-N 2.87Å
304	C	98.6	Very high	98.5	Very high	12 Å²	12	80.6 Å²	80.6	8%	0.081	40%	0.403	C	S	.	.	H	α-helix	trans	-63.6	-45.7	175.7	-65.2	0	0	0	0	111	M281 A285 I300 E301 A306 R307	M281-C304 HydrophobicContact CB-CB 4.17Å; M281-C304 HydrophobicContact SD-CB 4.48Å; A285-C304 HydrophobicContact CB-CB 4Å; I300-C304 PolarHBondContact O-N 2.75Å; I300-C304 PolarHBondContact O-SG 3.46Å; E301-C304 PolarHBondContact O-N 3.25Å; E301-C304 VanDerWaalsContact O-N 3.17Å; C304-A306 PolarHBondContact O-N 3.34Å; C304-R307 WeakPolarHBondContact O-CB 3.21Å; C304-R307 PolarHBondContact O-N 2.89Å
305	Y	98.6	Very high	98.5	Very high	154 Å²	154	79.8 Å²	79.8	60%	0.604	40%	0.396	S	S	*	.	H	α-helix	trans	-62.9	-41.2	178.3	-165	-84.3	0	0	0	112.1	E301 R302 R307 V308 I309	E301-Y305 WeakPolarHBondContact O-CB 3.41Å; E301-Y305 PolarHBondContact O-N 3.26Å; R302-Y305 PolarHBondContact O-N 2.85Å; Y305-R307 PolarHBondContact O-N 3.47Å; Y305-R307 VanDerWaalsContact O-N 3.14Å; Y305-V308 WeakPolarHBondContact O-CA 3.49Å; Y305-V308 WeakPolarHBondContact O-CB 3.32Å; Y305-V308 PolarHBondContact O-N 3.41Å; Y305-I309 HydrophobicContact CD1-CD1 3.97Å; Y305-I309 HydrophobicContact CD1-CG1 3.92Å; Y305-I309 HydrophobicContact CE1-CD1 4.07Å; Y305-I309 HydrophobicContact CE1-CG1 3.84Å; Y305-I309 PolarHBondContact O-N 3.22Å
306	A	98.6	Very high	98.5	Very high	50 Å²	50	79.9 Å²	79.9	41%	0.413	39%	0.387	S	S	.	.	H	α-helix	trans	-57.1	-30.5	177.4	0	0	0	0	0	112.9	R302 L303 C304 P310	R302-A306 WeakPolarHBondContact O-CB 3.27Å; R302-A306 PolarHBondContact O-N 3.03Å; L303-A306 PolarHBondContact O-N 3.16Å; C304-A306 PolarHBondContact O-N 3.34Å; A306-P310 WeakPolarHBondContact O-CD 3.43Å
307	R	98.1	Very high	98.4	Very high	140 Å²	140	77.9 Å²	77.9	53%	0.528	38%	0.375	S	S	.	.	H	α-helix	trans	-74.7	-24.4	175.1	-63.5	177.5	66	-172.9	1.8	113.4	F277 M281 L303 C304 Y305 P310	F277-R307 HydrophobicContact CE1-CB 3.85Å; F277-R307 WeakPolarHBondContact CE1-O 3.46Å; F277-R307 HydrophobicContact CZ-CB 4.05Å; M281-R307 HydrophobicContact SD-CB 4.18Å; L303-R307 PolarHBondContact O-N 2.87Å; C304-R307 WeakPolarHBondContact O-CB 3.21Å; C304-R307 PolarHBondContact O-N 2.89Å; Y305-R307 PolarHBondContact O-N 3.47Å; Y305-R307 VanDerWaalsContact O-N 3.14Å; R307-P310 WeakPolarHBondContact O-CD 3.32Å
