A0A087X2M7_POEFO Loading...

Dihydrouridine synthase 2

AlphaFold DB , UniProt , Accession A0A087X2M7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 541 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.9	Very low	33.6	Very low	232 Å²	232	157.5 Å²	157.5	100%	1.143	82%	0.819	S	S	*	*				0	142	0	-76.6	-151.4	177.3	0	0	108.3
2	P	50.6	Low	33.2	Very low	122 Å²	122	159.7 Å²	159.7	79%	0.792	82%	0.817	S	S	*	*			cis	-97.8	126.6	-1.4	34.9	-24.7	0	0	0	109.7
3	A	30.4	Very low	32.9	Very low	87 Å²	87	158.5 Å²	158.5	72%	0.719	82%	0.822	S	S	*	*				50.8	118.1	72.8	0	0	0	0	0	110.6
4	A	35.2	Very low	32.5	Very low	102 Å²	102	160.4 Å²	160.4	84%	0.843	82%	0.821	S	S	*	*			cis	-153.2	138.7	43.3	0	0	0	0	0	113.4
5	N	30.4	Very low	32.4	Very low	141 Å²	141	155.3 Å²	155.3	75%	0.754	81%	0.805	S	S	*	*			trans	-77.1	128.9	165.7	-171.8	4.1	0	0	0	109
6	K	36.1	Very low	32.5	Very low	211 Å²	211	153.2 Å²	153.2	92%	0.917	81%	0.805	S	S	*	*			trans	-146	88.5	151.1	-92.9	-170.8	-175.9	175.2	0	110.6
7	N	28.9	Very low	32.3	Very low	142 Å²	142	154.2 Å²	154.2	76%	0.759	80%	0.803	S	S	*	*			trans	-64.5	144.1	155.6	-119.7	-26	0	0	0	111
8	Q	31	Very low	32.3	Very low	157 Å²	157	156.1 Å²	156.1	73%	0.734	81%	0.808	S	S	*	*			trans	153.3	130.1	144.4	-84.9	-175.2	48.7	0	0	108.3
9	K	30.1	Very low	32.3	Very low	149 Å²	149	157.3 Å²	157.3	65%	0.648	81%	0.809	S	S	*	*			cis	-168.8	139.5	8.9	-111.8	162.3	-178.5	161	0	108.7
10	K	29.8	Very low	32.1	Very low	188 Å²	188	155.9 Å²	155.9	82%	0.817	81%	0.808	S	S	*	*			trans	55.3	129.9	140	-60.8	179	176.6	-174.2	0	118.3
11	K	29.4	Very low	32	Very low	202 Å²	202	154.4 Å²	154.4	88%	0.878	81%	0.805	S	S	*	*			cis	-148.3	148.3	43.4	-81.3	178.3	172.8	174.8	0	112.1
12	K	28.8	Very low	31.7	Very low	183 Å²	183	151.2 Å²	151.2	80%	0.796	79%	0.788	S	S	*	*			trans	-71.1	138.6	175.1	-67.2	174.8	172.3	-177.6	0	111.4
13	T	28.9	Very low	30.7	Very low	144 Å²	144	153.7 Å²	153.7	88%	0.883	79%	0.793	S	S	*	*			trans	-124.8	123.4	152	40.4	0	0	0	0	107.4
14	F	27.3	Very low	30.6	Very low	186 Å²	186	157 Å²	157	82%	0.816	79%	0.794	S	S	*	*			trans	-92.5	135	-178.1	-113	-99.9	0	0	0	109.3
15	S	31.4	Very low	30.5	Very low	83 Å²	83	158 Å²	158	58%	0.58	79%	0.794	S	S	*	*			trans	-62.2	148.7	163	169.3	0	0	0	0	110.5
16	P	33.8	Very low	30.5	Very low	122 Å²	122	159.4 Å²	159.4	79%	0.792	80%	0.797	S	S	*	*				-134.4	149.7	96	15.2	7.1	0	0	0	114.4
17	H	29.7	Very low	30.2	Very low	170 Å²	170	157.4 Å²	157.4	79%	0.787	79%	0.793	S	S	*	*			trans	-55.7	127.8	177.7	-70.6	-48.2	0	0	0	114.5
18	E	32.3	Very low	30.3	Very low	189 Å²	189	156.9 Å²	156.9	88%	0.883	80%	0.797	S	S	*	*			trans	-83.4	121.3	166.1	-78.7	179.8	149	0	0	110.5	T20	E18-T20 PolarHBondContact O-N 2.91Å
19	H	31.6	Very low	30.6	Very low	179 Å²	179	155.7 Å²	155.7	83%	0.829	80%	0.8	S	S	*	*			trans	-68.5	110.3	174.2	-74.4	-87.5	0	0	0	110.6
20	T	28.3	Very low	31.1	Very low	129 Å²	129	153.8 Å²	153.8	79%	0.791	81%	0.806	S	S	*	*			trans	-96.3	103.1	165	-48.9	0	0	0	0	107.7	E18 Q22	E18-T20 PolarHBondContact O-N 2.91Å; T20-Q22 PolarHBondContact O-N 3.48Å
21	V	30.3	Very low	31.4	Very low	124 Å²	124	154.2 Å²	154.2	75%	0.752	80%	0.802	S	S	*	*			trans	-77.9	105.5	177.5	177.8	0	0	0	0	108.7
22	Q	30.4	Very low	32	Very low	166 Å²	166	147.4 Å²	147.4	78%	0.776	78%	0.78	S	S	*	*			trans	-79.7	118.6	164.8	-73.5	-177.6	-18.1	0	0	108.7	T20 Q24	T20-Q22 PolarHBondContact O-N 3.48Å; Q22-Q24 PolarHBondContact O-N 3.04Å; Q22-Q24 VanDerWaalsContact O-N 3.15Å
23	L	30.9	Very low	32.5	Very low	173 Å²	173	142.8 Å²	142.8	91%	0.906	78%	0.776	S	S	*	*			trans	-67.5	103.2	169.6	-87.6	129.4	0	0	0	109.4
24	Q	28.8	Very low	32.6	Very low	158 Å²	158	144 Å²	144	74%	0.738	77%	0.772	S	S	*	*			trans	-84.3	118.1	163.6	-74.6	-179.9	-27	0	0	108.7	Q22 E26	Q22-Q24 PolarHBondContact O-N 3.04Å; Q22-Q24 VanDerWaalsContact O-N 3.15Å; Q24-E26 PolarHBondContact O-N 3.42Å
25	S	32.8	Very low	32.8	Very low	121 Å²	121	141.7 Å²	141.7	85%	0.846	76%	0.763	S	S	*	*			trans	-75.9	93.5	168.5	55.9	0	0	0	0	109.2
26	E	29.8	Very low	33.1	Very low	171 Å²	171	142.2 Å²	142.2	80%	0.799	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-86.7	117.4	166	-71.5	-172.5	159.9	0	0	109.2	Q24	Q24-E26 PolarHBondContact O-N 3.42Å
27	M	29.3	Very low	33	Very low	170 Å²	170	140 Å²	140	84%	0.837	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-66	139	170.9	-62.3	-164.5	-60.3	0	0	109.6	V29	M27-V29 PolarHBondContact O-N 2.92Å
28	P	32	Very low	33.2	Very low	131 Å²	131	143.9 Å²	143.9	85%	0.851	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-68.8	119.9	179.4	26	-30	0	0	0	110.4	S30	P28-S30 PolarHBondContact O-N 3.07Å
29	V	37.3	Very low	33.4	Very low	131 Å²	131	141.7 Å²	141.7	79%	0.794	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-54.9	129.6	172.1	179.5	0	0	0	0	109.5	M27 R31	M27-V29 PolarHBondContact O-N 2.92Å; V29-R31 PolarHBondContact O-N 3.11Å
30	S	40.1	Very low	33.9	Very low	110 Å²	110	141 Å²	141	77%	0.769	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-55.2	120.1	177.3	56.6	0	0	0	0	110.8	P28	P28-S30 PolarHBondContact O-N 3.07Å
31	R	36.5	Very low	35	Very low	196 Å²	196	140.5 Å²	140.5	74%	0.74	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-71	139.4	173.9	-66.6	-178.6	179.5	179.6	-0.5	109.8	V29	V29-R31 PolarHBondContact O-N 3.11Å
32	S	41.5	Very low	36.8	Very low	60 Å²	60	136.9 Å²	136.9	42%	0.42	74%	0.742	S	S	.	*	P	Polyproline II helix	trans	-66.7	152.7	176.6	60.5	0	0	0	0	111.3	E34 Q35 L36	S32-E34 PolarHBondContact O-N 2.88Å; S32-E34 VanDerWaalsContact O-N 3.09Å; S32-Q35 PolarHBondContact O-N 3.49Å; S32-L36 PolarHBondContact O-N 3.48Å
33	A	38.7	Very low	39.5	Very low	86 Å²	86	130.7 Å²	130.7	71%	0.711	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.4	-25.9	-179.9	0	0	0	0	0	113.6
34	E	32.8	Very low	42.4	Very low	170 Å²	170	125.9 Å²	125.9	79%	0.794	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.3	-23.3	176.7	-71.6	176.9	153.6	0	0	113.4	S32 A37	S32-E34 PolarHBondContact O-N 2.88Å; S32-E34 VanDerWaalsContact O-N 3.09Å; E34-A37 VanDerWaalsContact O-CB 3.31Å; E34-A37 WeakPolarHBondContact O-CB 3.42Å; E34-A37 PolarHBondContact O-N 2.98Å
35	Q	31.1	Very low	45.6	Very low	136 Å²	136	118.6 Å²	118.6	64%	0.636	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.5	-13	173.6	-77.5	178.2	-22.8	0	0	113.3	S32 A37	S32-Q35 PolarHBondContact O-N 3.49Å; Q35-A37 VanDerWaalsContact C-N 3.25Å
36	L	37.6	Very low	48.7	Very low	94 Å²	94	119.1 Å²	119.1	49%	0.492	64%	0.644	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.2	-14	163.2	-75.5	162.7	0	0	0	112.2	S32 W38	S32-L36 PolarHBondContact O-N 3.48Å; L36-W38 PolarHBondContact O-N 3.3Å
37	A	30.6	Very low	51.8	Low	77 Å²	77	116.9 Å²	116.9	64%	0.636	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	10.5	-177.8	0	0	0	0	0	114.5	E34 Q35	E34-A37 VanDerWaalsContact O-CB 3.31Å; E34-A37 WeakPolarHBondContact O-CB 3.42Å; E34-A37 PolarHBondContact O-N 2.98Å; Q35-A37 VanDerWaalsContact C-N 3.25Å
38	W	35.3	Very low	55.1	Low	250 Å²	250	109.3 Å²	109.3	95%	0.947	60%	0.601	S	S	*	*			trans	-112.5	47	171.4	-108.2	58.3	0	0	0	111.6	L36	L36-W38 PolarHBondContact O-N 3.3Å
39	Q	35.6	Very low	58.2	Low	144 Å²	144	103.8 Å²	103.8	67%	0.673	57%	0.565	S	S	*	*	S	Bend	trans	-117.9	102.1	173.1	-80.3	-176.4	-32.6	0	0	110.4
40	H	42.5	Very low	61.1	Low	165 Å²	165	97.5 Å²	97.5	76%	0.764	53%	0.527	S	S	*	.			trans	51.5	130.3	160.3	-61.9	-80.4	0	0	0	118.3	G42	H40-G42 PolarHBondContact O-N 2.94Å
41	A	50.2	Low	63.9	Low	118 Å²	118	92.3 Å²	92.3	98%	0.975	49%	0.49	S	S	*	.			trans	-66.4	67.5	161.7	0	0	0	0	0	110.1
42	G	68	Low	66.9	Low	47 Å²	47	83 Å²	83	49%	0.485	46%	0.455	S	S	.	.	P	Polyproline II helix	trans	-76.9	158.9	-177.7	0	0	0	0	0	112.5	H40 S44	H40-G42 PolarHBondContact O-N 2.94Å; G42-S44 PolarHBondContact O-N 3.19Å
43	L	87.4	Confident	69.6	Low	37 Å²	37	81.1 Å²	81.1	19%	0.194	44%	0.442	C	S	.	.	P	Polyproline II helix	trans	-58.9	122.6	177.7	-178.4	64.1	0	0	0	111.2	F45 V73 V120 A143	L43-F45 HydrophobicContact CD2-CE1 3.92Å; L43-F45 HydrophobicContact CD2-CE2 4.32Å; L43-F45 HydrophobicContact CD2-CZ 3.69Å; L43-F45 HydrophobicContact CG-CE2 4.43Å; L43-F45 HydrophobicContact CG-CZ 4.24Å; L43-V73 HydrophobicContact CD1-CG2 3.87Å; L43-V73 HydrophobicContact CD2-CG1 4.13Å; L43-V73 HydrophobicContact CD2-CG2 4.02Å; L43-V73 HydrophobicContact CG-CG2 4.34Å; L43-V120 HydrophobicContact CD2-CG2 4.12Å; L43-A143 HydrophobicContact CB-CB 4.25Å; L43-A143 HydrophobicContact CD2-CB 3.87Å
44	S	92.6	Very high	72.4	Confident	71 Å²	71	78 Å²	78	50%	0.497	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-87	131.8	172.2	177.6	0	0	0	0	110.8	G42 R46 I48	G42-S44 PolarHBondContact O-N 3.19Å; S44-R46 PolarHBondContact OG-N 2.87Å; S44-I48 WeakPolarHBondContact O-CG2 3.41Å
45	F	96.8	Very high	75.4	Confident	6 Å²	6	72.3 Å²	72.3	3%	0.026	39%	0.389	C	S	.	.			trans	-95.6	10.6	176.3	-67.7	-82.3	0	0	0	113.8	L43 I48 V120 A144 P186 T188 A213 A214 P245 I247 S273	L43-F45 HydrophobicContact CD2-CE1 3.92Å; L43-F45 HydrophobicContact CD2-CE2 4.32Å; L43-F45 HydrophobicContact CD2-CZ 3.69Å; L43-F45 HydrophobicContact CG-CE2 4.43Å; L43-F45 HydrophobicContact CG-CZ 4.24Å; F45-I48 HydrophobicContact CB-CD1 4.41Å; F45-I48 HydrophobicContact CD1-CD1 3.79Å; F45-V120 HydrophobicContact CE1-CG2 4.26Å; F45-V120 HydrophobicContact CZ-CG2 4.4Å; F45-A144 HydrophobicContact CE2-CB 4.35Å; F45-A144 HydrophobicContact CZ-CB 3.76Å; F45-P186 HydrophobicContact CE2-CB 4Å; F45-T188 HydrophobicContact CD1-CG2 4.41Å; F45-T188 HydrophobicContact CD2-CG2 4.08Å; F45-T188 HydrophobicContact CE1-CG2 3.94Å; F45-T188 HydrophobicContact CE2-CG2 3.57Å; F45-T188 HydrophobicContact CG-CG2 4.47Å; F45-T188 HydrophobicContact CZ-CG2 3.49Å; F45-T188 VanDerWaalsContact CZ-CG2 3.49Å; F45-A213 HydrophobicContact CD2-CB 4.25Å; F45-A213 HydrophobicContact CE2-CB 4.31Å; F45-A214 HydrophobicContact CB-CB 3.58Å; F45-A214 HydrophobicContact CD1-CB 4.28Å; F45-A214 HydrophobicContact CD2-CB 4.01Å; F45-A214 HydrophobicContact CG-CB 3.7Å; F45-P245 HydrophobicContact CB-CB 4.11Å; F45-P245 HydrophobicContact CB-CG 4.32Å; F45-I247 HydrophobicContact CB-CD1 4.49Å; F45-I247 HydrophobicContact CD1-CD1 3.89Å; F45-S273 PolarHBondContact O-OG 3.01Å
46	R	96.5	Very high	78.6	Confident	131 Å²	131	71.4 Å²	71.4	49%	0.494	38%	0.38	S	S	.	.	S	Bend	trans	-92.5	141.7	175.2	-66.1	-173.1	-178.6	-81	-2.6	110.9	S44 I48 S243 P245	S44-R46 PolarHBondContact OG-N 2.87Å; R46-I48 PolarHBondContact O-N 2.78Å; R46-S243 PolarHBondContact NH2-O 3.15Å; R46-P245 HydrophobicContact CG-CB 4.17Å; R46-P245 HydrophobicContact CG-CG 3.61Å
47	N	96.3	Very high	81.5	Confident	124 Å²	124	67 Å²	67	66%	0.663	36%	0.357	S	S	*	.	S	Bend	trans	58	29.3	177.5	-57.4	-40.3	0	0	0	114.6	S272 S273	N47-S272 VanDerWaalsContact CA-O 3.31Å; N47-S272 WeakPolarHBondContact CA-O 3.39Å; N47-S272 WeakPolarHBondContact OD1-CB 3.38Å; N47-S273 PolarHBondContact N-OG 2.88Å; N47-S273 VanDerWaalsContact N-OG 3.16Å
48	I	97.1	Very high	84.7	Confident	11 Å²	11	63.4 Å²	63.4	6%	0.056	33%	0.327	C	S	.	.			trans	-100.4	158.1	-178	65.1	165	0	0	0	112.6	S44 F45 R46 A50 D72 V73 I247 R266 S273 V274	S44-I48 WeakPolarHBondContact O-CG2 3.41Å; F45-I48 HydrophobicContact CB-CD1 4.41Å; F45-I48 HydrophobicContact CD1-CD1 3.79Å; R46-I48 PolarHBondContact O-N 2.78Å; I48-A50 HydrophobicContact CD1-CB 4.37Å; I48-D72 HydrophobicContact CB-CB 3.97Å; I48-D72 HydrophobicContact CG2-CB 4.11Å; I48-V73 HydrophobicContact CB-CG2 4.39Å; I48-V73 HydrophobicContact CD1-CB 4.04Å; I48-V73 HydrophobicContact CD1-CG2 3.6Å; I48-V73 HydrophobicContact CG2-CG2 4.31Å; I48-I247 HydrophobicContact CD1-CD1 4.37Å; I48-R266 VanDerWaalsContact C-NH2 3.28Å; I48-R266 PolarHBondContact O-NH2 3.49Å; I48-S273 PolarHBondContact N-OG 2.86Å; I48-S273 VanDerWaalsContact O-CA 3.27Å; I48-S273 WeakPolarHBondContact O-CA 3.27Å; I48-V274 PolarHBondContact O-N 3.15Å; I48-V274 VanDerWaalsContact O-N 3.08Å
49	T	97.6	Very high	87.7	Confident	15 Å²	15	52.2 Å²	52.2	9%	0.092	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	116.8	164.9	-40.8	0	0	0	0	108.6	D72 I262 R266 V274 F287	T49-D72 PolarHBondContact N-OD2 3.5Å; T49-D72 PolarHBondContact O-N 2.93Å; T49-I262 HydrophobicContact CG2-CD1 3.82Å; T49-I262 HydrophobicContact CG2-CG2 4.06Å; T49-R266 PolarHBondContact OG1-NH2 3.03Å; T49-V274 CarbonylContact C-O 3.45Å; T49-V274 WeakPolarHBondContact CA-O 3.31Å; T49-F287 HydrophobicContact CG2-CD1 3.66Å; T49-F287 HydrophobicContact CG2-CE1 3.72Å
50	A	98.6	Very high	90.7	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	142.9	-172.4	0	0	0	0	0	113.1	I48 V73 Y75 V274 M275 L276	I48-A50 HydrophobicContact CD1-CB 4.37Å; A50-V73 CarbonylContact C-O 3.41Å; A50-V73 WeakPolarHBondContact CA-O 3.33Å; A50-V73 HydrophobicContact CB-CB 4.08Å; A50-V73 HydrophobicContact CB-CG1 4.48Å; A50-Y75 HydrophobicContact CB-CD2 4.39Å; A50-Y75 HydrophobicContact CB-CE2 4.21Å; A50-V274 PolarHBondContact N-O 3.34Å; A50-M275 HydrophobicContact CB-CB 4.24Å; A50-M275 HydrophobicContact CB-CG 4.36Å; A50-M275 CarbonylContact O-C 2.87Å; A50-M275 WeakPolarHBondContact O-CA 3.47Å; A50-L276 PolarHBondContact O-N 3.48Å
51	L	98.8	Very high	93.4	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	125.7	159.9	177.9	70.1	0	0	0	109.1	M54 M62 R63 A66 V73 V74 Y75 A280 F287	L51-M54 HydrophobicContact CD1-CE 3.61Å; L51-M54 HydrophobicContact CG-CE 4.37Å; L51-M62 HydrophobicContact CD2-CG 4.06Å; L51-R63 HydrophobicContact CD2-CG 4.17Å; L51-A66 HydrophobicContact CB-CB 4.21Å; L51-A66 HydrophobicContact CD1-CB 4.43Å; L51-A66 HydrophobicContact CD2-CB 3.91Å; L51-A66 HydrophobicContact CG-CB 4.41Å; L51-V73 PolarHBondContact N-O 3.38Å; L51-V74 HydrophobicContact CB-CB 4.27Å; L51-V74 HydrophobicContact CB-CG1 3.89Å; L51-V74 HydrophobicContact CD2-CB 4.34Å; L51-V74 HydrophobicContact CD2-CG1 4.21Å; L51-Y75 WeakPolarHBondContact O-CB 3.22Å; L51-Y75 WeakPolarHBondContact O-CD2 3.41Å; L51-Y75 PolarHBondContact O-N 2.9Å; L51-Y75 VanDerWaalsContact O-N 3.08Å; L51-A280 HydrophobicContact CD1-CB 3.52Å; L51-F287 HydrophobicContact CB-CE2 4.36Å; L51-F287 HydrophobicContact CB-CZ 4.23Å; L51-F287 HydrophobicContact CD1-CE2 4.16Å; L51-F287 HydrophobicContact CD1-CZ 4.34Å
52	A	98.8	Very high	95.8	Very high	1 Å²	1	32.3 Å²	32.3	1%	0.008	17%	0.174	C	C	.	.	P	Polyproline II helix	trans	-72.5	152.4	179.1	0	0	0	0	0	112.8	M54 M275 L276 A277	A52-M54 PolarHBondContact O-N 3.45Å; A52-M275 VanDerWaalsContact CA-CG 3.46Å; A52-M275 HydrophobicContact CB-CG 3.43Å; A52-M275 VanDerWaalsContact CB-CG 3.43Å; A52-M275 HydrophobicContact CB-SD 3.73Å; A52-L276 VanDerWaalsContact CB-O 3.3Å; A52-L276 WeakPolarHBondContact CB-O 3.25Å; A52-L276 PolarHBondContact N-O 3.41Å; A52-A277 HydrophobicContact CB-CB 3.55Å
53	P	98.6	Very high	97.2	Very high	20 Å²	20	30.2 Å²	30.2	13%	0.13	15%	0.151	C	C	.	.	P	Polyproline II helix	trans	-67	127.1	172.3	25.5	-30.1	0	0	0	110.2	Y75 C76 Q122 K190	P53-Y75 HydrophobicContact CG-CD1 4.27Å; P53-Y75 HydrophobicContact CG-CG 4.46Å; P53-C76 VanDerWaalsContact CA-O 3.28Å; P53-C76 WeakPolarHBondContact CA-O 3.42Å; P53-C76 WeakPolarHBondContact CB-O 3.45Å; P53-Q122 HydrophobicContact CB-CB 4.18Å; P53-Q122 HydrophobicContact CB-CG 4.45Å; P53-Q122 VanDerWaalsContact CG-CD 3.49Å; P53-Q122 VanDerWaalsContact CG-NE2 3.27Å; P53-K190 HydrophobicContact CG-CD 3.82Å