308	V	97.9	Very high	98.4	Very high	24 Å²	24	82.1 Å²	82.1	15%	0.145	39%	0.393	C	S	.	.	H	α-helix	trans	-79.8	-29.9	176.9	-178.5	0	0	0	0	111.4	F277 A278 M281 Y305 T311	F277-V308 HydrophobicContact CD1-CG2 4.23Å; F277-V308 HydrophobicContact CE1-CG2 4.36Å; A278-V308 HydrophobicContact CB-CG1 4.13Å; A278-V308 HydrophobicContact CB-CG2 4.37Å; M281-V308 HydrophobicContact CB-CG2 3.94Å; M281-V308 HydrophobicContact CG-CG2 3.9Å; Y305-V308 WeakPolarHBondContact O-CA 3.49Å; Y305-V308 WeakPolarHBondContact O-CB 3.32Å; Y305-V308 PolarHBondContact O-N 3.41Å; V308-T311 PolarHBondContact O-N 2.88Å; V308-T311 PolarHBondContact O-OG1 3.12Å
309	I	98.3	Very high	98.4	Very high	85 Å²	85	78.3 Å²	78.3	44%	0.436	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-47.9	-178.9	-65.1	174.2	0	0	0	114	Y305 T311 R314	Y305-I309 HydrophobicContact CD1-CD1 3.97Å; Y305-I309 HydrophobicContact CD1-CG1 3.92Å; Y305-I309 HydrophobicContact CE1-CD1 4.07Å; Y305-I309 HydrophobicContact CE1-CG1 3.84Å; Y305-I309 PolarHBondContact O-N 3.22Å; I309-T311 VanDerWaalsContact C-N 3.3Å; I309-T311 PolarHBondContact O-N 3.3Å; I309-R314 WeakPolarHBondContact O-CD 3.35Å; I309-R314 PolarHBondContact O-NE 3.27Å
310	P	98.1	Very high	98.4	Very high	95 Å²	95	75.9 Å²	75.9	62%	0.617	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	1.2	-175.8	33	-37.8	0	0	0	114.8	A306 R307	A306-P310 WeakPolarHBondContact O-CD 3.43Å; R307-P310 WeakPolarHBondContact O-CD 3.32Å
311	T	98.3	Very high	98.4	Very high	9 Å²	9	82.7 Å²	82.7	6%	0.055	39%	0.388	C	S	.	.			trans	-74.8	152.1	-173.3	68.2	0	0	0	0	112.9	F277 V308 I309 D313 R314 E332	F277-T311 HydrophobicContact CD1-CG2 3.76Å; F277-T311 HydrophobicContact CE1-CG2 4.16Å; F277-T311 HydrophobicContact CG-CG2 4.32Å; V308-T311 PolarHBondContact O-N 2.88Å; V308-T311 PolarHBondContact O-OG1 3.12Å; I309-T311 VanDerWaalsContact C-N 3.3Å; I309-T311 PolarHBondContact O-N 3.3Å; T311-D313 VanDerWaalsContact C-N 3.31Å; T311-R314 PolarHBondContact O-N 2.92Å; T311-R314 PolarHBondContact OG1-N 3.43Å; T311-E332 WeakPolarHBondContact CA-OXT 3.33Å; T311-E332 WeakPolarHBondContact CB-O 3.43Å; T311-E332 WeakPolarHBondContact CB-OXT 3.43Å
312	R	98.1	Very high	98.3	Very high	158 Å²	158	83.1 Å²	83.1	60%	0.596	39%	0.393	S	S	*	.	H	α-helix	trans	-66.3	-37.3	171.3	-65	179.5	169.2	178.7	-6.8	110.8	R314 Q315 E316 E332	R312-R314 VanDerWaalsContact C-N 3.26Å; R312-R314 PolarHBondContact O-N 3.21Å; R312-Q315 WeakPolarHBondContact O-CB 3.34Å; R312-Q315 PolarHBondContact O-N 2.75Å; R312-E316 WeakPolarHBondContact O-CB 3.33Å; R312-E316 PolarHBondContact O-N 2.92Å; R312-E332 CarbonylContact C-O 3.53Å; R312-E332 WeakPolarHBondContact CA-O 3.33Å; R312-E332 HydrophobicContact CB-CB 4.34Å; R312-E332 WeakPolarHBondContact CB-O 3.35Å; R312-E332 HydrophobicContact CG-CB 4.39Å; R312-E332 IonicContact CZ-OE2 2.83Å; R312-E332 VanDerWaalsContact N-C 3.32Å; R312-E332 PolarHBondContact N-O 3.29Å; R312-E332 PolarHBondContact N-OXT 2.94Å; R312-E332 VanDerWaalsContact N-OXT 3.15Å; R312-E332 IonicContact NE-OE2 2.71Å; R312-E332 IonicContact NH1-OE2 3.15Å; R312-E332 PolarHBondContact NH1-OE2 3.3Å
313	D	98.1	Very high	98.3	Very high	4 Å²	4	79.2 Å²	79.2	2%	0.021	38%	0.383	C	S	.	.	H	α-helix	trans	-56.6	-39.5	175.9	-79.5	-11.4	0	0	0	112	A275 P276 T311 Q315 E316 G317 Y329 T330 G331 E332	A275-D313 HydrophobicContact CB-CB 3.96Å; P276-D313 WeakPolarHBondContact CD-OD2 3.22Å; T311-D313 VanDerWaalsContact C-N 3.31Å; D313-Q315 PolarHBondContact O-N 3.22Å; D313-E316 PolarHBondContact O-N 3.26Å; D313-G317 PolarHBondContact O-N 3.11Å; D313-Y329 HydrophobicContact CB-CD1 3.69Å; D313-Y329 HydrophobicContact CB-CE1 4.33Å; D313-Y329 HydrophobicContact CB-CG 4.42Å; D313-Y329 WeakPolarHBondContact O-CE1 3.34Å; D313-Y329 WeakPolarHBondContact OD1-CA 3.47Å; D313-Y329 WeakPolarHBondContact OD1-CB 3.35Å; D313-T330 PolarHBondContact OD1-N 3.31Å; D313-G331 PolarHBondContact OD1-N 2.83Å; D313-G331 WeakPolarHBondContact OD2-CA 3.41Å; D313-G331 PolarHBondContact OD2-N 3.41Å; D313-E332 PolarHBondContact N-O 3.35Å
314	R	98.3	Very high	98.3	Very high	99 Å²	99	82.9 Å²	82.9	37%	0.374	39%	0.393	S	S	.	.	H	α-helix	trans	-63.3	-44.4	175.6	-172.2	-161.3	64.4	78.5	1.1	111.2	I309 T311 R312 G317 M318	I309-R314 WeakPolarHBondContact O-CD 3.35Å; I309-R314 PolarHBondContact O-NE 3.27Å; T311-R314 PolarHBondContact O-N 2.92Å; T311-R314 PolarHBondContact OG1-N 3.43Å; R312-R314 VanDerWaalsContact C-N 3.26Å; R312-R314 PolarHBondContact O-N 3.21Å; R314-G317 PolarHBondContact O-N 2.89Å; R314-M318 WeakPolarHBondContact O-CG 3.14Å; R314-M318 PolarHBondContact O-N 3.41Å; R314-M318 VanDerWaalsContact O-N 3.13Å
315	Q	98.1	Very high	98.3	Very high	111 Å²	111	86.7 Å²	86.7	52%	0.519	41%	0.406	S	S	.	.	H	α-helix	trans	-63	-45.4	179.5	-60.4	175.6	15.6	0	0	111	R312 D313 G317 M318 A319	R312-Q315 WeakPolarHBondContact O-CB 3.34Å; R312-Q315 PolarHBondContact O-N 2.75Å; D313-Q315 PolarHBondContact O-N 3.22Å; Q315-G317 VanDerWaalsContact C-N 3.34Å; Q315-G317 PolarHBondContact O-N 2.75Å; Q315-M318 PolarHBondContact O-N 2.89Å; Q315-A319 WeakPolarHBondContact O-CB 3.5Å; Q315-A319 PolarHBondContact O-N 2.94Å