54	M	98.1	Very high	97.8	Very high	21 Å²	21	28.5 Å²	28.5	10%	0.103	14%	0.142	C	C	.	.			trans	-142.1	111.4	-176.6	-68.8	-179	-73.4	0	0	110.5	L51 A52 R56 V57 G58 E77 A277 M281	L51-M54 HydrophobicContact CD1-CE 3.61Å; L51-M54 HydrophobicContact CG-CE 4.37Å; A52-M54 PolarHBondContact O-N 3.45Å; M54-R56 PolarHBondContact O-N 3.08Å; M54-V57 HydrophobicContact CB-CB 3.75Å; M54-V57 HydrophobicContact CB-CG1 4.43Å; M54-V57 HydrophobicContact CB-CG2 4.36Å; M54-V57 HydrophobicContact CE-CB 4.38Å; M54-V57 HydrophobicContact CE-CG1 3.81Å; M54-V57 PolarHBondContact O-N 3.42Å; M54-V57 HydrophobicContact SD-CB 4.49Å; M54-V57 HydrophobicContact SD-CG1 4.3Å; M54-G58 PolarHBondContact O-N 3.06Å; M54-E77 WeakPolarHBondContact O-CB 3.28Å; M54-A277 HydrophobicContact CG-CB 4.1Å; M54-A277 VanDerWaalsContact SD-CA 3.57Å; M54-A277 HydrophobicContact SD-CB 3.79Å; M54-A277 VanDerWaalsContact SD-O 3.37Å; M54-M281 HydrophobicContact CE-CB 4.29Å; M54-M281 HydrophobicContact SD-CB 3.88Å
55	V	96.4	Very high	98.1	Very high	50 Å²	50	25.1 Å²	25.1	30%	0.303	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.1	130.8	177.1	177.2	0	0	0	0	111.3	V57 E78	V55-V57 PolarHBondContact O-N 3.26Å; V55-V57 VanDerWaalsContact O-N 3.09Å; V55-E78 HydrophobicContact CG2-CB 4Å
56	R	96.9	Very high	98.2	Very high	118 Å²	118	24.9 Å²	24.9	45%	0.445	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.8	-30.7	-169.6	-57.1	169.7	-178.8	178	-1.2	116	M54 E77 N315 Y318	M54-R56 PolarHBondContact O-N 3.08Å; R56-E77 WeakPolarHBondContact CA-OE2 3.39Å; R56-E77 PolarHBondContact N-OE2 2.81Å; R56-N315 PolarHBondContact O-ND2 2.74Å; R56-Y318 HydrophobicContact CB-CD1 3.59Å; R56-Y318 HydrophobicContact CB-CE1 3.53Å; R56-Y318 HydrophobicContact CB-CG 4.43Å; R56-Y318 HydrophobicContact CG-CD1 4.48Å; R56-Y318 HydrophobicContact CG-CE1 4.38Å
57	V	98.6	Very high	98.3	Very high	2 Å²	2	19.4 Å²	19.4	1%	0.012	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-40.9	-174.7	-179.1	0	0	0	0	111.4	M54 V55 T59 M62 M281 Y318	M54-V57 HydrophobicContact CB-CB 3.75Å; M54-V57 HydrophobicContact CB-CG1 4.43Å; M54-V57 HydrophobicContact CB-CG2 4.36Å; M54-V57 HydrophobicContact CE-CB 4.38Å; M54-V57 HydrophobicContact CE-CG1 3.81Å; M54-V57 PolarHBondContact O-N 3.42Å; M54-V57 HydrophobicContact SD-CB 4.49Å; M54-V57 HydrophobicContact SD-CG1 4.3Å; V55-V57 PolarHBondContact O-N 3.26Å; V55-V57 VanDerWaalsContact O-N 3.09Å; V57-T59 PolarHBondContact O-N 3.4Å; V57-M62 HydrophobicContact CG1-CE 3.93Å; V57-M62 HydrophobicContact CG1-CG 4.1Å; V57-M62 WeakPolarHBondContact O-CB 3.42Å; V57-M62 WeakPolarHBondContact O-CG 3.46Å; V57-M281 HydrophobicContact CG1-CB 4.13Å; V57-M281 HydrophobicContact CG1-CG 3.89Å; V57-M281 HydrophobicContact CG2-CG 3.9Å; V57-M281 HydrophobicContact CG2-SD 3.81Å; V57-Y318 HydrophobicContact CG2-CE1 3.81Å
58	G	98.4	Very high	98.4	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	8%	0.082	C	C	.	.	S	Bend	trans	-76.9	34	-175.5	0	0	0	0	0	114.9	M54 R63 E77	M54-G58 PolarHBondContact O-N 3.06Å; G58-R63 PolarHBondContact O-NH1 3.06Å; G58-E77 PolarHBondContact O-N 2.95Å
59	T	98.8	Very high	98.4	Very high	15 Å²	15	17.2 Å²	17.2	9%	0.092	9%	0.085	C	C	.	.	S	Bend	trans	-77.2	166.8	171	54.5	0	0	0	0	110.8	V57 P61 M62 R63 E77 N315	V57-T59 PolarHBondContact O-N 3.4Å; T59-P61 VanDerWaalsContact C-CD 3.44Å; T59-P61 VanDerWaalsContact C-N 3.34Å; T59-M62 PolarHBondContact O-N 3.26Å; T59-M62 VanDerWaalsContact O-N 3.1Å; T59-R63 PolarHBondContact O-N 2.86Å; T59-E77 VanDerWaalsContact CG2-OE1 3.27Å; T59-E77 WeakPolarHBondContact CG2-OE1 3.16Å; T59-N315 PolarHBondContact OG1-OD1 3.49Å
60	L	98.9	Very high	98.4	Very high	7 Å²	7	18.5 Å²	18.5	4%	0.037	10%	0.101	C	C	.	.	H	α-helix	trans	-49	-45.2	-172.7	-179.5	64	0	0	0	113.8	M62 R63 L64 T97 R110 E115 Y309	L60-M62 VanDerWaalsContact C-N 3.34Å; L60-M62 PolarHBondContact O-N 2.91Å; L60-R63 PolarHBondContact O-N 2.92Å; L60-L64 HydrophobicContact CD1-CD1 3.85Å; L60-L64 HydrophobicContact CD1-CD2 4.02Å; L60-L64 HydrophobicContact CD1-CG 3.69Å; L60-L64 HydrophobicContact CD2-CD1 4.42Å; L60-L64 HydrophobicContact CG-CD1 3.89Å; L60-L64 HydrophobicContact CG-CG 4.13Å; L60-L64 WeakPolarHBondContact O-CG 2.91Å; L60-L64 PolarHBondContact O-N 3.37Å; L60-T97 HydrophobicContact CD2-CG2 4.3Å; L60-R110 HydrophobicContact CD2-CG 3.82Å; L60-E115 VanDerWaalsContact CD1-CD 3.44Å; L60-E115 HydrophobicContact CD1-CG 4.24Å; L60-E115 VanDerWaalsContact CD1-OE1 3.29Å; L60-E115 WeakPolarHBondContact CD1-OE1 3.46Å; L60-Y309 HydrophobicContact CD2-CD1 3.7Å; L60-Y309 HydrophobicContact CD2-CD2 4.08Å; L60-Y309 HydrophobicContact CD2-CE1 4.14Å; L60-Y309 HydrophobicContact CD2-CE2 4.48Å; L60-Y309 HydrophobicContact CD2-CG 3.66Å; L60-Y309 HydrophobicContact CG-CD2 4.5Å; L60-Y309 HydrophobicContact CG-CG 4.48Å
61	P	98.9	Very high	98.4	Very high	1 Å²	1	18.5 Å²	18.5	1%	0.006	10%	0.101	C	C	.	.	H	α-helix	trans	-58.4	-41.7	-179.6	-27.2	37.2	0	0	0	114	T59 L65 Y302 A306 N311	T59-P61 VanDerWaalsContact C-CD 3.44Å; T59-P61 VanDerWaalsContact C-N 3.34Å; P61-L65 VanDerWaalsContact O-CB 3.23Å; P61-L65 WeakPolarHBondContact O-CB 3.44Å; P61-L65 PolarHBondContact O-N 2.99Å; P61-Y302 HydrophobicContact CB-CD2 4.04Å; P61-Y302 HydrophobicContact CB-CE2 3.63Å; P61-A306 HydrophobicContact CG-CB 4.31Å; P61-N311 HydrophobicContact CG-CB 3.82Å
62	M	98.9	Very high	98.4	Very high	1 Å²	1	21.7 Å²	21.7	1%	0.005	12%	0.118	C	C	.	.	H	α-helix	trans	-69.7	-39	178.6	178.1	60.9	65.9	0	0	111.6	L51 V57 T59 L60 L65 A66 P284 Y302 M323	L51-M62 HydrophobicContact CD2-CG 4.06Å; V57-M62 HydrophobicContact CG1-CE 3.93Å; V57-M62 HydrophobicContact CG1-CG 4.1Å; V57-M62 WeakPolarHBondContact O-CB 3.42Å; V57-M62 WeakPolarHBondContact O-CG 3.46Å; T59-M62 PolarHBondContact O-N 3.26Å; T59-M62 VanDerWaalsContact O-N 3.1Å; L60-M62 VanDerWaalsContact C-N 3.34Å; L60-M62 PolarHBondContact O-N 2.91Å; M62-L65 PolarHBondContact O-N 3.41Å; M62-A66 WeakPolarHBondContact O-CB 3.21Å; M62-A66 PolarHBondContact O-N 2.96Å; M62-P284 HydrophobicContact SD-CB 3.86Å; M62-P284 HydrophobicContact SD-CG 3.98Å; M62-Y302 HydrophobicContact CB-CE2 4.13Å; M62-Y302 HydrophobicContact CE-CD2 4.38Å; M62-Y302 HydrophobicContact CE-CE2 4.24Å; M62-M323 HydrophobicContact CE-CE 3.38Å
63	R	98.9	Very high	98.4	Very high	4 Å²	4	21.7 Å²	21.7	2%	0.015	12%	0.118	C	C	.	.	H	α-helix	trans	-64.1	-49	179.4	-65.1	-163.8	-55	-92.5	3.9	111	L51 G58 T59 L60 L65 A66 L67 V74 R110 E115	L51-R63 HydrophobicContact CD2-CG 4.17Å; G58-R63 PolarHBondContact O-NH1 3.06Å; T59-R63 PolarHBondContact O-N 2.86Å; L60-R63 PolarHBondContact O-N 2.92Å; R63-L65 VanDerWaalsContact C-N 3.32Å; R63-L65 PolarHBondContact O-N 2.96Å; R63-A66 PolarHBondContact O-N 3.17Å; R63-L67 WeakPolarHBondContact O-CG 3.39Å; R63-L67 PolarHBondContact O-N 3.34Å; R63-V74 HydrophobicContact CB-CB 4.02Å; R63-V74 HydrophobicContact CB-CG1 4.46Å; R63-V74 HydrophobicContact CB-CG2 3.92Å; R63-V74 HydrophobicContact CG-CB 4.16Å; R63-V74 HydrophobicContact CG-CG2 4.35Å; R63-R110 PolarHBondContact NH2-O 2.91Å; R63-E115 VanDerWaalsContact CB-OE2 3.24Å; R63-E115 WeakPolarHBondContact CB-OE2 3.19Å; R63-E115 IonicContact CZ-OE1 3.86Å; R63-E115 IonicContact CZ-OE2 2.81Å; R63-E115 IonicContact NE-OE1 3.53Å; R63-E115 PolarHBondContact NE-OE1 3.18Å; R63-E115 VanDerWaalsContact NE-OE1 3.16Å; R63-E115 IonicContact NE-OE2 2.78Å; R63-E115 PolarHBondContact NE-OE2 3.02Å; R63-E115 IonicContact NH2-OE1 3.78Å; R63-E115 PolarHBondContact NH2-OE1 2.87Å; R63-E115 IonicContact NH2-OE2 2.8Å
64	L	98.9	Very high	98.4	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-61.1	-42.4	176.4	-63.7	-177.9	0	0	0	112	L60 A66 L67 D68 R114 E115 Y305 Y309	L60-L64 HydrophobicContact CD1-CD1 3.85Å; L60-L64 HydrophobicContact CD1-CD2 4.02Å; L60-L64 HydrophobicContact CD1-CG 3.69Å; L60-L64 HydrophobicContact CD2-CD1 4.42Å; L60-L64 HydrophobicContact CG-CD1 3.89Å; L60-L64 HydrophobicContact CG-CG 4.13Å; L60-L64 WeakPolarHBondContact O-CG 2.91Å; L60-L64 PolarHBondContact O-N 3.37Å; L64-A66 VanDerWaalsContact C-N 3.33Å; L64-A66 PolarHBondContact O-N 3.37Å; L64-L67 HydrophobicContact CD2-CD1 4.43Å; L64-L67 WeakPolarHBondContact O-CB 3.19Å; L64-L67 PolarHBondContact O-N 3.48Å; L64-D68 PolarHBondContact O-N 3Å; L64-R114 HydrophobicContact CD2-CB 4.36Å; L64-R114 HydrophobicContact CD2-CG 4.37Å; L64-E115 HydrophobicContact CD2-CB 4.04Å; L64-E115 HydrophobicContact CD2-CG 4.33Å; L64-Y305 HydrophobicContact CB-CD1 4.3Å; L64-Y305 HydrophobicContact CB-CD2 4.49Å; L64-Y305 HydrophobicContact CB-CE1 4.13Å; L64-Y305 HydrophobicContact CB-CE2 4.31Å; L64-Y305 HydrophobicContact CB-CG 4.49Å; L64-Y305 HydrophobicContact CD1-CD1 3.96Å; L64-Y305 HydrophobicContact CD1-CE1 4.05Å; L64-Y309 HydrophobicContact CD1-CD2 3.86Å; L64-Y309 HydrophobicContact CD1-CE2 3.2Å
65	L	98.8	Very high	98.4	Very high	1 Å²	1	19.8 Å²	19.8	1%	0.005	11%	0.107	C	C	.	.	H	α-helix	trans	-66.7	-34.4	178.1	-171	61.5	0	0	0	112.7	P61 M62 R63 D68 Y69 P284 V298 E301 Y302 Y305	P61-L65 VanDerWaalsContact O-CB 3.23Å; P61-L65 WeakPolarHBondContact O-CB 3.44Å; P61-L65 PolarHBondContact O-N 2.99Å; M62-L65 PolarHBondContact O-N 3.41Å; R63-L65 VanDerWaalsContact C-N 3.32Å; R63-L65 PolarHBondContact O-N 2.96Å; L65-D68 WeakPolarHBondContact O-CB 3.4Å; L65-D68 PolarHBondContact O-N 3.28Å; L65-Y69 HydrophobicContact CD1-CD2 4.17Å; L65-Y69 HydrophobicContact CD1-CE2 3.43Å; L65-Y69 VanDerWaalsContact CD1-CE2 3.43Å; L65-Y69 HydrophobicContact CD2-CE2 4.28Å; L65-Y69 HydrophobicContact CG-CD2 4.06Å; L65-Y69 HydrophobicContact CG-CE2 3.58Å; L65-Y69 WeakPolarHBondContact O-CD2 3.42Å; L65-Y69 PolarHBondContact O-N 2.99Å; L65-P284 HydrophobicContact CD2-CG 3.62Å; L65-P284 HydrophobicContact CG-CB 4.43Å; L65-P284 HydrophobicContact CG-CG 3.92Å; L65-V298 HydrophobicContact CD2-CG1 4.11Å; L65-E301 HydrophobicContact CD1-CB 3.84Å; L65-Y302 HydrophobicContact CD2-CD2 4.17Å; L65-Y302 HydrophobicContact CD2-CG 4.43Å; L65-Y305 HydrophobicContact CB-CD2 4.2Å; L65-Y305 HydrophobicContact CB-CE2 4.27Å; L65-Y305 HydrophobicContact CD1-CD2 4.41Å; L65-Y305 HydrophobicContact CD1-CE2 4.12Å
66	A	98.8	Very high	98.6	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-66.4	-39.4	172.3	0	0	0	0	0	111.7	L51 M62 R63 L64 Y69 G70 A71 V74 F287	L51-A66 HydrophobicContact CB-CB 4.21Å; L51-A66 HydrophobicContact CD1-CB 4.43Å; L51-A66 HydrophobicContact CD2-CB 3.91Å; L51-A66 HydrophobicContact CG-CB 4.41Å; M62-A66 WeakPolarHBondContact O-CB 3.21Å; M62-A66 PolarHBondContact O-N 2.96Å; R63-A66 PolarHBondContact O-N 3.17Å; L64-A66 VanDerWaalsContact C-N 3.33Å; L64-A66 PolarHBondContact O-N 3.37Å; A66-Y69 PolarHBondContact O-N 2.87Å; A66-G70 PolarHBondContact O-N 3.18Å; A66-A71 HydrophobicContact CB-CB 4.06Å; A66-A71 VanDerWaalsContact O-CB 3.27Å; A66-A71 WeakPolarHBondContact O-CB 3.47Å; A66-A71 PolarHBondContact O-N 3.28Å; A66-V74 HydrophobicContact CB-CG1 4.09Å; A66-F287 HydrophobicContact CB-CD2 4.06Å; A66-F287 HydrophobicContact CB-CE2 3.9Å
67	L	98.8	Very high	98.6	Very high	17 Å²	17	13.4 Å²	13.4	9%	0.089	8%	0.079	C	C	.	.	H	α-helix	trans	-62.9	-42.2	173.8	-67.6	177.8	0	0	0	111.8	R63 L64 Y69 G70 A71 V74 E115 R118	R63-L67 WeakPolarHBondContact O-CG 3.39Å; R63-L67 PolarHBondContact O-N 3.34Å; L64-L67 HydrophobicContact CD2-CD1 4.43Å; L64-L67 WeakPolarHBondContact O-CB 3.19Å; L64-L67 PolarHBondContact O-N 3.48Å; L67-Y69 PolarHBondContact O-N 3.43Å; L67-G70 PolarHBondContact O-N 2.88Å; L67-A71 VanDerWaalsContact CD2-O 3.29Å; L67-A71 WeakPolarHBondContact CD2-O 3.47Å; L67-V74 HydrophobicContact CD1-CG2 4.16Å; L67-V74 HydrophobicContact CD2-CG1 3.69Å; L67-V74 HydrophobicContact CD2-CG2 4.17Å; L67-V74 HydrophobicContact CG-CG1 3.8Å; L67-V74 HydrophobicContact CG-CG2 4.15Å; L67-E115 HydrophobicContact CD1-CB 3.68Å; L67-R118 HydrophobicContact CD2-CB 4.13Å
68	D	98.4	Very high	98.6	Very high	62 Å²	62	14 Å²	14	33%	0.332	8%	0.081	S	C	.	.	H	α-helix	trans	-55.6	-38.6	175.2	-71.9	-9.2	0	0	0	112.2	L64 L65 G70 R114 Y305	L64-D68 PolarHBondContact O-N 3Å; L65-D68 WeakPolarHBondContact O-CB 3.4Å; L65-D68 PolarHBondContact O-N 3.28Å; D68-G70 VanDerWaalsContact C-N 3.3Å; D68-R114 IonicContact OD1-CZ 2.9Å; D68-R114 IonicContact OD1-NH1 2.77Å; D68-R114 PolarHBondContact OD1-NH1 2.99Å; D68-R114 VanDerWaalsContact OD1-NH1 3.1Å; D68-R114 IonicContact OD1-NH2 3.66Å; D68-R114 PolarHBondContact OD1-NH2 3.27Å; D68-Y305 VanDerWaalsContact CG-OH 3.25Å; D68-Y305 PolarHBondContact OD1-OH 3.11Å; D68-Y305 WeakPolarHBondContact OD2-CE2 3.43Å; D68-Y305 VanDerWaalsContact OD2-CZ 3.24Å; D68-Y305 PolarHBondContact OD2-OH 3.43Å
69	Y	98.4	Very high	98.5	Very high	27 Å²	27	14.4 Å²	14.4	11%	0.106	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	3.8	179.5	-64.9	-47.9	0	0	0	114.1	L65 A66 L67 P284 F287 C288 L293 V298	L65-Y69 HydrophobicContact CD1-CD2 4.17Å; L65-Y69 HydrophobicContact CD1-CE2 3.43Å; L65-Y69 VanDerWaalsContact CD1-CE2 3.43Å; L65-Y69 HydrophobicContact CD2-CE2 4.28Å; L65-Y69 HydrophobicContact CG-CD2 4.06Å; L65-Y69 HydrophobicContact CG-CE2 3.58Å; L65-Y69 WeakPolarHBondContact O-CD2 3.42Å; L65-Y69 PolarHBondContact O-N 2.99Å; A66-Y69 PolarHBondContact O-N 2.87Å; L67-Y69 PolarHBondContact O-N 3.43Å; Y69-P284 VanDerWaalsContact CD2-C 3.49Å; Y69-P284 HydrophobicContact CD2-CB 4.08Å; Y69-P284 HydrophobicContact CD2-CG 4.31Å; Y69-P284 HydrophobicContact CE2-CB 4.48Å; Y69-P284 HydrophobicContact CE2-CG 4.21Å; Y69-F287 CarbonylContact O-C 3.54Å; Y69-F287 WeakPolarHBondContact O-CB 3.37Å; Y69-C288 HydrophobicContact CD1-CB 4.48Å; Y69-C288 VanDerWaalsContact O-CA 3.23Å; Y69-C288 WeakPolarHBondContact O-CA 3.29Å; Y69-C288 PolarHBondContact O-N 3.39Å; Y69-L293 HydrophobicContact CD1-CD1 4.28Å; Y69-L293 HydrophobicContact CE1-CD1 3.41Å; Y69-L293 VanDerWaalsContact CE1-CD1 3.41Å; Y69-L293 HydrophobicContact CE1-CG 4.48Å; Y69-V298 HydrophobicContact CE2-CG1 4.13Å; Y69-V298 HydrophobicContact CE2-CG2 4.31Å
70	G	97.6	Very high	98.5	Very high	42 Å²	42	15.7 Å²	15.7	43%	0.433	9%	0.09	S	C	.	.	T	Hydrogen-bonded Turn	trans	97.7	21.3	171.7	0	0	0	0	0	115.2	A66 L67 D68	A66-G70 PolarHBondContact O-N 3.18Å; L67-G70 PolarHBondContact O-N 2.88Å; D68-G70 VanDerWaalsContact C-N 3.3Å
71	A	98.1	Very high	98.4	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	9%	0.088	C	C	.	.			trans	-63.8	135.4	160.8	0	0	0	0	0	109.7	A66 L67 V74 F287	A66-A71 HydrophobicContact CB-CB 4.06Å; A66-A71 VanDerWaalsContact O-CB 3.27Å; A66-A71 WeakPolarHBondContact O-CB 3.47Å; A66-A71 PolarHBondContact O-N 3.28Å; L67-A71 VanDerWaalsContact CD2-O 3.29Å; L67-A71 WeakPolarHBondContact CD2-O 3.47Å; A71-V74 HydrophobicContact CB-CG1 4.17Å; A71-F287 HydrophobicContact CB-CD1 4.2Å; A71-F287 HydrophobicContact CB-CD2 3.96Å; A71-F287 HydrophobicContact CB-CE1 4.39Å; A71-F287 HydrophobicContact CB-CE2 4.16Å; A71-F287 HydrophobicContact CB-CG 3.99Å; A71-F287 HydrophobicContact CB-CZ 4.38Å
72	D	98.3	Very high	98.2	Very high	67 Å²	67	19.4 Å²	19.4	36%	0.358	11%	0.109	S	C	.	.	S	Bend	trans	-80.1	-36.4	177.6	-58.4	-64.4	0	0	0	110.8	I48 T49 R118	I48-D72 HydrophobicContact CB-CB 3.97Å; I48-D72 HydrophobicContact CG2-CB 4.11Å; T49-D72 PolarHBondContact N-OD2 3.5Å; T49-D72 PolarHBondContact O-N 2.93Å; D72-R118 WeakPolarHBondContact O-CD 3.47Å
73	V	98.6	Very high	98	Very high	1 Å²	1	24.2 Å²	24.2	1%	0.006	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	141.3	-174.7	178.8	0	0	0	0	109.9	L43 I48 A50 L51 Y75 V120	L43-V73 HydrophobicContact CD1-CG2 3.87Å; L43-V73 HydrophobicContact CD2-CG1 4.13Å; L43-V73 HydrophobicContact CD2-CG2 4.02Å; L43-V73 HydrophobicContact CG-CG2 4.34Å; I48-V73 HydrophobicContact CB-CG2 4.39Å; I48-V73 HydrophobicContact CD1-CB 4.04Å; I48-V73 HydrophobicContact CD1-CG2 3.6Å; I48-V73 HydrophobicContact CG2-CG2 4.31Å; A50-V73 CarbonylContact C-O 3.41Å; A50-V73 WeakPolarHBondContact CA-O 3.33Å; A50-V73 HydrophobicContact CB-CB 4.08Å; A50-V73 HydrophobicContact CB-CG1 4.48Å; L51-V73 PolarHBondContact N-O 3.38Å; V73-Y75 HydrophobicContact CG1-CD2 4.13Å; V73-Y75 HydrophobicContact CG1-CE2 3.77Å; V73-V120 HydrophobicContact CG1-CG2 3.45Å; V73-V120 VanDerWaalsContact CG1-CG2 3.45Å