316	E	98.5	Very high	98.2	Very high	38 Å²	38	86.8 Å²	86.8	18%	0.178	41%	0.412	C	S	.	.	H	α-helix	trans	-60	-41.7	174.8	166.5	57.1	-171.3	0	0	112	R312 D313 M318 A319 A320 R325 P327 R328 Y329	R312-E316 WeakPolarHBondContact O-CB 3.33Å; R312-E316 PolarHBondContact O-N 2.92Å; D313-E316 PolarHBondContact O-N 3.26Å; E316-M318 VanDerWaalsContact C-N 3.33Å; E316-M318 PolarHBondContact O-N 3.45Å; E316-A319 PolarHBondContact O-N 3.26Å; E316-A320 VanDerWaalsContact O-CB 3.22Å; E316-A320 WeakPolarHBondContact O-CB 3.49Å; E316-A320 PolarHBondContact O-N 3.44Å; E316-R325 IonicContact OE1-CZ 3.49Å; E316-R325 IonicContact OE1-NH1 3.56Å; E316-R325 PolarHBondContact OE1-NH1 2.9Å; E316-R325 IonicContact OE1-NH2 3.46Å; E316-R325 PolarHBondContact OE1-NH2 2.86Å; E316-R325 IonicContact OE2-CZ 3.61Å; E316-R325 IonicContact OE2-NH1 2.73Å; E316-R325 IonicContact OE2-NH2 3.7Å; E316-R325 PolarHBondContact OE2-NH2 3.01Å; E316-P327 HydrophobicContact CG-CB 4.33Å; E316-P327 WeakPolarHBondContact OE1-CA 3.42Å; E316-R328 PolarHBondContact OE1-N 3.18Å; E316-Y329 HydrophobicContact CG-CD1 4.16Å; E316-Y329 HydrophobicContact CG-CE1 4.22Å
317	G	98.2	Very high	98.2	Very high	10 Å²	10	86.1 Å²	86.1	10%	0.103	40%	0.404	C	S	.	.	H	α-helix	trans	-60.2	-41.8	175.6	0	0	0	0	0	112.6	D313 R314 Q315 F321	D313-G317 PolarHBondContact O-N 3.11Å; R314-G317 PolarHBondContact O-N 2.89Å; Q315-G317 VanDerWaalsContact C-N 3.34Å; Q315-G317 PolarHBondContact O-N 2.75Å; G317-F321 WeakPolarHBondContact O-CB 3.43Å; G317-F321 PolarHBondContact O-N 3.31Å; G317-F321 VanDerWaalsContact O-N 3.15Å
318	M	98.3	Very high	98.1	Very high	104 Å²	104	89.4 Å²	89.4	51%	0.512	42%	0.416	S	S	.	.	H	α-helix	trans	-68.3	-43.1	175.9	-60.5	-62.2	94.2	0	0	111.7	R314 Q315 E316 F321 I322	R314-M318 WeakPolarHBondContact O-CG 3.14Å; R314-M318 PolarHBondContact O-N 3.41Å; R314-M318 VanDerWaalsContact O-N 3.13Å; Q315-M318 PolarHBondContact O-N 2.89Å; E316-M318 VanDerWaalsContact C-N 3.33Å; E316-M318 PolarHBondContact O-N 3.45Å; M318-F321 PolarHBondContact O-N 3.05Å; M318-I322 WeakPolarHBondContact O-CG1 3.27Å; M318-I322 PolarHBondContact O-N 3.47Å; M318-I322 VanDerWaalsContact O-N 3.11Å
319	A	98.5	Very high	98.1	Very high	28 Å²	28	90.3 Å²	90.3	23%	0.231	42%	0.417	C	S	.	.	H	α-helix	trans	-62.3	-48.9	177.9	0	0	0	0	0	111.6	Q315 E316 F321 I322 E323	Q315-A319 WeakPolarHBondContact O-CB 3.5Å; Q315-A319 PolarHBondContact O-N 2.94Å; E316-A319 PolarHBondContact O-N 3.26Å; A319-F321 VanDerWaalsContact C-N 3.29Å; A319-F321 PolarHBondContact O-N 3.1Å; A319-I322 PolarHBondContact O-N 2.86Å; A319-E323 WeakPolarHBondContact O-CB 3.42Å; A319-E323 WeakPolarHBondContact O-CG 3.38Å; A319-E323 PolarHBondContact O-N 2.82Å
320	A	98.5	Very high	97.9	Very high	2 Å²	2	90.4 Å²	90.4	2%	0.017	42%	0.422	C	S	.	.	H	α-helix	trans	-60.1	-37.4	178.3	0	0	0	0	0	112.7	E316 K324 R325 P327	E316-A320 VanDerWaalsContact O-CB 3.22Å; E316-A320 WeakPolarHBondContact O-CB 3.49Å; E316-A320 PolarHBondContact O-N 3.44Å; A320-K324 WeakPolarHBondContact O-CA 3.49Å; A320-K324 PolarHBondContact O-N 2.85Å; A320-R325 HydrophobicContact CB-CG 4.12Å; A320-R325 PolarHBondContact O-N 3.36Å; A320-P327 HydrophobicContact CB-CB 3.76Å
321	F	98.3	Very high	97.6	Very high	168 Å²	168	87.1 Å²	87.1	74%	0.737	41%	0.405	S	S	*	.	H	α-helix	trans	-63.6	-47.5	174.2	177.9	-97.6	0	0	0	112.1	G317 M318 A319 E323 K324	G317-F321 WeakPolarHBondContact O-CB 3.43Å; G317-F321 PolarHBondContact O-N 3.31Å; G317-F321 VanDerWaalsContact O-N 3.15Å; M318-F321 PolarHBondContact O-N 3.05Å; A319-F321 VanDerWaalsContact C-N 3.29Å; A319-F321 PolarHBondContact O-N 3.1Å; F321-E323 VanDerWaalsContact C-N 3.33Å; F321-E323 PolarHBondContact O-N 2.91Å; F321-K324 PolarHBondContact O-N 3.25Å
322	I	98.5	Very high	97.3	Very high	133 Å²	133	92.3 Å²	92.3	68%	0.682	43%	0.429	S	S	*	.	H	α-helix	trans	-62.4	-43.1	177.8	-67.8	165.6	0	0	0	110.6	M318 A319 K324	M318-I322 WeakPolarHBondContact O-CG1 3.27Å; M318-I322 PolarHBondContact O-N 3.47Å; M318-I322 VanDerWaalsContact O-N 3.11Å; A319-I322 PolarHBondContact O-N 2.86Å; I322-K324 VanDerWaalsContact C-N 3.3Å; I322-K324 PolarHBondContact O-N 2.94Å
323	E	98.4	Very high	97.2	Very high	118 Å²	118	89.1 Å²	89.1	55%	0.551	42%	0.42	S	S	*	.	H	α-helix	trans	-81.6	-4.4	-177.9	-67.1	170	-151.9	0	0	113.7	A319 F321 R325	A319-E323 WeakPolarHBondContact O-CB 3.42Å; A319-E323 WeakPolarHBondContact O-CG 3.38Å; A319-E323 PolarHBondContact O-N 2.82Å; F321-E323 VanDerWaalsContact C-N 3.33Å; F321-E323 PolarHBondContact O-N 2.91Å; E323-R325 VanDerWaalsContact C-N 3.31Å; E323-R325 HydrophobicContact CB-CG 4.06Å; E323-R325 PolarHBondContact O-N 2.93Å; E323-R325 WeakPolarHBondContact OE2-CD 3.26Å; E323-R325 IonicContact OE2-CZ 3.51Å; E323-R325 IonicContact OE2-NE 2.68Å; E323-R325 PolarHBondContact OE2-NE 2.86Å; E323-R325 IonicContact OE2-NH2 3.5Å; E323-R325 PolarHBondContact OE2-NH2 2.85Å
324	K	98.1	Very high	97.2	Very high	198 Å²	198	93.5 Å²	93.5	86%	0.861	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.2	41.7	-178.1	-55.1	-178	-178.9	178.4	0	113.8	A320 F321 I322	A320-K324 WeakPolarHBondContact O-CA 3.49Å; A320-K324 PolarHBondContact O-N 2.85Å; F321-K324 PolarHBondContact O-N 3.25Å; I322-K324 VanDerWaalsContact C-N 3.3Å; I322-K324 PolarHBondContact O-N 2.94Å