74	V	98.9	Very high	97.9	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	118.8	179.7	-68.1	0	0	0	0	111.8	L51 R63 A66 L67 A71 R118 V119 V120	L51-V74 HydrophobicContact CB-CB 4.27Å; L51-V74 HydrophobicContact CB-CG1 3.89Å; L51-V74 HydrophobicContact CD2-CB 4.34Å; L51-V74 HydrophobicContact CD2-CG1 4.21Å; R63-V74 HydrophobicContact CB-CB 4.02Å; R63-V74 HydrophobicContact CB-CG1 4.46Å; R63-V74 HydrophobicContact CB-CG2 3.92Å; R63-V74 HydrophobicContact CG-CB 4.16Å; R63-V74 HydrophobicContact CG-CG2 4.35Å; A66-V74 HydrophobicContact CB-CG1 4.09Å; L67-V74 HydrophobicContact CD1-CG2 4.16Å; L67-V74 HydrophobicContact CD2-CG1 3.69Å; L67-V74 HydrophobicContact CD2-CG2 4.17Å; L67-V74 HydrophobicContact CG-CG1 3.8Å; L67-V74 HydrophobicContact CG-CG2 4.15Å; A71-V74 HydrophobicContact CB-CG1 4.17Å; V74-R118 PolarHBondContact N-O 3.31Å; V74-V119 HydrophobicContact CG2-CB 4.23Å; V74-V119 HydrophobicContact CG2-CG2 4.44Å; V74-V119 CarbonylContact O-C 3.6Å; V74-V119 VanDerWaalsContact O-CA 3.27Å; V74-V119 WeakPolarHBondContact O-CA 3.5Å; V74-V120 PolarHBondContact O-N 3.33Å
75	Y	98.9	Very high	97.8	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	137.3	174.7	-74.1	-114	0	0	0	109.9	A50 L51 P53 V73 V120 D146 M275	A50-Y75 HydrophobicContact CB-CD2 4.39Å; A50-Y75 HydrophobicContact CB-CE2 4.21Å; L51-Y75 WeakPolarHBondContact O-CB 3.22Å; L51-Y75 WeakPolarHBondContact O-CD2 3.41Å; L51-Y75 PolarHBondContact O-N 2.9Å; L51-Y75 VanDerWaalsContact O-N 3.08Å; P53-Y75 HydrophobicContact CG-CD1 4.27Å; P53-Y75 HydrophobicContact CG-CG 4.46Å; V73-Y75 HydrophobicContact CG1-CD2 4.13Å; V73-Y75 HydrophobicContact CG1-CE2 3.77Å; Y75-V120 WeakPolarHBondContact CA-O 3.43Å; Y75-V120 HydrophobicContact CD1-CB 3.76Å; Y75-V120 HydrophobicContact CD1-CG1 3.69Å; Y75-V120 HydrophobicContact CD2-CB 4.09Å; Y75-V120 HydrophobicContact CD2-CG2 4.22Å; Y75-V120 HydrophobicContact CE1-CB 3.79Å; Y75-V120 HydrophobicContact CE1-CG1 3.39Å; Y75-V120 HydrophobicContact CE1-CG2 4.32Å; Y75-V120 HydrophobicContact CE2-CB 4.09Å; Y75-V120 HydrophobicContact CE2-CG1 4.46Å; Y75-V120 HydrophobicContact CE2-CG2 3.9Å; Y75-V120 HydrophobicContact CG-CB 3.91Å; Y75-V120 HydrophobicContact CG-CG1 4.36Å; Y75-D146 HydrophobicContact CD1-CB 4.15Å; Y75-D146 HydrophobicContact CE1-CB 3.7Å; Y75-M275 HydrophobicContact CD1-CE 4.3Å; Y75-M275 HydrophobicContact CD2-CE 3.75Å; Y75-M275 HydrophobicContact CE1-CE 4.01Å; Y75-M275 HydrophobicContact CE2-CE 3.43Å; Y75-M275 VanDerWaalsContact CE2-CE 3.43Å; Y75-M275 HydrophobicContact CG-CE 4.19Å
76	C	98.8	Very high	97.5	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.167	C	C	.	.	P	Polyproline II helix	trans	-71.4	171.7	168.5	76.4	0	0	0	0	111.5	P53 F109 V120 Q122	P53-C76 VanDerWaalsContact CA-O 3.28Å; P53-C76 WeakPolarHBondContact CA-O 3.42Å; P53-C76 WeakPolarHBondContact CB-O 3.45Å; C76-F109 HydrophobicContact CB-CD2 4.29Å; C76-F109 HydrophobicContact CB-CE2 3.79Å; C76-V120 PolarHBondContact N-O 2.94Å; C76-Q122 PolarHBondContact SG-N 3.08Å
77	E	98.2	Very high	97.2	Very high	35 Å²	35	31.1 Å²	31.1	16%	0.164	17%	0.17	C	C	.	.	P	Polyproline II helix	trans	-61.2	157.3	168.4	58.9	-176	134	0	0	112.7	M54 R56 G58 T59 L79	M54-E77 WeakPolarHBondContact O-CB 3.28Å; R56-E77 WeakPolarHBondContact CA-OE2 3.39Å; R56-E77 PolarHBondContact N-OE2 2.81Å; G58-E77 PolarHBondContact O-N 2.95Å; T59-E77 VanDerWaalsContact CG2-OE1 3.27Å; T59-E77 WeakPolarHBondContact CG2-OE1 3.16Å; E77-L79 HydrophobicContact CG-CD2 3.98Å; E77-L79 HydrophobicContact CG-CG 4.24Å; E77-L79 PolarHBondContact O-N 3.07Å; E77-L79 VanDerWaalsContact O-N 3.15Å
78	E	97.9	Very high	97	Very high	13 Å²	13	36.8 Å²	36.8	6%	0.061	20%	0.197	C	C	.	.			trans	-63.1	115.9	171.7	-179.4	-178.7	-172.1	0	0	109.9	V55 I80 G124 N148	V55-E78 HydrophobicContact CG2-CB 4Å; E78-I80 HydrophobicContact CG-CD1 4.35Å; E78-G124 WeakPolarHBondContact OE1-CA 3.31Å; E78-N148 HydrophobicContact CG-CB 4.22Å; E78-N148 PolarHBondContact OE2-ND2 2.9Å
79	L	97.8	Very high	96.9	Very high	10 Å²	10	38.5 Å²	38.5	5%	0.052	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	127.6	175.9	-65.6	173.7	0	0	0	110.4	E77 D81 M84 M108 F109 F121 Q122 M123 G124	E77-L79 HydrophobicContact CG-CD2 3.98Å; E77-L79 HydrophobicContact CG-CG 4.24Å; E77-L79 PolarHBondContact O-N 3.07Å; E77-L79 VanDerWaalsContact O-N 3.15Å; L79-D81 PolarHBondContact O-N 3.24Å; L79-M84 HydrophobicContact CB-CG 3.88Å; L79-M84 HydrophobicContact CB-SD 4.17Å; L79-M84 HydrophobicContact CD1-SD 3.99Å; L79-M108 WeakPolarHBondContact CD1-O 3.35Å; L79-M108 HydrophobicContact CD2-CE 4.48Å; L79-M108 WeakPolarHBondContact CD2-O 3.3Å; L79-F109 HydrophobicContact CD1-CB 3.68Å; L79-F109 HydrophobicContact CD1-CD2 4.19Å; L79-F109 HydrophobicContact CD1-CG 4.16Å; L79-F121 HydrophobicContact CB-CZ 4.01Å; L79-F121 HydrophobicContact CD1-CE2 3.57Å; L79-F121 HydrophobicContact CD1-CZ 3.85Å; L79-Q122 PolarHBondContact N-O 3.4Å; L79-M123 VanDerWaalsContact O-CA 3.25Å; L79-M123 WeakPolarHBondContact O-CA 3.45Å; L79-G124 PolarHBondContact O-N 2.95Å
80	I	97.1	Very high	96.7	Very high	42 Å²	42	40.7 Å²	40.7	22%	0.215	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	127	-174.2	-54.6	-53	0	0	0	110.5	E78 I82 K83 M84 Y155 M161	E78-I80 HydrophobicContact CG-CD1 4.35Å; I80-I82 VanDerWaalsContact C-N 3.3Å; I80-I82 HydrophobicContact CG2-CB 4.34Å; I80-I82 PolarHBondContact O-N 3.47Å; I80-K83 PolarHBondContact O-N 3.14Å; I80-M84 PolarHBondContact O-N 2.98Å; I80-Y155 HydrophobicContact CD1-CE2 4.36Å; I80-M161 HydrophobicContact CD1-CE 3.83Å; I80-M161 HydrophobicContact CD1-SD 4.31Å; I80-M161 HydrophobicContact CG2-CE 3.91Å; I80-M161 HydrophobicContact CG2-SD 4.02Å
81	D	97.2	Very high	96.6	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-54.2	-40.6	-175.6	66.1	-10.4	0	0	0	113.5	L79 K83 M84 A85 G124 T125 R130 V134	L79-D81 PolarHBondContact O-N 3.24Å; D81-K83 PolarHBondContact O-N 3.37Å; D81-M84 PolarHBondContact O-N 3.31Å; D81-A85 VanDerWaalsContact O-CB 3.3Å; D81-A85 WeakPolarHBondContact O-CB 3.28Å; D81-A85 PolarHBondContact O-N 3.12Å; D81-G124 WeakPolarHBondContact CB-O 3.31Å; D81-G124 VanDerWaalsContact CG-O 3.29Å; D81-G124 PolarHBondContact N-O 3.49Å; D81-T125 WeakPolarHBondContact OD2-CA 3.27Å; D81-T125 WeakPolarHBondContact OD2-CB 3.17Å; D81-T125 PolarHBondContact OD2-OG1 3.01Å; D81-R130 HydrophobicContact CB-CG 4.2Å; D81-R130 IonicContact OD1-CZ 2.76Å; D81-R130 IonicContact OD1-NE 2.71Å; D81-R130 PolarHBondContact OD1-NE 2.99Å; D81-R130 IonicContact OD1-NH2 3.1Å; D81-R130 IonicContact OD2-CZ 3.67Å; D81-R130 VanDerWaalsContact OD2-CZ 3.23Å; D81-R130 IonicContact OD2-NE 2.72Å; D81-R130 PolarHBondContact OD2-NE 3.35Å; D81-R130 IonicContact OD2-NH2 3.63Å; D81-R130 PolarHBondContact OD2-NH2 2.89Å; D81-V134 HydrophobicContact CB-CG2 4.11Å; D81-V134 WeakPolarHBondContact O-CG2 3.34Å
82	I	95.1	Very high	96.4	Very high	86 Å²	86	43.9 Å²	43.9	44%	0.441	22%	0.221	S	C	.	.	H	α-helix	trans	-56.9	-37.1	177.7	-65.5	167.6	0	0	0	111.4	I80 Q86	I80-I82 VanDerWaalsContact C-N 3.3Å; I80-I82 HydrophobicContact CG2-CB 4.34Å; I80-I82 PolarHBondContact O-N 3.47Å; I82-Q86 PolarHBondContact O-NE2 2.82Å
83	K	94.4	Very high	96.1	Very high	101 Å²	101	45.6 Å²	45.6	44%	0.439	23%	0.23	S	C	.	.	H	α-helix	trans	-82.5	-40.6	178.8	-70.2	-64	-176.9	-178.9	0	111.5	I80 D81 A85 Q86 C87 M108	I80-K83 PolarHBondContact O-N 3.14Å; D81-K83 PolarHBondContact O-N 3.37Å; K83-A85 VanDerWaalsContact C-N 3.34Å; K83-A85 PolarHBondContact O-N 3.3Å; K83-Q86 PolarHBondContact O-N 3.38Å; K83-C87 PolarHBondContact O-SG 2.82Å; K83-M108 HydrophobicContact CB-CE 4.19Å
84	M	98.1	Very high	95.8	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-65.3	-36.3	178.6	-72.1	-61	-53.5	0	0	112.9	L79 I80 D81 Q86 C87 F100 M108 F109 F121 V134 L137 V138	L79-M84 HydrophobicContact CB-CG 3.88Å; L79-M84 HydrophobicContact CB-SD 4.17Å; L79-M84 HydrophobicContact CD1-SD 3.99Å; I80-M84 PolarHBondContact O-N 2.98Å; D81-M84 PolarHBondContact O-N 3.31Å; M84-Q86 PolarHBondContact O-N 3.25Å; M84-C87 VanDerWaalsContact O-CB 3.25Å; M84-C87 WeakPolarHBondContact O-CB 3.37Å; M84-C87 PolarHBondContact O-N 2.95Å; M84-F100 HydrophobicContact CE-CB 3.9Å; M84-F100 HydrophobicContact CE-CD1 4.45Å; M84-F100 HydrophobicContact CE-CG 4.23Å; M84-M108 HydrophobicContact SD-CB 3.68Å; M84-F109 HydrophobicContact CE-CB 4.31Å; M84-F121 HydrophobicContact CE-CE2 3.96Å; M84-F121 HydrophobicContact CE-CZ 3.72Å; M84-F121 HydrophobicContact CG-CZ 3.97Å; M84-F121 HydrophobicContact SD-CZ 4.13Å; M84-V134 HydrophobicContact CB-CB 4.39Å; M84-V134 HydrophobicContact CB-CG1 3.6Å; M84-V134 HydrophobicContact CB-CG2 3.81Å; M84-V134 HydrophobicContact CG-CG1 4.3Å; M84-L137 WeakPolarHBondContact O-CD2 3.35Å; M84-V138 HydrophobicContact CE-CG1 4.21Å
85	A	95.8	Very high	95.6	Very high	44 Å²	44	47.4 Å²	47.4	36%	0.364	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-14.5	177.2	0	0	0	0	0	113.8	D81 K83 R130 V134	D81-A85 VanDerWaalsContact O-CB 3.3Å; D81-A85 WeakPolarHBondContact O-CB 3.28Å; D81-A85 PolarHBondContact O-N 3.12Å; K83-A85 VanDerWaalsContact C-N 3.34Å; K83-A85 PolarHBondContact O-N 3.3Å; A85-R130 HydrophobicContact CB-CG 4.29Å; A85-V134 HydrophobicContact CB-CG2 3.97Å
86	Q	93.1	Very high	95.5	Very high	94 Å²	94	53.7 Å²	53.7	44%	0.439	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-4.9	175.8	-59.9	171.7	43	0	0	112.5	I82 K83 M84 P103	I82-Q86 PolarHBondContact O-NE2 2.82Å; K83-Q86 PolarHBondContact O-N 3.38Å; M84-Q86 PolarHBondContact O-N 3.25Å; Q86-P103 HydrophobicContact CB-CG 3.99Å; Q86-P103 WeakPolarHBondContact O-CD 3.35Å
87	C	92.5	Very high	95.5	Very high	12 Å²	12	53.9 Å²	53.9	8%	0.081	27%	0.271	C	S	.	.			trans	-84.3	158	-174	-63.4	0	0	0	0	112.1	K83 M84 F100 V101 M108 L137	K83-C87 PolarHBondContact O-SG 2.82Å; M84-C87 VanDerWaalsContact O-CB 3.25Å; M84-C87 WeakPolarHBondContact O-CB 3.37Å; M84-C87 PolarHBondContact O-N 2.95Å; C87-F100 HydrophobicContact CB-CB 4.29Å; C87-V101 CarbonylContact C-O 3.22Å; C87-V101 WeakPolarHBondContact CA-O 3.31Å; C87-M108 VanDerWaalsContact SG-CG 3.54Å; C87-L137 HydrophobicContact CB-CD2 4.3Å
88	Q	93.5	Very high	95.5	Very high	137 Å²	137	53.1 Å²	53.1	64%	0.64	27%	0.269	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.1	137.4	171.1	-65.1	179.8	-2.6	0	0	109.6	I90 F100 V101	Q88-I90 HydrophobicContact CB-CG1 4.46Å; Q88-F100 CarbonylContact O-C 3.58Å; Q88-F100 WeakPolarHBondContact O-CA 3.31Å; Q88-V101 PolarHBondContact N-O 2.82Å; Q88-V101 PolarHBondContact O-N 2.9Å
89	R	97.7	Very high	95.6	Very high	98 Å²	98	52.8 Å²	52.8	37%	0.37	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	121.7	171	-176.3	-173.2	178.2	-78.3	-3.5	109.3	V98 F100 L137 D141	R89-V98 HydrophobicContact CG-CG1 3.67Å; R89-F100 HydrophobicContact CB-CD1 4.16Å; R89-F100 HydrophobicContact CB-CE1 3.81Å; R89-F100 HydrophobicContact CG-CE1 3.87Å; R89-F100 HydrophobicContact CG-CZ 4.08Å; R89-L137 HydrophobicContact CB-CD1 4.29Å; R89-D141 WeakPolarHBondContact CD-OD2 3.34Å; R89-D141 IonicContact CZ-OD1 2.91Å; R89-D141 IonicContact CZ-OD2 3.71Å; R89-D141 IonicContact NE-OD1 3.54Å; R89-D141 PolarHBondContact NE-OD1 2.9Å; R89-D141 IonicContact NE-OD2 2.72Å; R89-D141 PolarHBondContact NE-OD2 2.82Å; R89-D141 IonicContact NH2-OD1 2.95Å; R89-D141 PolarHBondContact NH2-OD1 2.95Å; R89-D141 IonicContact NH2-OD2 2.79Å
90	I	94.2	Very high	95.6	Very high	72 Å²	72	52.3 Å²	52.3	37%	0.369	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	124.1	-178.2	-59.6	-177.5	0	0	0	108.3	Q88 D99 V101	Q88-I90 HydrophobicContact CB-CG1 4.46Å; I90-D99 PolarHBondContact N-O 3.26Å; I90-D99 PolarHBondContact O-N 3.15Å; I90-V101 HydrophobicContact CD1-CB 3.93Å; I90-V101 HydrophobicContact CD1-CG2 3.78Å; I90-V101 HydrophobicContact CG1-CG2 4.33Å
91	V	95.4	Very high	95.4	Very high	77 Å²	77	51.5 Å²	51.5	47%	0.467	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	126.1	167.7	-178.4	0	0	0	0	107.6
92	N	92.4	Very high	94.9	Very high	33 Å²	33	52 Å²	52	18%	0.176	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	91.7	-178.7	-175.6	-22.5	0	0	0	109	V94 L95 E96 T97 D99	N92-V94 PolarHBondContact O-N 2.69Å; N92-V94 WeakPolarHBondContact OD1-CB 3.41Å; N92-V94 PolarHBondContact OD1-N 3.48Å; N92-L95 WeakPolarHBondContact ND2-CD1 3.46Å; N92-L95 PolarHBondContact O-N 3.11Å; N92-L95 PolarHBondContact OD1-N 3.36Å; N92-L95 VanDerWaalsContact OD1-N 3.15Å; N92-E96 WeakPolarHBondContact O-CA 3.24Å; N92-E96 PolarHBondContact O-N 3.31Å; N92-T97 WeakPolarHBondContact CB-OG1 3.46Å; N92-T97 PolarHBondContact N-O 3.09Å; N92-T97 PolarHBondContact O-N 3.2Å; N92-T97 VanDerWaalsContact O-N 3.1Å; N92-D99 PolarHBondContact ND2-OD2 3.13Å
93	D	92.3	Very high	94.3	Very high	102 Å²	102	51 Å²	51	55%	0.545	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-21	-177.3	-59.1	-49.3	0	0	0	113.2	L369	D93-L369 HydrophobicContact CB-CD1 3.73Å; D93-L369 HydrophobicContact CB-CD2 4.13Å
94	V	92.1	Very high	93.7	Very high	23 Å²	23	50.8 Å²	50.8	14%	0.139	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-45.4	178.2	175.7	0	0	0	0	110.5	N92 L362 K365 M366 L369	N92-V94 PolarHBondContact O-N 2.69Å; N92-V94 WeakPolarHBondContact OD1-CB 3.41Å; N92-V94 PolarHBondContact OD1-N 3.48Å; V94-L362 HydrophobicContact CG1-CB 4.31Å; V94-L362 HydrophobicContact CG1-CD2 4.04Å; V94-K365 HydrophobicContact CG1-CB 4.45Å; V94-K365 WeakPolarHBondContact O-CD 3.32Å; V94-M366 HydrophobicContact CB-CG 4.26Å; V94-M366 HydrophobicContact CG1-CG 3.7Å; V94-M366 HydrophobicContact CG1-SD 4.43Å; V94-M366 HydrophobicContact CG2-CB 4.43Å; V94-M366 HydrophobicContact CG2-CG 3.49Å; V94-M366 VanDerWaalsContact CG2-CG 3.49Å; V94-L369 HydrophobicContact CG2-CD1 3.61Å
95	L	95.4	Very high	93.1	Very high	16 Å²	16	56.2 Å²	56.2	8%	0.084	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95	-7.7	-178.5	-60.1	-179.5	0	0	0	113.2	N92 T97 R110 D310 L362	N92-L95 WeakPolarHBondContact ND2-CD1 3.46Å; N92-L95 PolarHBondContact O-N 3.11Å; N92-L95 PolarHBondContact OD1-N 3.36Å; N92-L95 VanDerWaalsContact OD1-N 3.15Å; L95-T97 VanDerWaalsContact C-N 3.28Å; L95-T97 HydrophobicContact CB-CG2 3.91Å; L95-T97 WeakPolarHBondContact O-CG2 3.49Å; L95-T97 PolarHBondContact O-N 3Å; L95-R110 VanDerWaalsContact CD1-NH1 3.27Å; L95-D310 HydrophobicContact CD1-CB 3.94Å; L95-D310 HydrophobicContact CD2-CB 4.15Å; L95-L362 HydrophobicContact CD2-CD1 3.94Å; L95-L362 HydrophobicContact CD2-CD2 3.72Å; L95-L362 HydrophobicContact CD2-CG 4.47Å
96	E	97.3	Very high	92.8	Very high	133 Å²	133	60.1 Å²	60.1	62%	0.621	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.6	44.8	-172	-60.5	162.5	-148.9	0	0	111	N92 K365	N92-E96 WeakPolarHBondContact O-CA 3.24Å; N92-E96 PolarHBondContact O-N 3.31Å; E96-K365 IonicContact OE1-NZ 3.61Å; E96-K365 PolarHBondContact OE1-NZ 3.36Å
97	T	98.6	Very high	92.9	Very high	4 Å²	4	58.2 Å²	58.2	3%	0.025	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	166.7	-178.6	63.1	0	0	0	0	112.5	L60 N92 L95 D99 R110 T111 C112 Y309	L60-T97 HydrophobicContact CD2-CG2 4.3Å; N92-T97 WeakPolarHBondContact CB-OG1 3.46Å; N92-T97 PolarHBondContact N-O 3.09Å; N92-T97 PolarHBondContact O-N 3.2Å; N92-T97 VanDerWaalsContact O-N 3.1Å; L95-T97 VanDerWaalsContact C-N 3.28Å; L95-T97 HydrophobicContact CB-CG2 3.91Å; L95-T97 WeakPolarHBondContact O-CG2 3.49Å; L95-T97 PolarHBondContact O-N 3Å; T97-D99 PolarHBondContact OG1-OD1 2.95Å; T97-R110 HydrophobicContact CG2-CG 3.96Å; T97-T111 WeakPolarHBondContact CA-O 3.28Å; T97-T111 VanDerWaalsContact CB-O 3.23Å; T97-T111 WeakPolarHBondContact CB-O 3.27Å; T97-C112 HydrophobicContact CG2-CB 4.23Å; T97-Y309 HydrophobicContact CG2-CD1 3.55Å; T97-Y309 HydrophobicContact CG2-CE1 3.77Å