325	R	98.3	Very high	97.1	Very high	92 Å²	92	93.2 Å²	93.2	35%	0.347	45%	0.445	S	S	.	.	S	Bend	trans	-119.8	166.5	175.8	62.4	173.9	178.4	75.3	2.1	111.2	E316 A320 E323	E316-R325 IonicContact OE1-CZ 3.49Å; E316-R325 IonicContact OE1-NH1 3.56Å; E316-R325 PolarHBondContact OE1-NH1 2.9Å; E316-R325 IonicContact OE1-NH2 3.46Å; E316-R325 PolarHBondContact OE1-NH2 2.86Å; E316-R325 IonicContact OE2-CZ 3.61Å; E316-R325 IonicContact OE2-NH1 2.73Å; E316-R325 IonicContact OE2-NH2 3.7Å; E316-R325 PolarHBondContact OE2-NH2 3.01Å; A320-R325 HydrophobicContact CB-CG 4.12Å; A320-R325 PolarHBondContact O-N 3.36Å; E323-R325 VanDerWaalsContact C-N 3.31Å; E323-R325 HydrophobicContact CB-CG 4.06Å; E323-R325 PolarHBondContact O-N 2.93Å; E323-R325 WeakPolarHBondContact OE2-CD 3.26Å; E323-R325 IonicContact OE2-CZ 3.51Å; E323-R325 IonicContact OE2-NE 2.68Å; E323-R325 PolarHBondContact OE2-NE 2.86Å; E323-R325 IonicContact OE2-NH2 3.5Å; E323-R325 PolarHBondContact OE2-NH2 2.85Å
326	Q	96.7	Very high	97.1	Very high	156 Å²	156	92.2 Å²	92.2	73%	0.729	44%	0.441	S	S	*	.			trans	-69.3	135.1	170.8	-69.1	-64.8	-25.7	0	0	110.2
327	P	97.7	Very high	97	Very high	36 Å²	36	95.6 Å²	95.6	23%	0.234	46%	0.457	C	S	.	.			trans	-72	152.7	176.7	30.2	-34.4	0	0	0	111.5	E316 A320 Y329	E316-P327 HydrophobicContact CG-CB 4.33Å; E316-P327 WeakPolarHBondContact OE1-CA 3.42Å; A320-P327 HydrophobicContact CB-CB 3.76Å; P327-Y329 HydrophobicContact CB-CD1 4.35Å; P327-Y329 HydrophobicContact CB-CD2 4.37Å; P327-Y329 HydrophobicContact CB-CE1 3.72Å; P327-Y329 HydrophobicContact CB-CE2 3.76Å; P327-Y329 VanDerWaalsContact CB-CZ 3.4Å; P327-Y329 HydrophobicContact CG-CD2 4.34Å; P327-Y329 HydrophobicContact CG-CE1 4.35Å; P327-Y329 HydrophobicContact CG-CE2 3.52Å; P327-Y329 WeakPolarHBondContact CG-OH 3.49Å
328	R	96.9	Very high	96.9	Very high	209 Å²	209	101.3 Å²	101.3	79%	0.789	48%	0.481	S	S	*	.			trans	-120.2	84.6	177.1	-65.8	-176.2	179.6	-176.7	0.7	110.4	E316	E316-R328 PolarHBondContact OE1-N 3.18Å