98	V	98.7	Very high	93.2	Very high	19 Å²	19	59.1 Å²	59.1	12%	0.115	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	123.9	161.7	-179	0	0	0	0	108.1	R89 F100 R110 T111	R89-V98 HydrophobicContact CG-CG1 3.67Å; V98-F100 HydrophobicContact CG1-CE2 4Å; V98-F100 HydrophobicContact CG1-CZ 4.22Å; V98-R110 WeakPolarHBondContact O-CA 3.45Å; V98-T111 HydrophobicContact CB-CG2 4Å; V98-T111 PolarHBondContact N-O 3.22Å; V98-T111 PolarHBondContact O-N 2.64Å
99	D	98.4	Very high	93.4	Very high	6 Å²	6	53 Å²	53	3%	0.032	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	132.7	-175.5	-65.8	-10	0	0	0	110.2	I90 N92 T97 V101 V107 R110	I90-D99 PolarHBondContact N-O 3.26Å; I90-D99 PolarHBondContact O-N 3.15Å; N92-D99 PolarHBondContact ND2-OD2 3.13Å; T97-D99 PolarHBondContact OG1-OD1 2.95Å; D99-V101 HydrophobicContact CB-CG2 3.82Å; D99-V107 HydrophobicContact CB-CG1 4.09Å; D99-R110 VanDerWaalsContact OD1-CG 3.3Å; D99-R110 WeakPolarHBondContact OD1-CG 3.31Å; D99-R110 IonicContact OD1-CZ 3.84Å; D99-R110 IonicContact OD1-NE 2.69Å; D99-R110 PolarHBondContact OD1-NE 2.79Å; D99-R110 IonicContact OD1-NH2 3.18Å; D99-R110 IonicContact OD2-CZ 3.92Å; D99-R110 IonicContact OD2-NE 2.79Å; D99-R110 PolarHBondContact OD2-NE 2.95Å; D99-R110 IonicContact OD2-NH2 3.89Å; D99-R110 PolarHBondContact OD2-NH2 3.25Å
100	F	98.4	Very high	93.5	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	102.7	171.6	-64.3	-92.3	0	0	0	108.4	M84 C87 Q88 R89 V98 M108 F109 T111 L137 V138 D141	M84-F100 HydrophobicContact CE-CB 3.9Å; M84-F100 HydrophobicContact CE-CD1 4.45Å; M84-F100 HydrophobicContact CE-CG 4.23Å; C87-F100 HydrophobicContact CB-CB 4.29Å; Q88-F100 CarbonylContact O-C 3.58Å; Q88-F100 WeakPolarHBondContact O-CA 3.31Å; R89-F100 HydrophobicContact CB-CD1 4.16Å; R89-F100 HydrophobicContact CB-CE1 3.81Å; R89-F100 HydrophobicContact CG-CE1 3.87Å; R89-F100 HydrophobicContact CG-CZ 4.08Å; V98-F100 HydrophobicContact CG1-CE2 4Å; V98-F100 HydrophobicContact CG1-CZ 4.22Å; F100-M108 PolarHBondContact O-N 3.15Å; F100-F109 HydrophobicContact CB-CB 4.11Å; F100-F109 HydrophobicContact CD2-CB 3.97Å; F100-F109 AromaticContact CD2-CD1 3.39Å; F100-F109 HydrophobicContact CD2-CD1 3.39Å; F100-F109 HydrophobicContact CD2-CE1 4.28Å; F100-F109 HydrophobicContact CD2-CG 4.1Å; F100-F109 AromaticContact CE2-CD1 3.55Å; F100-F109 HydrophobicContact CE2-CD1 3.55Å; F100-F109 HydrophobicContact CE2-CE1 4Å; F100-F109 HydrophobicContact CG-CB 4.35Å; F100-F109 HydrophobicContact CG-CD1 4.31Å; F100-F109 PolarHBondContact N-O 2.67Å; F100-T111 HydrophobicContact CE2-CG2 4.4Å; F100-L137 HydrophobicContact CD1-CD1 4.2Å; F100-L137 HydrophobicContact CD1-CD2 4.09Å; F100-L137 HydrophobicContact CD1-CG 3.85Å; F100-L137 HydrophobicContact CE1-CD1 4.14Å; F100-L137 HydrophobicContact CE1-CG 3.84Å; F100-L137 WeakPolarHBondContact CE1-O 3.36Å; F100-V138 HydrophobicContact CD1-CG1 4.02Å; F100-V138 HydrophobicContact CE1-CB 4.27Å; F100-V138 HydrophobicContact CE1-CG1 3.67Å; F100-V138 HydrophobicContact CE2-CG1 4.34Å; F100-V138 HydrophobicContact CZ-CB 4.06Å; F100-V138 HydrophobicContact CZ-CG1 3.82Å; F100-D141 HydrophobicContact CE2-CB 4.48Å; F100-D141 HydrophobicContact CZ-CB 4.32Å; F100-D141 WeakPolarHBondContact CZ-OD2 3.05Å
101	V	93.4	Very high	93.7	Very high	24 Å²	24	46.6 Å²	46.6	15%	0.145	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	124.9	-165.5	-173.7	0	0	0	0	110.6	C87 Q88 I90 D99 V107	C87-V101 CarbonylContact C-O 3.22Å; C87-V101 WeakPolarHBondContact CA-O 3.31Å; Q88-V101 PolarHBondContact N-O 2.82Å; Q88-V101 PolarHBondContact O-N 2.9Å; I90-V101 HydrophobicContact CD1-CB 3.93Å; I90-V101 HydrophobicContact CD1-CG2 3.78Å; I90-V101 HydrophobicContact CG1-CG2 4.33Å; D99-V101 HydrophobicContact CB-CG2 3.82Å; V101-V107 HydrophobicContact CG2-CG2 4.22Å
102	A	86.1	Confident	93.8	Very high	11 Å²	11	43.3 Å²	43.3	9%	0.091	22%	0.221	C	C	.	.			trans	-74.7	165.9	177.3	0	0	0	0	0	112.1	D104 E105 R106 M108	A102-D104 VanDerWaalsContact CB-OD1 3.29Å; A102-D104 WeakPolarHBondContact CB-OD1 3.46Å; A102-D104 PolarHBondContact O-N 2.92Å; A102-E105 WeakPolarHBondContact O-CA 3.05Å; A102-E105 PolarHBondContact O-N 3.35Å; A102-R106 PolarHBondContact N-O 2.85Å; A102-M108 HydrophobicContact CB-CG 3.77Å; A102-M108 HydrophobicContact CB-SD 4.28Å
103	P	82.9	Confident	94.1	Very high	66 Å²	66	48 Å²	48	43%	0.429	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-10.9	179.1	-23.4	35	0	0	0	114.6	Q86 E105 K449	Q86-P103 HydrophobicContact CB-CG 3.99Å; Q86-P103 WeakPolarHBondContact O-CD 3.35Å; P103-E105 VanDerWaalsContact C-N 3.29Å; P103-K449 WeakPolarHBondContact O-CE 3.42Å; P103-K449 PolarHBondContact O-NZ 2.96Å
104	D	81.3	Confident	94.4	Very high	96 Å²	96	49.2 Å²	49.2	51%	0.513	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	12.3	171.4	60.3	0.4	0	0	0	112.7	A102 R106	A102-D104 VanDerWaalsContact CB-OD1 3.29Å; A102-D104 WeakPolarHBondContact CB-OD1 3.46Å; A102-D104 PolarHBondContact O-N 2.92Å; D104-R106 PolarHBondContact O-N 2.81Å; D104-R106 VanDerWaalsContact OD1-CB 3.27Å; D104-R106 WeakPolarHBondContact OD1-CB 3.37Å; D104-R106 PolarHBondContact OD1-N 3.49Å
105	E	84.9	Confident	94.7	Very high	113 Å²	113	48.1 Å²	48.1	53%	0.528	23%	0.232	S	C	.	.	S	Bend	trans	67.8	6.8	-177.2	-51.4	-176.4	167.3	0	0	114	A102 P103 K390 K449	A102-E105 WeakPolarHBondContact O-CA 3.05Å; A102-E105 PolarHBondContact O-N 3.35Å; P103-E105 VanDerWaalsContact C-N 3.29Å; E105-K390 IonicContact OE1-NZ 3.15Å; E105-K390 PolarHBondContact OE1-NZ 3.39Å; E105-K449 IonicContact OE1-NZ 2.93Å
106	R	89.4	Confident	94.8	Very high	126 Å²	126	50.4 Å²	50.4	48%	0.475	24%	0.241	S	C	.	.			trans	-75.9	129.8	173.8	-170.8	174.2	65.7	-149.9	-5	110.6	A102 D104 M108	A102-R106 PolarHBondContact N-O 2.85Å; D104-R106 PolarHBondContact O-N 2.81Å; D104-R106 VanDerWaalsContact OD1-CB 3.27Å; D104-R106 WeakPolarHBondContact OD1-CB 3.37Å; D104-R106 PolarHBondContact OD1-N 3.49Å; R106-M108 HydrophobicContact CG-SD 4.48Å; R106-M108 PolarHBondContact NE-SD 3.24Å; R106-M108 PolarHBondContact NH2-SD 3.27Å; R106-M108 PolarHBondContact O-N 3.36Å
107	V	96.3	Very high	94.8	Very high	55 Å²	55	49.8 Å²	49.8	33%	0.333	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	113.7	169.5	-174.9	0	0	0	0	108.7	D99 V101 F109 R110	D99-V107 HydrophobicContact CB-CG1 4.09Å; V101-V107 HydrophobicContact CG2-CG2 4.22Å; V107-F109 WeakPolarHBondContact CG1-O 3.47Å; V107-R110 HydrophobicContact CG1-CB 3.91Å
108	M	97.7	Very high	94.8	Very high	31 Å²	31	55 Å²	55	15%	0.153	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	-36.3	-179.3	-66	-60.1	-56.3	0	0	112	L79 K83 M84 C87 F100 A102 R106	L79-M108 WeakPolarHBondContact CD1-O 3.35Å; L79-M108 HydrophobicContact CD2-CE 4.48Å; L79-M108 WeakPolarHBondContact CD2-O 3.3Å; K83-M108 HydrophobicContact CB-CE 4.19Å; M84-M108 HydrophobicContact SD-CB 3.68Å; C87-M108 VanDerWaalsContact SG-CG 3.54Å; F100-M108 PolarHBondContact O-N 3.15Å; A102-M108 HydrophobicContact CB-CG 3.77Å; A102-M108 HydrophobicContact CB-SD 4.28Å; R106-M108 HydrophobicContact CG-SD 4.48Å; R106-M108 PolarHBondContact NE-SD 3.24Å; R106-M108 PolarHBondContact NH2-SD 3.27Å; R106-M108 PolarHBondContact O-N 3.36Å
109	F	98.8	Very high	94.8	Very high	7 Å²	7	54.1 Å²	54.1	3%	0.031	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	136.1	173.9	-179.7	-129	0	0	0	108.4	C76 L79 M84 F100 V107 T111 V119 F121 V142	C76-F109 HydrophobicContact CB-CD2 4.29Å; C76-F109 HydrophobicContact CB-CE2 3.79Å; L79-F109 HydrophobicContact CD1-CB 3.68Å; L79-F109 HydrophobicContact CD1-CD2 4.19Å; L79-F109 HydrophobicContact CD1-CG 4.16Å; M84-F109 HydrophobicContact CE-CB 4.31Å; F100-F109 HydrophobicContact CB-CB 4.11Å; F100-F109 HydrophobicContact CD2-CB 3.97Å; F100-F109 AromaticContact CD2-CD1 3.39Å; F100-F109 HydrophobicContact CD2-CD1 3.39Å; F100-F109 HydrophobicContact CD2-CE1 4.28Å; F100-F109 HydrophobicContact CD2-CG 4.1Å; F100-F109 AromaticContact CE2-CD1 3.55Å; F100-F109 HydrophobicContact CE2-CD1 3.55Å; F100-F109 HydrophobicContact CE2-CE1 4Å; F100-F109 HydrophobicContact CG-CB 4.35Å; F100-F109 HydrophobicContact CG-CD1 4.31Å; F100-F109 PolarHBondContact N-O 2.67Å; V107-F109 WeakPolarHBondContact CG1-O 3.47Å; F109-T111 HydrophobicContact CE1-CG2 3.98Å; F109-T111 HydrophobicContact CZ-CG2 4.33Å; F109-V119 HydrophobicContact CZ-CG2 4.26Å; F109-F121 HydrophobicContact CB-CE2 4.14Å; F109-F121 AromaticContact CD1-CD2 3.78Å; F109-F121 HydrophobicContact CD1-CD2 3.78Å; F109-F121 AromaticContact CD1-CE2 3.76Å; F109-F121 HydrophobicContact CD1-CE2 3.76Å; F109-F121 HydrophobicContact CD2-CD2 4.39Å; F109-F121 HydrophobicContact CD2-CE2 4.36Å; F109-F121 AromaticContact CE1-CD2 3.81Å; F109-F121 HydrophobicContact CE1-CD2 3.81Å; F109-F121 HydrophobicContact CE1-CE2 4.28Å; F109-F121 HydrophobicContact CE2-CD2 4.4Å; F109-F121 HydrophobicContact CG-CD2 4.12Å; F109-F121 AromaticContact CG-CE2 3.84Å; F109-F121 HydrophobicContact CG-CE2 3.84Å; F109-F121 HydrophobicContact CZ-CD2 4.13Å; F109-V142 HydrophobicContact CE1-CG1 3.71Å; F109-V142 HydrophobicContact CZ-CG1 3.98Å
110	R	98.8	Very high	94.8	Very high	35 Å²	35	53.9 Å²	53.9	13%	0.132	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	129.2	174.3	172.5	170.5	-76	163.6	0.5	107.2	L60 R63 L95 T97 V98 D99 V107 Y309 D310	L60-R110 HydrophobicContact CD2-CG 3.82Å; R63-R110 PolarHBondContact NH2-O 2.91Å; L95-R110 VanDerWaalsContact CD1-NH1 3.27Å; T97-R110 HydrophobicContact CG2-CG 3.96Å; V98-R110 WeakPolarHBondContact O-CA 3.45Å; D99-R110 VanDerWaalsContact OD1-CG 3.3Å; D99-R110 WeakPolarHBondContact OD1-CG 3.31Å; D99-R110 IonicContact OD1-CZ 3.84Å; D99-R110 IonicContact OD1-NE 2.69Å; D99-R110 PolarHBondContact OD1-NE 2.79Å; D99-R110 IonicContact OD1-NH2 3.18Å; D99-R110 IonicContact OD2-CZ 3.92Å; D99-R110 IonicContact OD2-NE 2.79Å; D99-R110 PolarHBondContact OD2-NE 2.95Å; D99-R110 IonicContact OD2-NH2 3.89Å; D99-R110 PolarHBondContact OD2-NH2 3.25Å; V107-R110 HydrophobicContact CG1-CB 3.91Å; R110-Y309 PolarHBondContact NH1-O 3.15Å; R110-D310 PolarHBondContact NH1-O 3.22Å
111	T	98.9	Very high	94.8	Very high	2 Å²	2	53.9 Å²	53.9	1%	0.012	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	166	177.8	-176.3	0	0	0	0	109.6	T97 V98 F100 F109 E115 D141	T97-T111 WeakPolarHBondContact CA-O 3.28Å; T97-T111 VanDerWaalsContact CB-O 3.23Å; T97-T111 WeakPolarHBondContact CB-O 3.27Å; V98-T111 HydrophobicContact CB-CG2 4Å; V98-T111 PolarHBondContact N-O 3.22Å; V98-T111 PolarHBondContact O-N 2.64Å; F100-T111 HydrophobicContact CE2-CG2 4.4Å; F109-T111 HydrophobicContact CE1-CG2 3.98Å; F109-T111 HydrophobicContact CZ-CG2 4.33Å; T111-E115 PolarHBondContact OG1-OE1 2.85Å; T111-E115 VanDerWaalsContact OG1-OE1 3.1Å; T111-D141 HydrophobicContact CG2-CB 3.82Å
112	C	98.6	Very high	95.1	Very high	8 Å²	8	52.8 Å²	52.8	5%	0.054	25%	0.248	C	C	.	.			trans	-142.7	164.2	174.9	68.8	0	0	0	0	110.8	T97 R114 E115 K116 Y309	T97-C112 HydrophobicContact CG2-CB 4.23Å; C112-R114 PolarHBondContact O-N 3.27Å; C112-E115 PolarHBondContact O-N 3.02Å; C112-E115 VanDerWaalsContact O-N 3.12Å; C112-K116 PolarHBondContact O-N 3.34Å; C112-Y309 HydrophobicContact CB-CE1 4.44Å
113	E	98.3	Very high	95.7	Very high	131 Å²	131	52.2 Å²	52.2	61%	0.612	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	-54.2	-33.1	-176	-169.7	61.8	-162.3	0	0	112.5	E115 K116	E113-E115 VanDerWaalsContact C-N 3.28Å; E113-E115 PolarHBondContact O-N 3.09Å; E113-K116 WeakPolarHBondContact O-CB 3.42Å; E113-K116 PolarHBondContact O-N 2.87Å; E113-K116 IonicContact OE1-NZ 3.62Å; E113-K116 VanDerWaalsContact OE2-CD 3.3Å; E113-K116 WeakPolarHBondContact OE2-CD 3.45Å; E113-K116 IonicContact OE2-NZ 3.98Å
114	R	98.2	Very high	96.4	Very high	128 Å²	128	49.1 Å²	49.1	48%	0.483	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	-60.3	-32.3	-178	-172.3	174	-175.1	-145.1	-0.3	114.5	L64 D68 C112 Y305	L64-R114 HydrophobicContact CD2-CB 4.36Å; L64-R114 HydrophobicContact CD2-CG 4.37Å; D68-R114 IonicContact OD1-CZ 2.9Å; D68-R114 IonicContact OD1-NH1 2.77Å; D68-R114 PolarHBondContact OD1-NH1 2.99Å; D68-R114 VanDerWaalsContact OD1-NH1 3.1Å; D68-R114 IonicContact OD1-NH2 3.66Å; D68-R114 PolarHBondContact OD1-NH2 3.27Å; C112-R114 PolarHBondContact O-N 3.27Å; R114-Y305 PolarHBondContact NH1-OH 2.84Å
115	E	98.4	Very high	97.2	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-107.2	-3.9	179.9	66.2	168.3	-166.1	0	0	113.5	L60 R63 L64 L67 T111 C112 E113 D117 R118 V119	L60-E115 VanDerWaalsContact CD1-CD 3.44Å; L60-E115 HydrophobicContact CD1-CG 4.24Å; L60-E115 VanDerWaalsContact CD1-OE1 3.29Å; L60-E115 WeakPolarHBondContact CD1-OE1 3.46Å; R63-E115 VanDerWaalsContact CB-OE2 3.24Å; R63-E115 WeakPolarHBondContact CB-OE2 3.19Å; R63-E115 IonicContact CZ-OE1 3.86Å; R63-E115 IonicContact CZ-OE2 2.81Å; R63-E115 IonicContact NE-OE1 3.53Å; R63-E115 PolarHBondContact NE-OE1 3.18Å; R63-E115 VanDerWaalsContact NE-OE1 3.16Å; R63-E115 IonicContact NE-OE2 2.78Å; R63-E115 PolarHBondContact NE-OE2 3.02Å; R63-E115 IonicContact NH2-OE1 3.78Å; R63-E115 PolarHBondContact NH2-OE1 2.87Å; R63-E115 IonicContact NH2-OE2 2.8Å; L64-E115 HydrophobicContact CD2-CB 4.04Å; L64-E115 HydrophobicContact CD2-CG 4.33Å; L67-E115 HydrophobicContact CD1-CB 3.68Å; T111-E115 PolarHBondContact OG1-OE1 2.85Å; T111-E115 VanDerWaalsContact OG1-OE1 3.1Å; C112-E115 PolarHBondContact O-N 3.02Å; C112-E115 VanDerWaalsContact O-N 3.12Å; E113-E115 VanDerWaalsContact C-N 3.28Å; E113-E115 PolarHBondContact O-N 3.09Å; E115-D117 VanDerWaalsContact C-N 3.27Å; E115-D117 PolarHBondContact O-N 3.37Å; E115-D117 VanDerWaalsContact O-N 3.16Å; E115-R118 CarbonylContact O-C 3.55Å; E115-R118 WeakPolarHBondContact O-CA 3.27Å; E115-R118 PolarHBondContact O-N 2.96Å; E115-V119 HydrophobicContact CB-CB 4.25Å; E115-V119 HydrophobicContact CG-CB 4.02Å; E115-V119 HydrophobicContact CG-CG1 4.13Å; E115-V119 WeakPolarHBondContact O-CB 3.35Å; E115-V119 WeakPolarHBondContact O-CG1 3.37Å; E115-V119 PolarHBondContact O-N 3.16Å
116	K	97.3	Very high	97.8	Very high	64 Å²	64	39.9 Å²	39.9	28%	0.278	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.7	-45.2	-172.5	179.6	-180	175.4	-175	0	113.4	C112 E113 R118 Q140 V142 A143	C112-K116 PolarHBondContact O-N 3.34Å; E113-K116 WeakPolarHBondContact O-CB 3.42Å; E113-K116 PolarHBondContact O-N 2.87Å; E113-K116 IonicContact OE1-NZ 3.62Å; E113-K116 VanDerWaalsContact OE2-CD 3.3Å; E113-K116 WeakPolarHBondContact OE2-CD 3.45Å; E113-K116 IonicContact OE2-NZ 3.98Å; K116-R118 PolarHBondContact O-N 2.93Å; K116-Q140 WeakPolarHBondContact CE-O 3.29Å; K116-V142 CarbonylContact O-C 3.29Å; K116-A143 WeakPolarHBondContact O-CB 3.4Å; K116-A143 PolarHBondContact O-N 2.81Å
117	D	97	Very high	98.2	Very high	120 Å²	120	36.5 Å²	36.5	64%	0.642	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.2	4	-179.4	-59.6	-36.6	0	0	0	114.1	E115 A143	E115-D117 VanDerWaalsContact C-N 3.27Å; E115-D117 PolarHBondContact O-N 3.37Å; E115-D117 VanDerWaalsContact O-N 3.16Å; D117-A143 VanDerWaalsContact C-CB 3.4Å; D117-A143 WeakPolarHBondContact O-CB 3.48Å
118	R	98.4	Very high	98.3	Very high	114 Å²	114	35.3 Å²	35.3	43%	0.43	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-134	-14.8	-175.3	-58.5	-174.6	-176.2	-160.4	1.8	114.6	L67 D72 V74 E115 K116	L67-R118 HydrophobicContact CD2-CB 4.13Å; D72-R118 WeakPolarHBondContact O-CD 3.47Å; V74-R118 PolarHBondContact N-O 3.31Å; E115-R118 CarbonylContact O-C 3.55Å; E115-R118 WeakPolarHBondContact O-CA 3.27Å; E115-R118 PolarHBondContact O-N 2.96Å; K116-R118 PolarHBondContact O-N 2.93Å