329	Y	97.8	Very high	96.8	Very high	44 Å²	44	101.1 Å²	101.1	17%	0.173	48%	0.479	C	S	.	.			trans	-79	138.2	-179.1	-56.7	-53.1	0	0	0	113.1	R118 P273 Q274 A275 D313 E316 P327	R118-Y329 PolarHBondContact NH2-O 2.86Å; P273-Y329 WeakPolarHBondContact O-CD2 3.14Å; P273-Y329 WeakPolarHBondContact O-CE2 3.4Å; Q274-Y329 VanDerWaalsContact C-CD2 3.49Å; A275-Y329 VanDerWaalsContact CA-CD2 3.46Å; A275-Y329 HydrophobicContact CB-CD1 3.91Å; A275-Y329 HydrophobicContact CB-CD2 3.84Å; A275-Y329 HydrophobicContact CB-CE1 4.1Å; A275-Y329 HydrophobicContact CB-CE2 4.02Å; A275-Y329 HydrophobicContact CB-CG 3.77Å; D313-Y329 HydrophobicContact CB-CD1 3.69Å; D313-Y329 HydrophobicContact CB-CE1 4.33Å; D313-Y329 HydrophobicContact CB-CG 4.42Å; D313-Y329 WeakPolarHBondContact O-CE1 3.34Å; D313-Y329 WeakPolarHBondContact OD1-CA 3.47Å; D313-Y329 WeakPolarHBondContact OD1-CB 3.35Å; E316-Y329 HydrophobicContact CG-CD1 4.16Å; E316-Y329 HydrophobicContact CG-CE1 4.22Å; P327-Y329 HydrophobicContact CB-CD1 4.35Å; P327-Y329 HydrophobicContact CB-CD2 4.37Å; P327-Y329 HydrophobicContact CB-CE1 3.72Å; P327-Y329 HydrophobicContact CB-CE2 3.76Å; P327-Y329 VanDerWaalsContact CB-CZ 3.4Å; P327-Y329 HydrophobicContact CG-CD2 4.34Å; P327-Y329 HydrophobicContact CG-CE1 4.35Å; P327-Y329 HydrophobicContact CG-CE2 3.52Å; P327-Y329 WeakPolarHBondContact CG-OH 3.49Å
330	T	94.3	Very high	96.6	Very high	86 Å²	86	106.7 Å²	106.7	53%	0.528	50%	0.498	S	S	.	.			trans	-111.3	-16.6	179.2	57.3	0	0	0	0	113	D313	D313-T330 PolarHBondContact OD1-N 3.31Å
331	G	92.6	Very high	96.5	Very high	26 Å²	26	115.4 Å²	115.4	27%	0.268	54%	0.538	S	S	.	.			trans	86.7	24.2	-175.3	0	0	0	0	0	114.6	P276 D313	P276-G331 VanDerWaalsContact CG-CA 3.45Å; D313-G331 PolarHBondContact OD1-N 2.83Å; D313-G331 WeakPolarHBondContact OD2-CA 3.41Å; D313-G331 PolarHBondContact OD2-N 3.41Å
332	E	90.2	Very high	96.3	Very high	119 Å²	119	110.6 Å²	110.6	56%	0.556	52%	0.52	S	S	*	.			trans	-116.7	0	177	-61.6	173.3	-158.4	0	0	110.8	T311 R312 D313	T311-E332 WeakPolarHBondContact CA-OXT 3.33Å; T311-E332 WeakPolarHBondContact CB-O 3.43Å; T311-E332 WeakPolarHBondContact CB-OXT 3.43Å; R312-E332 CarbonylContact C-O 3.53Å; R312-E332 WeakPolarHBondContact CA-O 3.33Å; R312-E332 HydrophobicContact CB-CB 4.34Å; R312-E332 WeakPolarHBondContact CB-O 3.35Å; R312-E332 HydrophobicContact CG-CB 4.39Å; R312-E332 IonicContact CZ-OE2 2.83Å; R312-E332 VanDerWaalsContact N-C 3.32Å; R312-E332 PolarHBondContact N-O 3.29Å; R312-E332 PolarHBondContact N-OXT 2.94Å; R312-E332 VanDerWaalsContact N-OXT 3.15Å; R312-E332 IonicContact NE-OE2 2.71Å; R312-E332 IonicContact NH1-OE2 3.15Å; R312-E332 PolarHBondContact NH1-OE2 3.3Å; D313-E332 PolarHBondContact N-O 3.35Å

Retrieved 332 of 332 residues in 72.3 ms (Link to these results)

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