119	V	98.8	Very high	98.3	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	130.4	-177.2	67.1	0	0	0	0	110.7	V74 F109 E115 V142 A143	V74-V119 HydrophobicContact CG2-CB 4.23Å; V74-V119 HydrophobicContact CG2-CG2 4.44Å; V74-V119 CarbonylContact O-C 3.6Å; V74-V119 VanDerWaalsContact O-CA 3.27Å; V74-V119 WeakPolarHBondContact O-CA 3.5Å; F109-V119 HydrophobicContact CZ-CG2 4.26Å; E115-V119 HydrophobicContact CB-CB 4.25Å; E115-V119 HydrophobicContact CG-CB 4.02Å; E115-V119 HydrophobicContact CG-CG1 4.13Å; E115-V119 WeakPolarHBondContact O-CB 3.35Å; E115-V119 WeakPolarHBondContact O-CG1 3.37Å; E115-V119 PolarHBondContact O-N 3.16Å; V119-V142 HydrophobicContact CG1-CB 4.01Å; V119-V142 HydrophobicContact CG1-CG1 3.99Å; V119-A143 WeakPolarHBondContact O-CB 3.49Å; V119-A143 PolarHBondContact O-N 3.43Å
120	V	98.9	Very high	98.3	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	123	175.4	-175	0	0	0	0	109.1	L43 F45 V73 V74 Y75 C76 Q122 A144 D146	L43-V120 HydrophobicContact CD2-CG2 4.12Å; F45-V120 HydrophobicContact CE1-CG2 4.26Å; F45-V120 HydrophobicContact CZ-CG2 4.4Å; V73-V120 HydrophobicContact CG1-CG2 3.45Å; V73-V120 VanDerWaalsContact CG1-CG2 3.45Å; V74-V120 PolarHBondContact O-N 3.33Å; Y75-V120 WeakPolarHBondContact CA-O 3.43Å; Y75-V120 HydrophobicContact CD1-CB 3.76Å; Y75-V120 HydrophobicContact CD1-CG1 3.69Å; Y75-V120 HydrophobicContact CD2-CB 4.09Å; Y75-V120 HydrophobicContact CD2-CG2 4.22Å; Y75-V120 HydrophobicContact CE1-CB 3.79Å; Y75-V120 HydrophobicContact CE1-CG1 3.39Å; Y75-V120 HydrophobicContact CE1-CG2 4.32Å; Y75-V120 HydrophobicContact CE2-CB 4.09Å; Y75-V120 HydrophobicContact CE2-CG1 4.46Å; Y75-V120 HydrophobicContact CE2-CG2 3.9Å; Y75-V120 HydrophobicContact CG-CB 3.91Å; Y75-V120 HydrophobicContact CG-CG1 4.36Å; C76-V120 PolarHBondContact N-O 2.94Å; V120-Q122 PolarHBondContact O-N 3.24Å; V120-A144 HydrophobicContact CG1-CB 4.04Å; V120-A144 HydrophobicContact CG2-CB 4.12Å; V120-D146 HydrophobicContact CG1-CB 3.68Å
121	F	98.9	Very high	98.3	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	108.8	178.8	-173.2	-90.6	0	0	0	110.7	L79 M84 F109 M123 V134 V138 V142 A144 I145 D146	L79-F121 HydrophobicContact CB-CZ 4.01Å; L79-F121 HydrophobicContact CD1-CE2 3.57Å; L79-F121 HydrophobicContact CD1-CZ 3.85Å; M84-F121 HydrophobicContact CE-CE2 3.96Å; M84-F121 HydrophobicContact CE-CZ 3.72Å; M84-F121 HydrophobicContact CG-CZ 3.97Å; M84-F121 HydrophobicContact SD-CZ 4.13Å; F109-F121 HydrophobicContact CB-CE2 4.14Å; F109-F121 AromaticContact CD1-CD2 3.78Å; F109-F121 HydrophobicContact CD1-CD2 3.78Å; F109-F121 AromaticContact CD1-CE2 3.76Å; F109-F121 HydrophobicContact CD1-CE2 3.76Å; F109-F121 HydrophobicContact CD2-CD2 4.39Å; F109-F121 HydrophobicContact CD2-CE2 4.36Å; F109-F121 AromaticContact CE1-CD2 3.81Å; F109-F121 HydrophobicContact CE1-CD2 3.81Å; F109-F121 HydrophobicContact CE1-CE2 4.28Å; F109-F121 HydrophobicContact CE2-CD2 4.4Å; F109-F121 HydrophobicContact CG-CD2 4.12Å; F109-F121 AromaticContact CG-CE2 3.84Å; F109-F121 HydrophobicContact CG-CE2 3.84Å; F109-F121 HydrophobicContact CZ-CD2 4.13Å; F121-M123 HydrophobicContact CD1-CB 4.47Å; F121-M123 HydrophobicContact CD1-CE 4.34Å; F121-M123 HydrophobicContact CE1-CB 4.03Å; F121-M123 HydrophobicContact CE1-CE 4.33Å; F121-V134 HydrophobicContact CE1-CG1 3.82Å; F121-V134 HydrophobicContact CZ-CG1 4.26Å; F121-V138 HydrophobicContact CB-CG2 4.14Å; F121-V138 HydrophobicContact CD1-CG2 3.95Å; F121-V138 HydrophobicContact CD2-CB 4.44Å; F121-V138 HydrophobicContact CD2-CG1 4.23Å; F121-V138 HydrophobicContact CD2-CG2 4.21Å; F121-V138 HydrophobicContact CE1-CG2 4.43Å; F121-V138 HydrophobicContact CE2-CG1 4.03Å; F121-V138 HydrophobicContact CG-CG2 3.83Å; F121-V138 HydrophobicContact CZ-CG1 4.25Å; F121-V142 HydrophobicContact CB-CB 4.38Å; F121-V142 HydrophobicContact CB-CG1 4.13Å; F121-V142 HydrophobicContact CB-CG2 4.12Å; F121-A144 PolarHBondContact N-O 3.29Å; F121-I145 HydrophobicContact CB-CD1 4.18Å; F121-D146 PolarHBondContact O-N 3.14Å
122	Q	98.9	Very high	98.3	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.005	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	122.6	175.2	-175.9	176.1	84.7	0	0	111.7	P53 C76 L79 V120 D146 N148	P53-Q122 HydrophobicContact CB-CB 4.18Å; P53-Q122 HydrophobicContact CB-CG 4.45Å; P53-Q122 VanDerWaalsContact CG-CD 3.49Å; P53-Q122 VanDerWaalsContact CG-NE2 3.27Å; C76-Q122 PolarHBondContact SG-N 3.08Å; L79-Q122 PolarHBondContact N-O 3.4Å; V120-Q122 PolarHBondContact O-N 3.24Å; Q122-D146 CarbonylContact C-O 3.58Å; Q122-D146 WeakPolarHBondContact CA-O 3.28Å; Q122-D146 HydrophobicContact CB-CB 4.21Å; Q122-D146 HydrophobicContact CG-CB 4.37Å; Q122-D146 WeakPolarHBondContact CG-OD2 3.49Å; Q122-D146 PolarHBondContact NE2-OD2 2.86Å; Q122-N148 HydrophobicContact CG-CB 3.97Å; Q122-N148 PolarHBondContact OE1-ND2 3.49Å
123	M	98.6	Very high	98.3	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	145.6	171.5	68.8	178.6	73.5	0	0	113.6	L79 F121 T125 A131 V134 A135 I145 D146 V147 N148	L79-M123 VanDerWaalsContact O-CA 3.25Å; L79-M123 WeakPolarHBondContact O-CA 3.45Å; F121-M123 HydrophobicContact CD1-CB 4.47Å; F121-M123 HydrophobicContact CD1-CE 4.34Å; F121-M123 HydrophobicContact CE1-CB 4.03Å; F121-M123 HydrophobicContact CE1-CE 4.33Å; M123-T125 HydrophobicContact CG-CG2 4.12Å; M123-T125 HydrophobicContact SD-CG2 4.09Å; M123-A131 HydrophobicContact SD-CB 3.89Å; M123-V134 HydrophobicContact CE-CB 4.09Å; M123-V134 HydrophobicContact CE-CG1 3.85Å; M123-A135 HydrophobicContact CE-CB 3.96Å; M123-I145 HydrophobicContact CE-CG2 3.73Å; M123-D146 PolarHBondContact N-O 3.08Å; M123-V147 HydrophobicContact CG-CG2 4.48Å; M123-N148 PolarHBondContact O-N 3.48Å
124	G	98.2	Very high	98.3	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	120.8	159.4	0	0	0	0	0	109	E78 L79 D81 M161	E78-G124 WeakPolarHBondContact OE1-CA 3.31Å; L79-G124 PolarHBondContact O-N 2.95Å; D81-G124 WeakPolarHBondContact CB-O 3.31Å; D81-G124 VanDerWaalsContact CG-O 3.29Å; D81-G124 PolarHBondContact N-O 3.49Å; G124-M161 VanDerWaalsContact O-SD 3.39Å
125	T	98.1	Very high	98.3	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.157	C	C	.	.			trans	-147.4	157.1	-178.6	-176.5	0	0	0	0	111.7	D81 M123 D127 A131 V147 M161 L165 I175	D81-T125 WeakPolarHBondContact OD2-CA 3.27Å; D81-T125 WeakPolarHBondContact OD2-CB 3.17Å; D81-T125 PolarHBondContact OD2-OG1 3.01Å; M123-T125 HydrophobicContact CG-CG2 4.12Å; M123-T125 HydrophobicContact SD-CG2 4.09Å; T125-D127 PolarHBondContact OG1-N 2.95Å; T125-D127 PolarHBondContact OG1-O 3.2Å; T125-A131 HydrophobicContact CG2-CB 3.83Å; T125-V147 HydrophobicContact CG2-CG1 3.97Å; T125-V147 HydrophobicContact CG2-CG2 4.5Å; T125-M161 VanDerWaalsContact C-CG 3.48Å; T125-L165 WeakPolarHBondContact O-CD1 3.41Å; T125-I175 HydrophobicContact CG2-CD1 4.46Å; T125-I175 HydrophobicContact CG2-CG2 4.03Å
126	A	96.5	Very high	98.3	Very high	15 Å²	15	35.8 Å²	35.8	12%	0.124	18%	0.178	C	C	.	.	S	Bend	trans	-136.7	13.4	172.8	0	0	0	0	0	112.1	G159 G160 M161	A126-G159 WeakPolarHBondContact CB-O 3.23Å; A126-G160 WeakPolarHBondContact CB-O 3.42Å; A126-M161 HydrophobicContact CB-CG 3.88Å
127	D	98.1	Very high	98.4	Very high	56 Å²	56	34.9 Å²	34.9	30%	0.299	18%	0.176	S	C	.	.			trans	-141.5	119	-171.4	-176.4	-90.1	0	0	0	110.5	T125 D129 R130 A131	T125-D127 PolarHBondContact OG1-N 2.95Å; T125-D127 PolarHBondContact OG1-O 3.2Å; D127-D129 PolarHBondContact O-N 3.36Å; D127-D129 PolarHBondContact OD1-N 3.45Å; D127-R130 HydrophobicContact CB-CB 4.11Å; D127-R130 VanDerWaalsContact CB-CZ 3.45Å; D127-R130 VanDerWaalsContact CB-NH2 3.27Å; D127-R130 WeakPolarHBondContact OD1-CB 3.27Å; D127-R130 PolarHBondContact OD1-N 3.28Å; D127-R130 IonicContact OD1-NH1 3.35Å; D127-R130 IonicContact OD2-NH1 3.82Å; D127-A131 VanDerWaalsContact O-CB 3.3Å; D127-A131 WeakPolarHBondContact O-CB 3.34Å; D127-A131 PolarHBondContact O-N 3.06Å
128	P	98.4	Very high	98.5	Very high	30 Å²	30	29.1 Å²	29.1	20%	0.195	15%	0.145	C	C	.	.	H	α-helix	trans	-60.1	-40	-175.5	-25	33	0	0	0	114.7	L132 A174 I175 K178	P128-L132 PolarHBondContact O-N 2.85Å; P128-A174 HydrophobicContact CG-CB 3.92Å; P128-I175 HydrophobicContact CB-CG1 4.39Å; P128-I175 HydrophobicContact CG-CG1 3.86Å; P128-K178 HydrophobicContact CB-CB 4.03Å; P128-K178 HydrophobicContact CB-CG 4.17Å
129	D	98.5	Very high	98.5	Very high	92 Å²	92	25.3 Å²	25.3	49%	0.492	13%	0.132	S	C	.	.	H	α-helix	trans	-76.2	-38.7	-173.9	-67.2	-43.7	0	0	0	111.5	D127 L132 T133 K178	D127-D129 PolarHBondContact O-N 3.36Å; D127-D129 PolarHBondContact OD1-N 3.45Å; D129-L132 PolarHBondContact O-N 3.31Å; D129-T133 PolarHBondContact O-N 2.91Å; D129-T133 PolarHBondContact O-OG1 2.57Å; D129-K178 WeakPolarHBondContact OD1-CE 3.35Å; D129-K178 IonicContact OD1-NZ 2.75Å; D129-K178 PolarHBondContact OD1-NZ 3.32Å
130	R	98.4	Very high	98.4	Very high	67 Å²	67	32.1 Å²	32.1	25%	0.253	16%	0.164	S	C	.	.	H	α-helix	trans	-68.2	-38	173	-167.6	168.4	60.7	-99.4	-7.8	111.7	D81 A85 D127 L132 T133 V134	D81-R130 HydrophobicContact CB-CG 4.2Å; D81-R130 IonicContact OD1-CZ 2.76Å; D81-R130 IonicContact OD1-NE 2.71Å; D81-R130 PolarHBondContact OD1-NE 2.99Å; D81-R130 IonicContact OD1-NH2 3.1Å; D81-R130 IonicContact OD2-CZ 3.67Å; D81-R130 VanDerWaalsContact OD2-CZ 3.23Å; D81-R130 IonicContact OD2-NE 2.72Å; D81-R130 PolarHBondContact OD2-NE 3.35Å; D81-R130 IonicContact OD2-NH2 3.63Å; D81-R130 PolarHBondContact OD2-NH2 2.89Å; A85-R130 HydrophobicContact CB-CG 4.29Å; D127-R130 HydrophobicContact CB-CB 4.11Å; D127-R130 VanDerWaalsContact CB-CZ 3.45Å; D127-R130 VanDerWaalsContact CB-NH2 3.27Å; D127-R130 WeakPolarHBondContact OD1-CB 3.27Å; D127-R130 PolarHBondContact OD1-N 3.28Å; D127-R130 IonicContact OD1-NH1 3.35Å; D127-R130 IonicContact OD2-NH1 3.82Å; R130-L132 VanDerWaalsContact C-N 3.34Å; R130-T133 PolarHBondContact O-N 2.7Å; R130-V134 WeakPolarHBondContact O-CG2 3.4Å; R130-V134 PolarHBondContact O-N 3.34Å; R130-V134 VanDerWaalsContact O-N 3.08Å
131	A	98.8	Very high	98.4	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-57.2	-49	172.6	0	0	0	0	0	111	M123 T125 D127 T133 V134 A135 I175 L179	M123-A131 HydrophobicContact SD-CB 3.89Å; T125-A131 HydrophobicContact CG2-CB 3.83Å; D127-A131 VanDerWaalsContact O-CB 3.3Å; D127-A131 WeakPolarHBondContact O-CB 3.34Å; D127-A131 PolarHBondContact O-N 3.06Å; A131-T133 PolarHBondContact O-N 3.19Å; A131-V134 PolarHBondContact O-N 2.93Å; A131-A135 WeakPolarHBondContact O-CB 3.37Å; A131-A135 PolarHBondContact O-N 3.03Å; A131-I175 HydrophobicContact CB-CG2 4.19Å; A131-L179 HydrophobicContact CB-CD1 4.36Å; A131-L179 HydrophobicContact CB-CD2 4.07Å; A131-L179 HydrophobicContact CB-CG 4.34Å
132	L	98.8	Very high	98.4	Very high	21 Å²	21	32.9 Å²	32.9	11%	0.11	17%	0.168	C	C	.	.	H	α-helix	trans	-61.8	-43.1	178.1	180	60.4	0	0	0	112.2	P128 D129 R130 V134 A135 Q136 K178 V183	P128-L132 PolarHBondContact O-N 2.85Å; D129-L132 PolarHBondContact O-N 3.31Å; R130-L132 VanDerWaalsContact C-N 3.34Å; L132-V134 VanDerWaalsContact C-N 3.29Å; L132-V134 PolarHBondContact O-N 2.89Å; L132-A135 PolarHBondContact O-N 2.84Å; L132-Q136 HydrophobicContact CD1-CG 3.94Å; L132-Q136 HydrophobicContact CG-CG 4.37Å; L132-Q136 WeakPolarHBondContact O-CG 3.3Å; L132-Q136 PolarHBondContact O-N 2.8Å; L132-K178 HydrophobicContact CB-CG 4.14Å; L132-K178 HydrophobicContact CD2-CD 4.29Å; L132-K178 VanDerWaalsContact CD2-CE 3.41Å; L132-K178 HydrophobicContact CD2-CG 4.07Å; L132-V183 HydrophobicContact CD1-CG1 4.15Å
133	T	98.6	Very high	98.3	Very high	77 Å²	77	33.4 Å²	33.4	47%	0.472	17%	0.173	S	C	.	.	H	α-helix	trans	-55.9	-44.9	177.1	-58.3	0	0	0	0	111.5	D129 R130 A131 L137	D129-T133 PolarHBondContact O-N 2.91Å; D129-T133 PolarHBondContact O-OG1 2.57Å; R130-T133 PolarHBondContact O-N 2.7Å; A131-T133 PolarHBondContact O-N 3.19Å; T133-L137 PolarHBondContact O-N 3.18Å
134	V	98.8	Very high	98.4	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-72.3	-37.7	178.9	173.3	0	0	0	0	111.7	D81 M84 A85 F121 M123 R130 A131 L132 L137 V138	D81-V134 HydrophobicContact CB-CG2 4.11Å; D81-V134 WeakPolarHBondContact O-CG2 3.34Å; M84-V134 HydrophobicContact CB-CB 4.39Å; M84-V134 HydrophobicContact CB-CG1 3.6Å; M84-V134 HydrophobicContact CB-CG2 3.81Å; M84-V134 HydrophobicContact CG-CG1 4.3Å; A85-V134 HydrophobicContact CB-CG2 3.97Å; F121-V134 HydrophobicContact CE1-CG1 3.82Å; F121-V134 HydrophobicContact CZ-CG1 4.26Å; M123-V134 HydrophobicContact CE-CB 4.09Å; M123-V134 HydrophobicContact CE-CG1 3.85Å; R130-V134 WeakPolarHBondContact O-CG2 3.4Å; R130-V134 PolarHBondContact O-N 3.34Å; R130-V134 VanDerWaalsContact O-N 3.08Å; A131-V134 PolarHBondContact O-N 2.93Å; L132-V134 VanDerWaalsContact C-N 3.29Å; L132-V134 PolarHBondContact O-N 2.89Å; V134-L137 WeakPolarHBondContact O-CB 3.43Å; V134-L137 PolarHBondContact O-N 3.3Å; V134-V138 PolarHBondContact O-N 3.24Å
135	A	98.8	Very high	98.4	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-62.8	-46	178.4	0	0	0	0	0	111.2	M123 A131 L132 L137 V138 E139 I145 L179 V183	M123-A135 HydrophobicContact CE-CB 3.96Å; A131-A135 WeakPolarHBondContact O-CB 3.37Å; A131-A135 PolarHBondContact O-N 3.03Å; L132-A135 PolarHBondContact O-N 2.84Å; A135-L137 VanDerWaalsContact C-N 3.28Å; A135-L137 PolarHBondContact O-N 3.46Å; A135-V138 PolarHBondContact O-N 2.82Å; A135-E139 WeakPolarHBondContact O-CB 3.26Å; A135-E139 PolarHBondContact O-N 3.04Å; A135-I145 HydrophobicContact CB-CD1 4.23Å; A135-I145 HydrophobicContact CB-CG1 4.11Å; A135-I145 HydrophobicContact CB-CG2 4.22Å; A135-L179 HydrophobicContact CB-CD2 3.54Å; A135-V183 HydrophobicContact CB-CG1 3.57Å
136	Q	98.6	Very high	98.4	Very high	94 Å²	94	33.4 Å²	33.4	44%	0.439	17%	0.173	S	C	.	.	H	α-helix	trans	-65.7	-29.3	176.1	-70.7	178.1	-27.7	0	0	113.1	L132 V138 G182 V183	L132-Q136 HydrophobicContact CD1-CG 3.94Å; L132-Q136 HydrophobicContact CG-CG 4.37Å; L132-Q136 WeakPolarHBondContact O-CG 3.3Å; L132-Q136 PolarHBondContact O-N 2.8Å; Q136-V138 VanDerWaalsContact C-N 3.29Å; Q136-V138 PolarHBondContact O-N 3.12Å; Q136-G182 PolarHBondContact NE2-O 3.37Å; Q136-G182 VanDerWaalsContact NE2-O 3.14Å; Q136-V183 HydrophobicContact CG-CG1 4.11Å
137	L	98.4	Very high	98.5	Very high	45 Å²	45	32.7 Å²	32.7	24%	0.236	17%	0.167	C	C	.	.	H	α-helix	trans	-62	-37.9	174.4	174.2	63.9	0	0	0	111.6	M84 C87 R89 F100 T133 V134 A135	M84-L137 WeakPolarHBondContact O-CD2 3.35Å; C87-L137 HydrophobicContact CB-CD2 4.3Å; R89-L137 HydrophobicContact CB-CD1 4.29Å; F100-L137 HydrophobicContact CD1-CD1 4.2Å; F100-L137 HydrophobicContact CD1-CD2 4.09Å; F100-L137 HydrophobicContact CD1-CG 3.85Å; F100-L137 HydrophobicContact CE1-CD1 4.14Å; F100-L137 HydrophobicContact CE1-CG 3.84Å; F100-L137 WeakPolarHBondContact CE1-O 3.36Å; T133-L137 PolarHBondContact O-N 3.18Å; V134-L137 WeakPolarHBondContact O-CB 3.43Å; V134-L137 PolarHBondContact O-N 3.3Å; A135-L137 VanDerWaalsContact C-N 3.28Å; A135-L137 PolarHBondContact O-N 3.46Å
138	V	98.6	Very high	98.6	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-107.9	-14.2	-170.4	-53.8	0	0	0	0	114.7	M84 F100 F121 V134 A135 Q136 Q140 D141 V142 I145	M84-V138 HydrophobicContact CE-CG1 4.21Å; F100-V138 HydrophobicContact CD1-CG1 4.02Å; F100-V138 HydrophobicContact CE1-CB 4.27Å; F100-V138 HydrophobicContact CE1-CG1 3.67Å; F100-V138 HydrophobicContact CE2-CG1 4.34Å; F100-V138 HydrophobicContact CZ-CB 4.06Å; F100-V138 HydrophobicContact CZ-CG1 3.82Å; F121-V138 HydrophobicContact CB-CG2 4.14Å; F121-V138 HydrophobicContact CD1-CG2 3.95Å; F121-V138 HydrophobicContact CD2-CB 4.44Å; F121-V138 HydrophobicContact CD2-CG1 4.23Å; F121-V138 HydrophobicContact CD2-CG2 4.21Å; F121-V138 HydrophobicContact CE1-CG2 4.43Å; F121-V138 HydrophobicContact CE2-CG1 4.03Å; F121-V138 HydrophobicContact CG-CG2 3.83Å; F121-V138 HydrophobicContact CZ-CG1 4.25Å; V134-V138 PolarHBondContact O-N 3.24Å; A135-V138 PolarHBondContact O-N 2.82Å; Q136-V138 VanDerWaalsContact C-N 3.29Å; Q136-V138 PolarHBondContact O-N 3.12Å; V138-Q140 PolarHBondContact O-N 3.28Å; V138-D141 PolarHBondContact O-N 3.32Å; V138-V142 HydrophobicContact CG2-CG2 4.16Å; V138-V142 WeakPolarHBondContact O-CG2 3.47Å; V138-I145 HydrophobicContact CG2-CD1 3.54Å
139	E	98.2	Very high	98.5	Very high	33 Å²	33	29.1 Å²	29.1	15%	0.154	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-22.7	-167.9	68.6	176.7	134.2	0	0	115	A135 D141 S184 V185	A135-E139 WeakPolarHBondContact O-CB 3.26Å; A135-E139 PolarHBondContact O-N 3.04Å; E139-D141 VanDerWaalsContact C-N 3.32Å; E139-S184 PolarHBondContact OE2-N 2.82Å; E139-S184 PolarHBondContact OE2-OG 2.76Å; E139-V185 HydrophobicContact CB-CG2 4.07Å
140	Q	97.3	Very high	98.1	Very high	143 Å²	143	25.1 Å²	25.1	67%	0.668	13%	0.127	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-12.8	179.2	-61.9	-174.3	-2.7	0	0	113.7	K116 V138	K116-Q140 WeakPolarHBondContact CE-O 3.29Å; V138-Q140 PolarHBondContact O-N 3.28Å
141	D	98.6	Very high	97.7	Very high	10 Å²	10	22.6 Å²	22.6	5%	0.053	12%	0.119	C	C	.	.	S	Bend	trans	-119.5	4.7	-171.9	-53.3	-71	0	0	0	113.1	R89 F100 T111 V138 E139	R89-D141 WeakPolarHBondContact CD-OD2 3.34Å; R89-D141 IonicContact CZ-OD1 2.91Å; R89-D141 IonicContact CZ-OD2 3.71Å; R89-D141 IonicContact NE-OD1 3.54Å; R89-D141 PolarHBondContact NE-OD1 2.9Å; R89-D141 IonicContact NE-OD2 2.72Å; R89-D141 PolarHBondContact NE-OD2 2.82Å; R89-D141 IonicContact NH2-OD1 2.95Å; R89-D141 PolarHBondContact NH2-OD1 2.95Å; R89-D141 IonicContact NH2-OD2 2.79Å; F100-D141 HydrophobicContact CE2-CB 4.48Å; F100-D141 HydrophobicContact CZ-CB 4.32Å; F100-D141 WeakPolarHBondContact CZ-OD2 3.05Å; T111-D141 HydrophobicContact CG2-CB 3.82Å; V138-D141 PolarHBondContact O-N 3.32Å; E139-D141 VanDerWaalsContact C-N 3.32Å
142	V	98.7	Very high	97.2	Very high	6 Å²	6	25 Å²	25	4%	0.036	14%	0.135	C	C	.	.			trans	-139.3	155.2	-176.6	-52.7	0	0	0	0	111.1	F109 K116 V119 F121 V138 I145	F109-V142 HydrophobicContact CE1-CG1 3.71Å; F109-V142 HydrophobicContact CZ-CG1 3.98Å; K116-V142 CarbonylContact O-C 3.29Å; V119-V142 HydrophobicContact CG1-CB 4.01Å; V119-V142 HydrophobicContact CG1-CG1 3.99Å; F121-V142 HydrophobicContact CB-CB 4.38Å; F121-V142 HydrophobicContact CB-CG1 4.13Å; F121-V142 HydrophobicContact CB-CG2 4.12Å; V138-V142 HydrophobicContact CG2-CG2 4.16Å; V138-V142 WeakPolarHBondContact O-CG2 3.47Å; V142-I145 HydrophobicContact CG2-CD1 3.95Å
143	A	98.5	Very high	96.7	Very high	12 Å²	12	29.8 Å²	29.8	10%	0.099	16%	0.155	C	C	.	.	S	Bend	trans	-82.6	-24.4	-176.6	0	0	0	0	0	113.4	L43 K116 D117 V119 P186	L43-A143 HydrophobicContact CB-CB 4.25Å; L43-A143 HydrophobicContact CD2-CB 3.87Å; K116-A143 WeakPolarHBondContact O-CB 3.4Å; K116-A143 PolarHBondContact O-N 2.81Å; D117-A143 VanDerWaalsContact C-CB 3.4Å; D117-A143 WeakPolarHBondContact O-CB 3.48Å; V119-A143 WeakPolarHBondContact O-CB 3.49Å; V119-A143 PolarHBondContact O-N 3.43Å; A143-P186 WeakPolarHBondContact O-CD 3.45Å
144	A	98.8	Very high	96	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.8	163.8	-180	0	0	0	0	0	111.8	F45 V120 F121 P186	F45-A144 HydrophobicContact CE2-CB 4.35Å; F45-A144 HydrophobicContact CZ-CB 3.76Å; V120-A144 HydrophobicContact CG1-CB 4.04Å; V120-A144 HydrophobicContact CG2-CB 4.12Å; F121-A144 PolarHBondContact N-O 3.29Å; A144-P186 VanDerWaalsContact CA-O 3.31Å; A144-P186 WeakPolarHBondContact CA-O 3.43Å; A144-P186 HydrophobicContact CB-CB 4.21Å; A144-P186 VanDerWaalsContact CB-O 3.29Å; A144-P186 WeakPolarHBondContact CB-O 3.23Å
145	I	98.9	Very high	95.3	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	136.4	173.9	-57.4	-61.1	0	0	0	109.4	F121 M123 A135 V138 V142 V183 V185 P186 V187 T188	F121-I145 HydrophobicContact CB-CD1 4.18Å; M123-I145 HydrophobicContact CE-CG2 3.73Å; A135-I145 HydrophobicContact CB-CD1 4.23Å; A135-I145 HydrophobicContact CB-CG1 4.11Å; A135-I145 HydrophobicContact CB-CG2 4.22Å; V138-I145 HydrophobicContact CG2-CD1 3.54Å; V142-I145 HydrophobicContact CG2-CD1 3.95Å; I145-V183 HydrophobicContact CG1-CG2 4.45Å; I145-V185 HydrophobicContact CD1-CG2 4.47Å; I145-V185 HydrophobicContact CG1-CG2 3.79Å; I145-P186 PolarHBondContact N-O 3.1Å; I145-V187 CarbonylContact O-C 3.58Å; I145-V187 WeakPolarHBondContact O-CA 3.31Å; I145-T188 PolarHBondContact O-N 3Å
146	D	98.9	Very high	94.7	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	140.2	175.5	-173.3	79.4	0	0	0	112.2	Y75 V120 F121 Q122 M123 T188 C189	Y75-D146 HydrophobicContact CD1-CB 4.15Å; Y75-D146 HydrophobicContact CE1-CB 3.7Å; V120-D146 HydrophobicContact CG1-CB 3.68Å; F121-D146 PolarHBondContact O-N 3.14Å; Q122-D146 CarbonylContact C-O 3.58Å; Q122-D146 WeakPolarHBondContact CA-O 3.28Å; Q122-D146 HydrophobicContact CB-CB 4.21Å; Q122-D146 HydrophobicContact CG-CB 4.37Å; Q122-D146 WeakPolarHBondContact CG-OD2 3.49Å; Q122-D146 PolarHBondContact NE2-OD2 2.86Å; M123-D146 PolarHBondContact N-O 3.08Å; D146-T188 WeakPolarHBondContact CA-O 3.44Å; D146-T188 WeakPolarHBondContact CB-OG1 3.24Å; D146-T188 WeakPolarHBondContact OD1-CB 3.43Å; D146-T188 PolarHBondContact OD1-OG1 2.81Å; D146-C189 VanDerWaalsContact OD1-C 3.28Å; D146-C189 WeakPolarHBondContact OD1-CA 3.29Å; D146-C189 PolarHBondContact OD1-N 2.95Å; D146-C189 VanDerWaalsContact OD1-N 3.17Å
147	V	98.8	Very high	94.2	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	123.8	173.4	179.9	0	0	0	0	110.7	M123 T125 M149 L165 I175 L176 L179 T188 C189 K190	M123-V147 HydrophobicContact CG-CG2 4.48Å; T125-V147 HydrophobicContact CG2-CG1 3.97Å; T125-V147 HydrophobicContact CG2-CG2 4.5Å; V147-M149 HydrophobicContact CB-CE 3.98Å; V147-M149 HydrophobicContact CG1-CE 3.67Å; V147-M149 HydrophobicContact CG1-CG 4.11Å; V147-M149 PolarHBondContact O-N 2.83Å; V147-L165 HydrophobicContact CG1-CD1 4.43Å; V147-I175 HydrophobicContact CG1-CG2 4.49Å; V147-I175 HydrophobicContact CG2-CG2 4.2Å; V147-L176 HydrophobicContact CB-CD2 4.38Å; V147-L176 HydrophobicContact CG2-CD2 4.15Å; V147-L179 HydrophobicContact CG2-CD1 3.41Å; V147-L179 VanDerWaalsContact CG2-CD1 3.41Å; V147-T188 PolarHBondContact N-O 2.79Å; V147-C189 HydrophobicContact CB-CB 4.38Å; V147-C189 WeakPolarHBondContact O-CA 3.3Å; V147-K190 PolarHBondContact O-N 3.39Å
148	N	98.5	Very high	93.6	Very high	12 Å²	12	40.1 Å²	40.1	6%	0.064	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	117.2	173.3	-171.1	-36.8	0	0	0	111	E78 Q122 M123 G150 C151 G162	E78-N148 HydrophobicContact CG-CB 4.22Å; E78-N148 PolarHBondContact OE2-ND2 2.9Å; Q122-N148 HydrophobicContact CG-CB 3.97Å; Q122-N148 PolarHBondContact OE1-ND2 3.49Å; M123-N148 PolarHBondContact O-N 3.48Å; N148-G150 PolarHBondContact OD1-N 2.79Å; N148-C151 WeakPolarHBondContact OD1-CB 3.47Å; N148-C151 PolarHBondContact OD1-N 2.69Å; N148-G162 WeakPolarHBondContact O-CA 3.49Å; N148-G162 PolarHBondContact O-N 3.1Å
149	M	97.1	Very high	92.9	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	14.3	173.6	-53.9	179	-173.8	0	0	111.5	V147 G162 A163 L165 L166 I172 L176 C189 K190 I191	V147-M149 HydrophobicContact CB-CE 3.98Å; V147-M149 HydrophobicContact CG1-CE 3.67Å; V147-M149 HydrophobicContact CG1-CG 4.11Å; V147-M149 PolarHBondContact O-N 2.83Å; M149-G162 CarbonylContact C-O 3.48Å; M149-G162 WeakPolarHBondContact CA-O 3.5Å; M149-G162 CarbonylContact O-C 3.54Å; M149-A163 WeakPolarHBondContact O-CA 3.4Å; M149-L165 HydrophobicContact CG-CB 4.45Å; M149-L165 HydrophobicContact CG-CD1 3.89Å; M149-L166 HydrophobicContact CB-CD2 4Å; M149-L166 WeakPolarHBondContact O-CD1 3.48Å; M149-L166 WeakPolarHBondContact O-CD2 3.49Å; M149-L166 VanDerWaalsContact O-CG 3.23Å; M149-L166 WeakPolarHBondContact O-CG 3.45Å; M149-I172 HydrophobicContact CE-CB 4.48Å; M149-I172 HydrophobicContact CE-CG1 4.29Å; M149-I172 HydrophobicContact CE-CG2 3.79Å; M149-I172 HydrophobicContact SD-CB 4.49Å; M149-I172 HydrophobicContact SD-CD1 3.89Å; M149-I172 HydrophobicContact SD-CG1 3.88Å; M149-I172 HydrophobicContact SD-CG2 3.87Å; M149-L176 HydrophobicContact CE-CD1 3.92Å; M149-L176 HydrophobicContact CE-CD2 3.77Å; M149-L176 HydrophobicContact CE-CG 3.86Å; M149-C189 HydrophobicContact CE-CB 3.75Å; M149-C189 HydrophobicContact SD-CB 4.14Å; M149-K190 CarbonylContact C-O 3.54Å; M149-K190 WeakPolarHBondContact CA-O 3.33Å; M149-K190 WeakPolarHBondContact CB-O 3.23Å; M149-K190 PolarHBondContact N-O 3.12Å; M149-I191 HydrophobicContact CB-CG2 4.08Å; M149-I191 HydrophobicContact SD-CG2 4.18Å
150	G	90.6	Very high	92.6	Very high	7 Å²	7	41.7 Å²	41.7	7%	0.072	22%	0.218	C	C	.	.			trans	-120.4	-12.6	-170.3	0	0	0	0	0	115.3	N148 P152 K190 R192	N148-G150 PolarHBondContact OD1-N 2.79Å; G150-P152 VanDerWaalsContact O-CD 3.26Å; G150-P152 WeakPolarHBondContact O-CD 3.39Å; G150-K190 PolarHBondContact N-O 3.37Å; G150-R192 WeakPolarHBondContact O-CD 3.12Å; G150-R192 PolarHBondContact O-NE 3.18Å
151	C	90.1	Very high	92.4	Very high	14 Å²	14	35.3 Å²	35.3	10%	0.095	19%	0.188	C	C	.	.			trans	-71.3	117.6	-176.6	-168.7	0	0	0	0	111.5	N148 A163	N148-C151 WeakPolarHBondContact OD1-CB 3.47Å; N148-C151 PolarHBondContact OD1-N 2.69Å; C151-A163 WeakPolarHBondContact O-CB 3.48Å; C151-A163 PolarHBondContact O-N 3.1Å
152	P	87.8	Confident	92.2	Very high	52 Å²	52	34.8 Å²	34.8	34%	0.338	19%	0.186	S	C	.	.			trans	-88.8	-2.6	179.9	36.1	-35.1	0	0	0	113.1	G150 K222	G150-P152 VanDerWaalsContact O-CD 3.26Å; G150-P152 WeakPolarHBondContact O-CD 3.39Å; P152-K222 HydrophobicContact CB-CG 4.11Å
153	K	87.6	Confident	91.9	Very high	120 Å²	120	34.8 Å²	34.8	52%	0.522	19%	0.186	S	C	.	.	S	Bend	trans	-69.7	145.3	-173.4	-66.9	-175	176.9	179.5	0	111.2	Y155 S156 T157	K153-Y155 VanDerWaalsContact C-N 3.3Å; K153-Y155 HydrophobicContact CB-CD1 3.82Å; K153-Y155 HydrophobicContact CB-CE1 3.57Å; K153-Y155 HydrophobicContact CD-CD1 4.33Å; K153-Y155 HydrophobicContact CD-CE1 3.46Å; K153-Y155 VanDerWaalsContact CD-CE1 3.46Å; K153-Y155 HydrophobicContact CG-CE1 4.16Å; K153-Y155 PolarHBondContact O-N 3.49Å; K153-S156 WeakPolarHBondContact O-CB 3.47Å; K153-S156 PolarHBondContact O-N 3.17Å; K153-T157 PolarHBondContact O-N 2.92Å; K153-T157 VanDerWaalsContact O-N 3.07Å; K153-T157 PolarHBondContact O-OG1 2.58Å
154	E	85.5	Confident	91.7	Very high	126 Å²	126	35.4 Å²	35.4	59%	0.589	19%	0.191	S	C	*	.	H	α-helix	trans	-55.7	-38.6	-174.7	-71.8	-168.3	-169.7	0	0	114.6	S156 T157 K158	E154-S156 PolarHBondContact O-N 3.2Å; E154-T157 WeakPolarHBondContact CA-OG1 3.48Å; E154-T157 PolarHBondContact O-N 2.75Å; E154-T157 PolarHBondContact O-OG1 3.03Å; E154-K158 HydrophobicContact CB-CD 4.4Å; E154-K158 VanDerWaalsContact O-CB 3.25Å; E154-K158 WeakPolarHBondContact O-CB 3.46Å; E154-K158 WeakPolarHBondContact O-CG 3.15Å; E154-K158 PolarHBondContact O-N 3.39Å; E154-K158 IonicContact OE2-NZ 3.64Å; E154-K158 PolarHBondContact OE2-NZ 2.96Å
155	Y	83.1	Confident	91.5	Very high	105 Å²	105	35.5 Å²	35.5	41%	0.412	19%	0.192	S	C	.	.	H	α-helix	trans	-62.2	-27.3	179.6	72.2	-102.4	0	0	0	112.2	I80 K153	I80-Y155 HydrophobicContact CD1-CE2 4.36Å; K153-Y155 VanDerWaalsContact C-N 3.3Å; K153-Y155 HydrophobicContact CB-CD1 3.82Å; K153-Y155 HydrophobicContact CB-CE1 3.57Å; K153-Y155 HydrophobicContact CD-CD1 4.33Å; K153-Y155 HydrophobicContact CD-CE1 3.46Å; K153-Y155 VanDerWaalsContact CD-CE1 3.46Å; K153-Y155 HydrophobicContact CG-CE1 4.16Å; K153-Y155 PolarHBondContact O-N 3.49Å
156	S	85.5	Confident	91.3	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-83.5	-52	176.4	-178.6	0	0	0	0	110.2	K153 E154 K158 G159 G160 M161 G162	K153-S156 WeakPolarHBondContact O-CB 3.47Å; K153-S156 PolarHBondContact O-N 3.17Å; E154-S156 PolarHBondContact O-N 3.2Å; S156-K158 PolarHBondContact O-N 3.27Å; S156-G159 PolarHBondContact O-N 2.52Å; S156-G159 VanDerWaalsContact O-N 3.14Å; S156-G160 PolarHBondContact O-N 3.1Å; S156-M161 CarbonylContact C-O 3.55Å; S156-M161 PolarHBondContact O-N 3.01Å; S156-M161 PolarHBondContact OG-O 3.06Å; S156-G162 VanDerWaalsContact OG-CA 3.32Å; S156-G162 WeakPolarHBondContact OG-CA 3.25Å; S156-G162 PolarHBondContact OG-N 3.38Å
157	T	87.7	Confident	91	Very high	39 Å²	39	41.3 Å²	41.3	24%	0.239	23%	0.231	C	C	.	.	H	α-helix	trans	-68.5	-35.9	-172.8	56	0	0	0	0	113.1	K153 E154 G159 G160 A164	K153-T157 PolarHBondContact O-N 2.92Å; K153-T157 VanDerWaalsContact O-N 3.07Å; K153-T157 PolarHBondContact O-OG1 2.58Å; E154-T157 WeakPolarHBondContact CA-OG1 3.48Å; E154-T157 PolarHBondContact O-N 2.75Å; E154-T157 PolarHBondContact O-OG1 3.03Å; T157-G159 PolarHBondContact O-N 3.23Å; T157-G160 PolarHBondContact O-N 2.75Å; T157-A164 HydrophobicContact CG2-CB 4.37Å
158	K	87.3	Confident	90.8	Very high	164 Å²	164	44.4 Å²	44.4	71%	0.713	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64	-29.3	173.8	-74.5	174.2	170.7	162.4	0	112.8	E154 S156 G160	E154-K158 HydrophobicContact CB-CD 4.4Å; E154-K158 VanDerWaalsContact O-CB 3.25Å; E154-K158 WeakPolarHBondContact O-CB 3.46Å; E154-K158 WeakPolarHBondContact O-CG 3.15Å; E154-K158 PolarHBondContact O-N 3.39Å; E154-K158 IonicContact OE2-NZ 3.64Å; E154-K158 PolarHBondContact OE2-NZ 2.96Å; S156-K158 PolarHBondContact O-N 3.27Å; K158-G160 VanDerWaalsContact C-N 3.26Å; K158-G160 PolarHBondContact O-N 3.29Å
159	G	84.4	Confident	90.7	Very high	43 Å²	43	45.6 Å²	45.6	44%	0.443	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	2.4	173.9	0	0	0	0	0	114.1	A126 S156 T157 M161	A126-G159 WeakPolarHBondContact CB-O 3.23Å; S156-G159 PolarHBondContact O-N 2.52Å; S156-G159 VanDerWaalsContact O-N 3.14Å; T157-G159 PolarHBondContact O-N 3.23Å; G159-M161 VanDerWaalsContact C-N 3.25Å; G159-M161 PolarHBondContact O-N 3.4Å
160	G	90.8	Very high	90.8	Very high	23 Å²	23	50.6 Å²	50.6	24%	0.237	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	72.7	14.6	-174.7	0	0	0	0	0	114.4	A126 S156 T157 K158 L165	A126-G160 WeakPolarHBondContact CB-O 3.42Å; S156-G160 PolarHBondContact O-N 3.1Å; T157-G160 PolarHBondContact O-N 2.75Å; K158-G160 VanDerWaalsContact C-N 3.26Å; K158-G160 PolarHBondContact O-N 3.29Å; G160-L165 WeakPolarHBondContact O-CD2 3.28Å
161	M	93.6	Very high	91.1	Very high	8 Å²	8	54 Å²	54	4%	0.039	30%	0.296	C	S	.	.			trans	-103.3	172.3	-176.4	-50.2	179.3	-71.7	0	0	111.2	I80 G124 T125 A126 S156 G159 A163 A164	I80-M161 HydrophobicContact CD1-CE 3.83Å; I80-M161 HydrophobicContact CD1-SD 4.31Å; I80-M161 HydrophobicContact CG2-CE 3.91Å; I80-M161 HydrophobicContact CG2-SD 4.02Å; G124-M161 VanDerWaalsContact O-SD 3.39Å; T125-M161 VanDerWaalsContact C-CG 3.48Å; A126-M161 HydrophobicContact CB-CG 3.88Å; S156-M161 CarbonylContact C-O 3.55Å; S156-M161 PolarHBondContact O-N 3.01Å; S156-M161 PolarHBondContact OG-O 3.06Å; G159-M161 VanDerWaalsContact C-N 3.25Å; G159-M161 PolarHBondContact O-N 3.4Å; M161-A163 PolarHBondContact O-N 3.42Å; M161-A164 PolarHBondContact O-N 3.49Å
162	G	93.9	Very high	91.5	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	62.8	-134.6	175.8	0	0	0	0	0	111.3	N148 M149 S156 A164 L165	N148-G162 WeakPolarHBondContact O-CA 3.49Å; N148-G162 PolarHBondContact O-N 3.1Å; M149-G162 CarbonylContact C-O 3.48Å; M149-G162 WeakPolarHBondContact CA-O 3.5Å; M149-G162 CarbonylContact O-C 3.54Å; S156-G162 VanDerWaalsContact OG-CA 3.32Å; S156-G162 WeakPolarHBondContact OG-CA 3.25Å; S156-G162 PolarHBondContact OG-N 3.38Å; G162-A164 PolarHBondContact O-N 3.04Å; G162-L165 WeakPolarHBondContact O-CB 3.31Å; G162-L165 PolarHBondContact O-N 3.34Å
163	A	93.2	Very high	92	Very high	5 Å²	5	52.6 Å²	52.6	4%	0.041	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-63.4	-14.1	-176.1	0	0	0	0	0	114.2	M149 C151 M161 L165 L166 K222	M149-A163 WeakPolarHBondContact O-CA 3.4Å; C151-A163 WeakPolarHBondContact O-CB 3.48Å; C151-A163 PolarHBondContact O-N 3.1Å; M161-A163 PolarHBondContact O-N 3.42Å; A163-L165 VanDerWaalsContact C-N 3.29Å; A163-L166 HydrophobicContact CB-CD1 4.41Å; A163-L166 PolarHBondContact O-N 2.96Å; A163-K222 HydrophobicContact CB-CD 4.17Å; A163-K222 HydrophobicContact CB-CG 4.11Å
164	A	93.3	Very high	92.5	Very high	26 Å²	26	49 Å²	49	22%	0.215	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-72.1	-22.5	172.8	0	0	0	0	0	113	T157 M161 G162 L166 S167	T157-A164 HydrophobicContact CG2-CB 4.37Å; M161-A164 PolarHBondContact O-N 3.49Å; G162-A164 PolarHBondContact O-N 3.04Å; A164-L166 VanDerWaalsContact C-N 3.28Å; A164-L166 PolarHBondContact O-N 2.76Å; A164-S167 PolarHBondContact O-OG 2.71Å
165	L	94.9	Very high	93.2	Very high	1 Å²	1	43 Å²	43	1%	0.005	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-68.1	-30.1	174.3	-72.3	174.2	0	0	0	112.1	T125 V147 M149 G160 G162 A163 S167 N168 K171 I172 I175	T125-L165 WeakPolarHBondContact O-CD1 3.41Å; V147-L165 HydrophobicContact CG1-CD1 4.43Å; M149-L165 HydrophobicContact CG-CB 4.45Å; M149-L165 HydrophobicContact CG-CD1 3.89Å; G160-L165 WeakPolarHBondContact O-CD2 3.28Å; G162-L165 WeakPolarHBondContact O-CB 3.31Å; G162-L165 PolarHBondContact O-N 3.34Å; A163-L165 VanDerWaalsContact C-N 3.29Å; L165-S167 PolarHBondContact O-N 3.11Å; L165-S167 VanDerWaalsContact O-N 3.14Å; L165-N168 CarbonylContact O-C 3.56Å; L165-N168 WeakPolarHBondContact O-CA 3.49Å; L165-N168 PolarHBondContact O-N 3.02Å; L165-K171 HydrophobicContact CD2-CD 3.69Å; L165-K171 HydrophobicContact CD2-CG 4.06Å; L165-I172 HydrophobicContact CB-CD1 4.22Å; L165-I172 HydrophobicContact CB-CG1 3.97Å; L165-I172 VanDerWaalsContact O-CD1 3.25Å; L165-I172 WeakPolarHBondContact O-CD1 3.44Å; L165-I175 HydrophobicContact CD2-CD1 4.04Å
166	L	93.6	Very high	93.9	Very high	15 Å²	15	38 Å²	38	8%	0.079	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-62.3	-24.5	-175	-60.6	177.9	0	0	0	113.3	M149 A163 A164 N168 I172 I191 R192 L194 L203	M149-L166 HydrophobicContact CB-CD2 4Å; M149-L166 WeakPolarHBondContact O-CD1 3.48Å; M149-L166 WeakPolarHBondContact O-CD2 3.49Å; M149-L166 VanDerWaalsContact O-CG 3.23Å; M149-L166 WeakPolarHBondContact O-CG 3.45Å; A163-L166 HydrophobicContact CB-CD1 4.41Å; A163-L166 PolarHBondContact O-N 2.96Å; A164-L166 VanDerWaalsContact C-N 3.28Å; A164-L166 PolarHBondContact O-N 2.76Å; L166-N168 VanDerWaalsContact C-N 3.3Å; L166-I172 HydrophobicContact CD2-CD1 4.49Å; L166-I191 HydrophobicContact CD2-CB 4.2Å; L166-I191 HydrophobicContact CD2-CG2 4.24Å; L166-R192 HydrophobicContact CD1-CB 4.33Å; L166-L194 HydrophobicContact CB-CD2 4.03Å; L166-L194 HydrophobicContact CD1-CD2 4.35Å; L166-L203 HydrophobicContact CD2-CD2 3.83Å
167	S	92.6	Very high	94.6	Very high	108 Å²	108	42.1 Å²	42.1	76%	0.755	25%	0.246	S	C	*	.	G	3₁₀ helix	trans	-84.3	-0.5	173.4	53.3	0	0	0	0	113.9	A164 L165	A164-S167 PolarHBondContact O-OG 2.71Å; L165-S167 PolarHBondContact O-N 3.11Å; L165-S167 VanDerWaalsContact O-N 3.14Å
168	N	96	Very high	95.1	Very high	64 Å²	64	44.2 Å²	44.2	34%	0.342	25%	0.252	S	S	.	.			trans	-134.9	77.6	178.4	-168.4	-26.2	0	0	0	111.3	L165 L166 D170 K171 I172	L165-N168 CarbonylContact O-C 3.56Å; L165-N168 WeakPolarHBondContact O-CA 3.49Å; L165-N168 PolarHBondContact O-N 3.02Å; L166-N168 VanDerWaalsContact C-N 3.3Å; N168-D170 VanDerWaalsContact C-N 3.26Å; N168-D170 PolarHBondContact O-N 3.27Å; N168-K171 HydrophobicContact CB-CB 4.13Å; N168-K171 PolarHBondContact O-N 3.4Å; N168-K171 WeakPolarHBondContact OD1-CB 3.31Å; N168-K171 PolarHBondContact OD1-N 2.85Å; N168-I172 PolarHBondContact O-N 2.81Å; N168-I172 VanDerWaalsContact O-N 3.16Å
169	P	96.8	Very high	95.6	Very high	37 Å²	37	36.4 Å²	36.4	24%	0.24	22%	0.218	C	C	.	.	H	α-helix	trans	-59.6	-31.3	179.5	-26.5	36.6	0	0	0	114.4	K171 I172 E173 L203	P169-K171 VanDerWaalsContact C-N 3.34Å; P169-K171 PolarHBondContact O-N 3.45Å; P169-I172 WeakPolarHBondContact O-CB 3.25Å; P169-I172 PolarHBondContact O-N 3.33Å; P169-E173 PolarHBondContact O-N 3.15Å; P169-L203 HydrophobicContact CB-CD1 4.18Å; P169-L203 HydrophobicContact CG-CD1 4.22Å
170	D	97.7	Very high	96.3	Very high	106 Å²	106	36.5 Å²	36.5	57%	0.567	21%	0.21	S	C	*	.	H	α-helix	trans	-66.2	-39.5	178.8	-61.7	-20	0	0	0	111.2	N168 E173 A174 R206	N168-D170 VanDerWaalsContact C-N 3.26Å; N168-D170 PolarHBondContact O-N 3.27Å; D170-E173 PolarHBondContact O-N 2.96Å; D170-A174 WeakPolarHBondContact O-CB 3.37Å; D170-A174 PolarHBondContact O-N 3.09Å; D170-R206 IonicContact OD1-CZ 3.8Å; D170-R206 IonicContact OD1-NH1 2.72Å; D170-R206 IonicContact OD1-NH2 3.42Å; D170-R206 PolarHBondContact OD1-NH2 2.92Å
171	K	97.9	Very high	96.7	Very high	78 Å²	78	43.4 Å²	43.4	34%	0.339	24%	0.238	S	C	.	.	H	α-helix	trans	-66.2	-39.9	172.9	-177.3	177.3	-69.8	-165.5	0	111.8	L165 N168 P169 E173 A174 I175	L165-K171 HydrophobicContact CD2-CD 3.69Å; L165-K171 HydrophobicContact CD2-CG 4.06Å; N168-K171 HydrophobicContact CB-CB 4.13Å; N168-K171 PolarHBondContact O-N 3.4Å; N168-K171 WeakPolarHBondContact OD1-CB 3.31Å; N168-K171 PolarHBondContact OD1-N 2.85Å; P169-K171 VanDerWaalsContact C-N 3.34Å; P169-K171 PolarHBondContact O-N 3.45Å; K171-E173 VanDerWaalsContact C-N 3.35Å; K171-A174 PolarHBondContact O-N 3.33Å; K171-I175 HydrophobicContact CG-CD1 3.93Å; K171-I175 HydrophobicContact CG-CG1 4.49Å; K171-I175 WeakPolarHBondContact O-CG1 3.49Å; K171-I175 PolarHBondContact O-N 2.71Å
172	I	98.3	Very high	96.9	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-56.4	-51	173.5	-73.2	172.2	0	0	0	110	M149 L165 L166 N168 P169 A174 I175 L176 L203 I207	M149-I172 HydrophobicContact CE-CB 4.48Å; M149-I172 HydrophobicContact CE-CG1 4.29Å; M149-I172 HydrophobicContact CE-CG2 3.79Å; M149-I172 HydrophobicContact SD-CB 4.49Å; M149-I172 HydrophobicContact SD-CD1 3.89Å; M149-I172 HydrophobicContact SD-CG1 3.88Å; M149-I172 HydrophobicContact SD-CG2 3.87Å; L165-I172 HydrophobicContact CB-CD1 4.22Å; L165-I172 HydrophobicContact CB-CG1 3.97Å; L165-I172 VanDerWaalsContact O-CD1 3.25Å; L165-I172 WeakPolarHBondContact O-CD1 3.44Å; L166-I172 HydrophobicContact CD2-CD1 4.49Å; N168-I172 PolarHBondContact O-N 2.81Å; N168-I172 VanDerWaalsContact O-N 3.16Å; P169-I172 WeakPolarHBondContact O-CB 3.25Å; P169-I172 PolarHBondContact O-N 3.33Å; I172-A174 VanDerWaalsContact C-N 3.34Å; I172-A174 PolarHBondContact O-N 3.18Å; I172-I175 PolarHBondContact O-N 3.21Å; I172-L176 HydrophobicContact CG2-CD1 3.77Å; I172-L176 HydrophobicContact CG2-CG 4.33Å; I172-L176 WeakPolarHBondContact O-CB 3.43Å; I172-L176 WeakPolarHBondContact O-CG 3.33Å; I172-L176 PolarHBondContact O-N 2.76Å; I172-L203 HydrophobicContact CD1-CD1 4.07Å; I172-I207 HydrophobicContact CG2-CD1 4.33Å; I172-I207 HydrophobicContact CG2-CG1 3.81Å
173	E	98.6	Very high	97.1	Very high	36 Å²	36	45 Å²	45	17%	0.168	25%	0.253	C	S	.	.	H	α-helix	trans	-60.3	-43.2	178.7	-75.5	-171.2	-148	0	0	112.5	P169 D170 K171 I175 L176 K177 R206 T210	P169-E173 PolarHBondContact O-N 3.15Å; D170-E173 PolarHBondContact O-N 2.96Å; K171-E173 VanDerWaalsContact C-N 3.35Å; E173-I175 PolarHBondContact O-N 3.36Å; E173-L176 PolarHBondContact O-N 3.28Å; E173-K177 VanDerWaalsContact O-CB 3.23Å; E173-K177 WeakPolarHBondContact O-CB 3.44Å; E173-K177 VanDerWaalsContact O-CG 3.28Å; E173-K177 WeakPolarHBondContact O-CG 3.42Å; E173-K177 PolarHBondContact O-N 2.93Å; E173-K177 IonicContact OE2-NZ 3.19Å; E173-K177 PolarHBondContact OE2-NZ 3.46Å; E173-R206 IonicContact OE1-CZ 3.48Å; E173-R206 IonicContact OE1-NE 2.81Å; E173-R206 PolarHBondContact OE1-NE 3.21Å; E173-R206 IonicContact OE1-NH2 2.71Å; E173-R206 PolarHBondContact OE1-NH2 3.17Å; E173-T210 HydrophobicContact CB-CG2 4.22Å; E173-T210 HydrophobicContact CG-CG2 3.95Å
174	A	98.6	Very high	97.2	Very high	45 Å²	45	49 Å²	49	37%	0.372	28%	0.281	S	S	.	.	H	α-helix	trans	-60.6	-44.7	178.8	0	0	0	0	0	111.9	P128 D170 K171 I172 K178	P128-A174 HydrophobicContact CG-CB 3.92Å; D170-A174 WeakPolarHBondContact O-CB 3.37Å; D170-A174 PolarHBondContact O-N 3.09Å; K171-A174 PolarHBondContact O-N 3.33Å; I172-A174 VanDerWaalsContact C-N 3.34Å; I172-A174 PolarHBondContact O-N 3.18Å; A174-K178 VanDerWaalsContact O-CB 3.26Å; A174-K178 WeakPolarHBondContact O-CB 3.42Å; A174-K178 PolarHBondContact O-N 3.05Å
175	I	98.8	Very high	97.4	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-64.4	-52.4	177.7	-67	166.2	0	0	0	110.2	T125 P128 A131 V147 L165 K171 I172 E173 K178 L179	T125-I175 HydrophobicContact CG2-CD1 4.46Å; T125-I175 HydrophobicContact CG2-CG2 4.03Å; P128-I175 HydrophobicContact CB-CG1 4.39Å; P128-I175 HydrophobicContact CG-CG1 3.86Å; A131-I175 HydrophobicContact CB-CG2 4.19Å; V147-I175 HydrophobicContact CG1-CG2 4.49Å; V147-I175 HydrophobicContact CG2-CG2 4.2Å; L165-I175 HydrophobicContact CD2-CD1 4.04Å; K171-I175 HydrophobicContact CG-CD1 3.93Å; K171-I175 HydrophobicContact CG-CG1 4.49Å; K171-I175 WeakPolarHBondContact O-CG1 3.49Å; K171-I175 PolarHBondContact O-N 2.71Å; I172-I175 PolarHBondContact O-N 3.21Å; E173-I175 PolarHBondContact O-N 3.36Å; I175-K178 PolarHBondContact O-N 2.85Å; I175-L179 HydrophobicContact CG2-CD1 3.94Å; I175-L179 WeakPolarHBondContact O-CG 3.39Å; I175-L179 PolarHBondContact O-N 3.32Å
176	L	98.9	Very high	97.6	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-66.4	-44.8	-174.4	-67.3	180	0	0	0	112.5	V147 M149 I172 E173 K178 L179 V180 V187 C189 I207 T210 V212	V147-L176 HydrophobicContact CB-CD2 4.38Å; V147-L176 HydrophobicContact CG2-CD2 4.15Å; M149-L176 HydrophobicContact CE-CD1 3.92Å; M149-L176 HydrophobicContact CE-CD2 3.77Å; M149-L176 HydrophobicContact CE-CG 3.86Å; I172-L176 HydrophobicContact CG2-CD1 3.77Å; I172-L176 HydrophobicContact CG2-CG 4.33Å; I172-L176 WeakPolarHBondContact O-CB 3.43Å; I172-L176 WeakPolarHBondContact O-CG 3.33Å; I172-L176 PolarHBondContact O-N 2.76Å; E173-L176 PolarHBondContact O-N 3.28Å; L176-K178 VanDerWaalsContact C-N 3.31Å; L176-K178 PolarHBondContact O-N 3.16Å; L176-L179 PolarHBondContact O-N 2.99Å; L176-V180 WeakPolarHBondContact O-CB 3.37Å; L176-V180 VanDerWaalsContact O-CG2 3.28Å; L176-V180 WeakPolarHBondContact O-CG2 3.37Å; L176-V180 PolarHBondContact O-N 2.94Å; L176-V187 HydrophobicContact CD2-CG1 4.3Å; L176-C189 HydrophobicContact CD2-CB 4.21Å; L176-I207 HydrophobicContact CD1-CB 4.39Å; L176-I207 HydrophobicContact CD1-CG1 4.17Å; L176-I207 HydrophobicContact CD1-CG2 3.9Å; L176-T210 HydrophobicContact CB-CG2 3.96Å; L176-T210 WeakPolarHBondContact CB-OG1 3.39Å; L176-T210 HydrophobicContact CD1-CG2 4.25Å; L176-V212 HydrophobicContact CB-CG1 4.25Å; L176-V212 HydrophobicContact CD1-CG1 3.89Å; L176-V212 HydrophobicContact CD2-CG1 3.85Å; L176-V212 HydrophobicContact CG-CG1 4.21Å
177	K	98.8	Very high	97.8	Very high	85 Å²	85	50.1 Å²	50.1	37%	0.37	29%	0.286	S	S	.	.	H	α-helix	trans	-59.4	-42.9	176.5	-74.8	170.2	173	162	0	111.3	E173 L179 M181 T210	E173-K177 VanDerWaalsContact O-CB 3.23Å; E173-K177 WeakPolarHBondContact O-CB 3.44Å; E173-K177 VanDerWaalsContact O-CG 3.28Å; E173-K177 WeakPolarHBondContact O-CG 3.42Å; E173-K177 PolarHBondContact O-N 2.93Å; E173-K177 IonicContact OE2-NZ 3.19Å; E173-K177 PolarHBondContact OE2-NZ 3.46Å; K177-L179 PolarHBondContact O-N 2.86Å; K177-M181 WeakPolarHBondContact O-CB 3.48Å; K177-M181 VanDerWaalsContact O-CG 3.25Å; K177-M181 WeakPolarHBondContact O-CG 3.44Å; K177-M181 PolarHBondContact O-N 2.71Å; K177-T210 HydrophobicContact CG-CG2 4.1Å
178	K	98.8	Very high	98.1	Very high	83 Å²	83	45 Å²	45	36%	0.361	25%	0.251	S	S	.	.	H	α-helix	trans	-62.3	-42.9	178.5	-170.8	77.6	-174.6	-135.6	0	111.6	P128 D129 L132 A174 I175 L176 G182	P128-K178 HydrophobicContact CB-CB 4.03Å; P128-K178 HydrophobicContact CB-CG 4.17Å; D129-K178 WeakPolarHBondContact OD1-CE 3.35Å; D129-K178 IonicContact OD1-NZ 2.75Å; D129-K178 PolarHBondContact OD1-NZ 3.32Å; L132-K178 HydrophobicContact CB-CG 4.14Å; L132-K178 HydrophobicContact CD2-CD 4.29Å; L132-K178 VanDerWaalsContact CD2-CE 3.41Å; L132-K178 HydrophobicContact CD2-CG 4.07Å; A174-K178 VanDerWaalsContact O-CB 3.26Å; A174-K178 WeakPolarHBondContact O-CB 3.42Å; A174-K178 PolarHBondContact O-N 3.05Å; I175-K178 PolarHBondContact O-N 2.85Å; L176-K178 VanDerWaalsContact C-N 3.31Å; L176-K178 PolarHBondContact O-N 3.16Å; K178-G182 PolarHBondContact O-N 2.88Å; K178-G182 VanDerWaalsContact O-N 3.16Å
179	L	98.8	Very high	98.2	Very high	0 Å²	0	42 Å²	42	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-66.1	-53.2	176.9	-71.2	172.5	0	0	0	111.4	A131 A135 V147 I175 L176 K177 M181 G182 V183 V187	A131-L179 HydrophobicContact CB-CD1 4.36Å; A131-L179 HydrophobicContact CB-CD2 4.07Å; A131-L179 HydrophobicContact CB-CG 4.34Å; A135-L179 HydrophobicContact CB-CD2 3.54Å; V147-L179 HydrophobicContact CG2-CD1 3.41Å; V147-L179 VanDerWaalsContact CG2-CD1 3.41Å; I175-L179 HydrophobicContact CG2-CD1 3.94Å; I175-L179 WeakPolarHBondContact O-CG 3.39Å; I175-L179 PolarHBondContact O-N 3.32Å; L176-L179 PolarHBondContact O-N 2.99Å; K177-L179 PolarHBondContact O-N 2.86Å; L179-M181 PolarHBondContact O-N 2.78Å; L179-G182 PolarHBondContact O-N 2.82Å; L179-V183 WeakPolarHBondContact O-CG2 3.37Å; L179-V183 PolarHBondContact O-N 2.91Å; L179-V183 VanDerWaalsContact O-N 3.1Å; L179-V187 HydrophobicContact CB-CG1 3.97Å; L179-V187 HydrophobicContact CB-CG2 3.93Å; L179-V187 HydrophobicContact CD1-CG1 4.2Å
180	V	98.7	Very high	98.3	Very high	46 Å²	46	41.2 Å²	41.2	28%	0.279	23%	0.227	S	C	.	.	H	α-helix	trans	-56.6	-37.9	-178.2	169.7	0	0	0	0	111.9	L176 V187 V212	L176-V180 WeakPolarHBondContact O-CB 3.37Å; L176-V180 VanDerWaalsContact O-CG2 3.28Å; L176-V180 WeakPolarHBondContact O-CG2 3.37Å; L176-V180 PolarHBondContact O-N 2.94Å; V180-V187 HydrophobicContact CG2-CB 3.85Å; V180-V187 HydrophobicContact CG2-CG1 4.31Å; V180-V187 HydrophobicContact CG2-CG2 4.13Å; V180-V212 HydrophobicContact CG2-CG1 4.32Å
181	M	98.1	Very high	98.4	Very high	167 Å²	167	36.1 Å²	36.1	82%	0.823	20%	0.2	S	C	*	.	H	α-helix	trans	-79.9	-17.9	177.4	-67.4	174.9	62.9	0	0	114	K177 L179	K177-M181 WeakPolarHBondContact O-CB 3.48Å; K177-M181 VanDerWaalsContact O-CG 3.25Å; K177-M181 WeakPolarHBondContact O-CG 3.44Å; K177-M181 PolarHBondContact O-N 2.71Å; L179-M181 PolarHBondContact O-N 2.78Å
182	G	98.3	Very high	98.4	Very high	23 Å²	23	33.9 Å²	33.9	24%	0.237	19%	0.189	C	C	.	.	H	α-helix	trans	-111.1	-12.3	-164.1	0	0	0	0	0	116	Q136 K178 L179	Q136-G182 PolarHBondContact NE2-O 3.37Å; Q136-G182 VanDerWaalsContact NE2-O 3.14Å; K178-G182 PolarHBondContact O-N 2.88Å; K178-G182 VanDerWaalsContact O-N 3.16Å; L179-G182 PolarHBondContact O-N 2.82Å
183	V	97.8	Very high	98.4	Very high	18 Å²	18	34 Å²	34	11%	0.109	19%	0.19	C	C	.	.			trans	-122.1	159.1	174.4	-63.2	0	0	0	0	112.2	L132 A135 Q136 I145 L179 V185 V187	L132-V183 HydrophobicContact CD1-CG1 4.15Å; A135-V183 HydrophobicContact CB-CG1 3.57Å; Q136-V183 HydrophobicContact CG-CG1 4.11Å; I145-V183 HydrophobicContact CG1-CG2 4.45Å; L179-V183 WeakPolarHBondContact O-CG2 3.37Å; L179-V183 PolarHBondContact O-N 2.91Å; L179-V183 VanDerWaalsContact O-N 3.1Å; V183-V185 HydrophobicContact CB-CG2 4.49Å; V183-V185 HydrophobicContact CG2-CG2 4.23Å; V183-V187 HydrophobicContact CG2-CG2 3.75Å
184	S	96.1	Very high	98.4	Very high	90 Å²	90	33.7 Å²	33.7	63%	0.629	19%	0.189	S	C	*	.	S	Bend	trans	-88.3	-15.6	-178.7	58.6	0	0	0	0	114.4	E139	E139-S184 PolarHBondContact OE2-N 2.82Å; E139-S184 PolarHBondContact OE2-OG 2.76Å
185	V	97.5	Very high	98.3	Very high	28 Å²	28	36.6 Å²	36.6	17%	0.17	20%	0.204	C	C	.	.	S	Bend	trans	-97.8	156.1	179.8	-62.8	0	0	0	0	111.8	E139 I145 V183	E139-V185 HydrophobicContact CB-CG2 4.07Å; I145-V185 HydrophobicContact CD1-CG2 4.47Å; I145-V185 HydrophobicContact CG1-CG2 3.79Å; V183-V185 HydrophobicContact CB-CG2 4.49Å; V183-V185 HydrophobicContact CG2-CG2 4.23Å
186	P	98.4	Very high	98.2	Very high	34 Å²	34	38 Å²	38	22%	0.221	22%	0.215	C	C	.	.			trans	-53.6	142.4	175.3	-27.1	34.9	0	0	0	113.5	F45 A143 A144 I145 A213	F45-P186 HydrophobicContact CE2-CB 4Å; A143-P186 WeakPolarHBondContact O-CD 3.45Å; A144-P186 VanDerWaalsContact CA-O 3.31Å; A144-P186 WeakPolarHBondContact CA-O 3.43Å; A144-P186 HydrophobicContact CB-CB 4.21Å; A144-P186 VanDerWaalsContact CB-O 3.29Å; A144-P186 WeakPolarHBondContact CB-O 3.23Å; I145-P186 PolarHBondContact N-O 3.1Å; P186-A213 HydrophobicContact CB-CB 3.71Å
187	V	98.8	Very high	98.1	Very high	4 Å²	4	40.7 Å²	40.7	2%	0.024	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	129.9	173.4	-178.4	0	0	0	0	109.5	I145 L176 L179 V180 V183 V212 A213	I145-V187 CarbonylContact O-C 3.58Å; I145-V187 WeakPolarHBondContact O-CA 3.31Å; L176-V187 HydrophobicContact CD2-CG1 4.3Å; L179-V187 HydrophobicContact CB-CG1 3.97Å; L179-V187 HydrophobicContact CB-CG2 3.93Å; L179-V187 HydrophobicContact CD1-CG1 4.2Å; V180-V187 HydrophobicContact CG2-CB 3.85Å; V180-V187 HydrophobicContact CG2-CG1 4.31Å; V180-V187 HydrophobicContact CG2-CG2 4.13Å; V183-V187 HydrophobicContact CG2-CG2 3.75Å; V187-V212 HydrophobicContact CG1-CG1 4.27Å; V187-V212 CarbonylContact O-C 3.59Å; V187-V212 VanDerWaalsContact O-CA 3.28Å; V187-V212 WeakPolarHBondContact O-CA 3.41Å; V187-V212 WeakPolarHBondContact O-CB 3.29Å; V187-A213 PolarHBondContact O-N 3.31Å
188	T	98.8	Very high	98.1	Very high	1 Å²	1	43.2 Å²	43.2	1%	0.006	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	171.8	174	67.1	0	0	0	0	110.9	F45 I145 D146 V147 A213 A214	F45-T188 HydrophobicContact CD1-CG2 4.41Å; F45-T188 HydrophobicContact CD2-CG2 4.08Å; F45-T188 HydrophobicContact CE1-CG2 3.94Å; F45-T188 HydrophobicContact CE2-CG2 3.57Å; F45-T188 HydrophobicContact CG-CG2 4.47Å; F45-T188 HydrophobicContact CZ-CG2 3.49Å; F45-T188 VanDerWaalsContact CZ-CG2 3.49Å; I145-T188 PolarHBondContact O-N 3Å; D146-T188 WeakPolarHBondContact CA-O 3.44Å; D146-T188 WeakPolarHBondContact CB-OG1 3.24Å; D146-T188 WeakPolarHBondContact OD1-CB 3.43Å; D146-T188 PolarHBondContact OD1-OG1 2.81Å; V147-T188 PolarHBondContact N-O 2.79Å; T188-A213 HydrophobicContact CG2-CB 4.49Å; T188-A214 WeakPolarHBondContact CA-O 3.34Å; T188-A214 WeakPolarHBondContact CB-O 3.35Å; T188-A214 HydrophobicContact CG2-CB 3.87Å
189	C	98.8	Very high	98.1	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	155.3	167.4	63.9	0	0	0	0	111.8	D146 V147 M149 L176 A214 V215 A216	D146-C189 VanDerWaalsContact OD1-C 3.28Å; D146-C189 WeakPolarHBondContact OD1-CA 3.29Å; D146-C189 PolarHBondContact OD1-N 2.95Å; D146-C189 VanDerWaalsContact OD1-N 3.17Å; V147-C189 HydrophobicContact CB-CB 4.38Å; V147-C189 WeakPolarHBondContact O-CA 3.3Å; M149-C189 HydrophobicContact CE-CB 3.75Å; M149-C189 HydrophobicContact SD-CB 4.14Å; L176-C189 HydrophobicContact CD2-CB 4.21Å; C189-A214 PolarHBondContact N-O 3.48Å; C189-V215 WeakPolarHBondContact O-CA 3.5Å; C189-A216 PolarHBondContact O-N 3.07Å
190	K	98.8	Very high	98.1	Very high	20 Å²	20	44.1 Å²	44.1	9%	0.087	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	121.8	176.2	-173.4	177.5	-169.1	-59.2	0	111.8	P53 V147 M149 G150 A216 N249 M275	P53-K190 HydrophobicContact CG-CD 3.82Å; V147-K190 PolarHBondContact O-N 3.39Å; M149-K190 CarbonylContact C-O 3.54Å; M149-K190 WeakPolarHBondContact CA-O 3.33Å; M149-K190 WeakPolarHBondContact CB-O 3.23Å; M149-K190 PolarHBondContact N-O 3.12Å; G150-K190 PolarHBondContact N-O 3.37Å; K190-A216 CarbonylContact C-O 3.37Å; K190-A216 WeakPolarHBondContact CA-O 3.31Å; K190-A216 HydrophobicContact CB-CB 4.07Å; K190-A216 HydrophobicContact CD-CB 4.48Å; K190-A216 HydrophobicContact CG-CB 3.86Å; K190-N249 WeakPolarHBondContact CE-OD1 3.49Å; K190-N249 PolarHBondContact NZ-OD1 2.99Å; K190-M275 HydrophobicContact CD-SD 4.02Å; K190-M275 VanDerWaalsContact CE-SD 3.54Å
191	I	98.6	Very high	98.1	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	168.3	-177.5	71.6	170.9	0	0	0	112.7	M149 L166 V204 I207 V215 A216 V217 H218	M149-I191 HydrophobicContact CB-CG2 4.08Å; M149-I191 HydrophobicContact SD-CG2 4.18Å; L166-I191 HydrophobicContact CD2-CB 4.2Å; L166-I191 HydrophobicContact CD2-CG2 4.24Å; I191-V204 HydrophobicContact CD1-CG2 3.52Å; I191-I207 HydrophobicContact CG2-CD1 4.04Å; I191-V215 HydrophobicContact CD1-CG2 4.39Å; I191-V215 HydrophobicContact CG1-CG2 4.32Å; I191-V215 HydrophobicContact CG2-CG2 4.49Å; I191-A216 PolarHBondContact N-O 3.42Å; I191-V217 HydrophobicContact CD1-CG2 4.22Å; I191-V217 HydrophobicContact CG1-CB 4.49Å; I191-V217 HydrophobicContact CG1-CG1 4.4Å; I191-V217 HydrophobicContact CG1-CG2 4.13Å; I191-H218 WeakPolarHBondContact O-CB 3.07Å; I191-H218 PolarHBondContact O-N 3.35Å
192	R	98.1	Very high	98.1	Very high	30 Å²	30	38.2 Å²	38.2	11%	0.113	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	158.6	156	-81.3	-173.6	178.8	-121.5	-0.3	109.1	G150 L166 H218 R220 F221 E224	G150-R192 WeakPolarHBondContact O-CD 3.12Å; G150-R192 PolarHBondContact O-NE 3.18Å; L166-R192 HydrophobicContact CD1-CB 4.33Å; R192-H218 HydrophobicContact CG-CB 4.12Å; R192-R220 WeakPolarHBondContact CB-O 3.42Å; R192-R220 WeakPolarHBondContact CG-O 3.23Å; R192-F221 PolarHBondContact NH1-O 3.21Å; R192-E224 PolarHBondContact NH1-O 3.07Å; R192-E224 VanDerWaalsContact NH1-O 3.12Å
193	I	98.3	Very high	98.1	Very high	3 Å²	3	37.5 Å²	37.5	2%	0.015	21%	0.214	C	C	.	.			trans	-70.1	152.3	174.3	59.3	170.4	0	0	0	111.6	T200 V217 H218 F221 H231 Y234	I193-T200 HydrophobicContact CB-CG2 4.16Å; I193-T200 HydrophobicContact CG2-CG2 3.99Å; I193-V217 HydrophobicContact CG2-CG1 3.74Å; I193-H218 PolarHBondContact N-O 3.29Å; I193-F221 HydrophobicContact CB-CD1 4.47Å; I193-F221 HydrophobicContact CD1-CD1 3.69Å; I193-F221 HydrophobicContact CD1-CE1 3.46Å; I193-F221 VanDerWaalsContact CD1-CE1 3.46Å; I193-F221 HydrophobicContact CD1-CG 4.3Å; I193-F221 HydrophobicContact CD1-CZ 3.93Å; I193-F221 HydrophobicContact CG1-CD1 3.58Å; I193-F221 HydrophobicContact CG1-CE1 3.81Å; I193-F221 HydrophobicContact CG1-CG 4.29Å; I193-H231 HydrophobicContact CD1-CB 3.82Å; I193-Y234 HydrophobicContact CB-CD1 3.84Å; I193-Y234 HydrophobicContact CB-CE1 4.48Å; I193-Y234 HydrophobicContact CD1-CD1 3.83Å; I193-Y234 HydrophobicContact CD1-CD2 4.46Å; I193-Y234 HydrophobicContact CD1-CE1 4.31Å; I193-Y234 HydrophobicContact CD1-CG 3.9Å; I193-Y234 HydrophobicContact CG1-CD1 4.39Å; I193-Y234 HydrophobicContact CG2-CD1 4.04Å; I193-Y234 HydrophobicContact CG2-CG 4.38Å
194	L	97.8	Very high	98.1	Very high	31 Å²	31	36.7 Å²	36.7	16%	0.162	21%	0.209	C	C	.	.			trans	-94	163.7	178.1	-66.2	-177	0	0	0	111.3	L166 S196 E199 T200 L203 F221	L166-L194 HydrophobicContact CB-CD2 4.03Å; L166-L194 HydrophobicContact CD1-CD2 4.35Å; L194-S196 PolarHBondContact O-N 2.63Å; L194-S196 VanDerWaalsContact O-N 3.09Å; L194-E199 HydrophobicContact CB-CB 4Å; L194-E199 HydrophobicContact CD1-CB 3.86Å; L194-T200 WeakPolarHBondContact CB-OG1 3.44Å; L194-T200 PolarHBondContact N-OG1 3.46Å; L194-T200 PolarHBondContact O-OG1 2.74Å; L194-L203 HydrophobicContact CD1-CB 4.16Å; L194-L203 HydrophobicContact CD1-CD2 3.91Å; L194-L203 HydrophobicContact CG-CD2 4.34Å; L194-F221 WeakPolarHBondContact O-CD1 3.13Å; L194-F221 WeakPolarHBondContact O-CE1 3.31Å
195	P	96.7	Very high	98.2	Very high	105 Å²	105	36.1 Å²	36.1	68%	0.682	20%	0.196	S	C	*	.	S	Bend	trans	-54.6	-28.5	-174.7	-28.5	37.2	0	0	0	115.7	Y234	P195-Y234 PolarHBondContact O-OH 3.33Å
196	S	97.4	Very high	98.3	Very high	31 Å²	31	38.4 Å²	38.4	22%	0.217	20%	0.202	C	C	.	.	S	Bend	trans	-116.3	155.9	171.1	80.3	0	0	0	0	113.3	L194 E199 T200	L194-S196 PolarHBondContact O-N 2.63Å; L194-S196 VanDerWaalsContact O-N 3.09Å; S196-E199 VanDerWaalsContact OG-CB 3.26Å; S196-E199 WeakPolarHBondContact OG-CB 3.48Å; S196-E199 WeakPolarHBondContact OG-CG 3.45Å; S196-E199 PolarHBondContact OG-N 3.16Å; S196-E199 VanDerWaalsContact OG-N 3.11Å; S196-E199 PolarHBondContact OG-OE2 2.71Å; S196-T200 PolarHBondContact O-N 2.77Å; S196-T200 VanDerWaalsContact O-N 3.11Å; S196-T200 PolarHBondContact O-OG1 3.49Å
197	L	97.8	Very high	98.3	Very high	56 Å²	56	36.8 Å²	36.8	29%	0.293	19%	0.191	S	C	.	.	H	α-helix	trans	-64.9	-43.4	177.3	-171.4	68.1	0	0	0	110.4	T200 V201 Y234 A237	L197-T200 PolarHBondContact O-N 2.64Å; L197-V201 WeakPolarHBondContact O-CG2 3.46Å; L197-V201 PolarHBondContact O-N 3.24Å; L197-Y234 HydrophobicContact CB-CE1 4.17Å; L197-Y234 HydrophobicContact CD1-CD1 3.75Å; L197-Y234 HydrophobicContact CD1-CD2 3.87Å; L197-Y234 HydrophobicContact CD1-CE1 4.06Å; L197-Y234 HydrophobicContact CD1-CE2 4.14Å; L197-Y234 HydrophobicContact CD1-CG 3.66Å; L197-Y234 PolarHBondContact N-OH 2.85Å; L197-A237 HydrophobicContact CD1-CB 3.65Å; L197-A237 HydrophobicContact CD2-CB 4.17Å; L197-A237 HydrophobicContact CG-CB 4.16Å
198	E	98.1	Very high	98.3	Very high	137 Å²	137	38.8 Å²	38.8	64%	0.64	20%	0.2	S	C	*	.	H	α-helix	trans	-63.1	-43.6	-179.4	-61.5	75.2	-164.2	0	0	111.3	S202	E198-S202 WeakPolarHBondContact O-CB 3.25Å; E198-S202 PolarHBondContact O-N 2.99Å
199	E	98	Very high	98.3	Very high	102 Å²	102	46.5 Å²	46.5	48%	0.477	23%	0.234	S	C	.	.	H	α-helix	trans	-62.9	-44.2	175.4	-75.5	174.7	161.6	0	0	111.1	L194 S196 S202 L203	L194-E199 HydrophobicContact CB-CB 4Å; L194-E199 HydrophobicContact CD1-CB 3.86Å; S196-E199 VanDerWaalsContact OG-CB 3.26Å; S196-E199 WeakPolarHBondContact OG-CB 3.48Å; S196-E199 WeakPolarHBondContact OG-CG 3.45Å; S196-E199 PolarHBondContact OG-N 3.16Å; S196-E199 VanDerWaalsContact OG-N 3.11Å; S196-E199 PolarHBondContact OG-OE2 2.71Å; E199-S202 PolarHBondContact O-N 3.03Å; E199-L203 WeakPolarHBondContact O-CB 3.35Å; E199-L203 PolarHBondContact O-N 3.29Å
200	T	98.5	Very high	98.3	Very high	1 Å²	1	47 Å²	47	1%	0.006	24%	0.237	C	C	.	.	H	α-helix	trans	-61	-50.6	178.4	-57.8	0	0	0	0	110.8	I193 L194 S196 L197 L203 V204 Y234 V238	I193-T200 HydrophobicContact CB-CG2 4.16Å; I193-T200 HydrophobicContact CG2-CG2 3.99Å; L194-T200 WeakPolarHBondContact CB-OG1 3.44Å; L194-T200 PolarHBondContact N-OG1 3.46Å; L194-T200 PolarHBondContact O-OG1 2.74Å; S196-T200 PolarHBondContact O-N 2.77Å; S196-T200 VanDerWaalsContact O-N 3.11Å; S196-T200 PolarHBondContact O-OG1 3.49Å; L197-T200 PolarHBondContact O-N 2.64Å; T200-L203 PolarHBondContact O-N 3.46Å; T200-V204 WeakPolarHBondContact O-CG2 3.28Å; T200-V204 PolarHBondContact O-N 3.19Å; T200-V204 VanDerWaalsContact O-N 3.08Å; T200-Y234 HydrophobicContact CG2-CD1 4.4Å; T200-V238 HydrophobicContact CG2-CG2 3.73Å
201	V	98.6	Very high	98.3	Very high	26 Å²	26	48.3 Å²	48.3	16%	0.158	26%	0.256	C	S	.	.	H	α-helix	trans	-61.8	-46.3	179.4	169.2	0	0	0	0	111	L197 L203 V204 Q205 A237 V238 A241	L197-V201 WeakPolarHBondContact O-CG2 3.46Å; L197-V201 PolarHBondContact O-N 3.24Å; V201-L203 VanDerWaalsContact C-N 3.34Å; V201-L203 PolarHBondContact O-N 2.92Å; V201-V204 PolarHBondContact O-N 3Å; V201-Q205 HydrophobicContact CG1-CG 4.43Å; V201-Q205 WeakPolarHBondContact O-CG 3.41Å; V201-Q205 PolarHBondContact O-N 3.45Å; V201-A237 HydrophobicContact CG2-CB 4.25Å; V201-V238 HydrophobicContact CG2-CG2 4.26Å; V201-A241 HydrophobicContact CG1-CB 3.53Å
202	S	98.4	Very high	98.2	Very high	63 Å²	63	48.4 Å²	48.4	44%	0.441	26%	0.257	S	S	.	.	H	α-helix	trans	-58.9	-43.9	177.9	-179.3	0	0	0	0	112	E198 E199 V204 Q205 R206	E198-S202 WeakPolarHBondContact O-CB 3.25Å; E198-S202 PolarHBondContact O-N 2.99Å; E199-S202 PolarHBondContact O-N 3.03Å; S202-V204 PolarHBondContact O-N 3.26Å; S202-Q205 PolarHBondContact O-N 3.26Å; S202-R206 WeakPolarHBondContact O-CG 3.5Å; S202-R206 PolarHBondContact O-N 3.05Å
203	L	98.5	Very high	98.3	Very high	7 Å²	7	48.7 Å²	48.7	4%	0.037	27%	0.265	C	S	.	.	H	α-helix	trans	-60.8	-46.1	175.9	176.8	63.2	0	0	0	111.6	L166 P169 I172 L194 E199 T200 V201 R206 I207	L166-L203 HydrophobicContact CD2-CD2 3.83Å; P169-L203 HydrophobicContact CB-CD1 4.18Å; P169-L203 HydrophobicContact CG-CD1 4.22Å; I172-L203 HydrophobicContact CD1-CD1 4.07Å; L194-L203 HydrophobicContact CD1-CB 4.16Å; L194-L203 HydrophobicContact CD1-CD2 3.91Å; L194-L203 HydrophobicContact CG-CD2 4.34Å; E199-L203 WeakPolarHBondContact O-CB 3.35Å; E199-L203 PolarHBondContact O-N 3.29Å; T200-L203 PolarHBondContact O-N 3.46Å; V201-L203 VanDerWaalsContact C-N 3.34Å; V201-L203 PolarHBondContact O-N 2.92Å; L203-R206 WeakPolarHBondContact O-CB 3.41Å; L203-R206 PolarHBondContact O-N 3.44Å; L203-I207 HydrophobicContact CD1-CD1 4.26Å; L203-I207 HydrophobicContact CD1-CG1 4.49Å; L203-I207 HydrophobicContact CG-CD1 4Å; L203-I207 WeakPolarHBondContact O-CG1 3.21Å; L203-I207 PolarHBondContact O-N 3.31Å
204	V	98.6	Very high	98.3	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.006	27%	0.265	C	S	.	.	H	α-helix	trans	-69	-35.6	-178.2	-174.7	0	0	0	0	111.9	I191 T200 V201 S202 R206 I207 E208 V215 V238 V242	I191-V204 HydrophobicContact CD1-CG2 3.52Å; T200-V204 WeakPolarHBondContact O-CG2 3.28Å; T200-V204 PolarHBondContact O-N 3.19Å; T200-V204 VanDerWaalsContact O-N 3.08Å; V201-V204 PolarHBondContact O-N 3Å; S202-V204 PolarHBondContact O-N 3.26Å; V204-R206 VanDerWaalsContact C-N 3.29Å; V204-R206 PolarHBondContact O-N 2.98Å; V204-I207 WeakPolarHBondContact O-CB 3.4Å; V204-I207 PolarHBondContact O-N 3.1Å; V204-E208 PolarHBondContact O-N 2.82Å; V204-V215 HydrophobicContact CG1-CG1 3.82Å; V204-V238 HydrophobicContact CB-CG1 3.96Å; V204-V238 HydrophobicContact CG1-CG1 3.72Å; V204-V238 HydrophobicContact CG2-CG1 3.84Å; V204-V238 HydrophobicContact CG2-CG2 4.24Å; V204-V242 HydrophobicContact CG1-CG1 3.96Å; V204-V242 HydrophobicContact CG1-CG2 4.37Å
205	Q	98.7	Very high	98.3	Very high	79 Å²	79	47 Å²	47	37%	0.369	26%	0.257	S	S	.	.	H	α-helix	trans	-63.5	-34.6	172	-73.2	178.8	-24.2	0	0	112.4	V201 S202 K209 A241 V242	V201-Q205 HydrophobicContact CG1-CG 4.43Å; V201-Q205 WeakPolarHBondContact O-CG 3.41Å; V201-Q205 PolarHBondContact O-N 3.45Å; S202-Q205 PolarHBondContact O-N 3.26Å; Q205-K209 WeakPolarHBondContact O-CG 3.45Å; Q205-K209 PolarHBondContact O-N 2.66Å; Q205-A241 PolarHBondContact NE2-O 3.41Å; Q205-V242 HydrophobicContact CG-CG1 3.99Å
206	R	98.5	Very high	98.4	Very high	75 Å²	75	42.1 Å²	42.1	28%	0.283	23%	0.225	S	C	.	.	H	α-helix	trans	-67.5	-43.1	171.5	-71.2	-175.6	68.7	172.2	-0.1	111.7	D170 E173 S202 L203 V204 K209	D170-R206 IonicContact OD1-CZ 3.8Å; D170-R206 IonicContact OD1-NH1 2.72Å; D170-R206 IonicContact OD1-NH2 3.42Å; D170-R206 PolarHBondContact OD1-NH2 2.92Å; E173-R206 IonicContact OE1-CZ 3.48Å; E173-R206 IonicContact OE1-NE 2.81Å; E173-R206 PolarHBondContact OE1-NE 3.21Å; E173-R206 IonicContact OE1-NH2 2.71Å; E173-R206 PolarHBondContact OE1-NH2 3.17Å; S202-R206 WeakPolarHBondContact O-CG 3.5Å; S202-R206 PolarHBondContact O-N 3.05Å; L203-R206 WeakPolarHBondContact O-CB 3.41Å; L203-R206 PolarHBondContact O-N 3.44Å; V204-R206 VanDerWaalsContact C-N 3.29Å; V204-R206 PolarHBondContact O-N 2.98Å; R206-K209 PolarHBondContact O-N 3.46Å
207	I	98.7	Very high	98.5	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-59.3	-46.7	175.3	-73.6	168.7	0	0	0	110.7	I172 L176 I191 L203 V204 K209 T210 V212	I172-I207 HydrophobicContact CG2-CD1 4.33Å; I172-I207 HydrophobicContact CG2-CG1 3.81Å; L176-I207 HydrophobicContact CD1-CB 4.39Å; L176-I207 HydrophobicContact CD1-CG1 4.17Å; L176-I207 HydrophobicContact CD1-CG2 3.9Å; I191-I207 HydrophobicContact CG2-CD1 4.04Å; L203-I207 HydrophobicContact CD1-CD1 4.26Å; L203-I207 HydrophobicContact CD1-CG1 4.49Å; L203-I207 HydrophobicContact CG-CD1 4Å; L203-I207 WeakPolarHBondContact O-CG1 3.21Å; L203-I207 PolarHBondContact O-N 3.31Å; V204-I207 WeakPolarHBondContact O-CB 3.4Å; V204-I207 PolarHBondContact O-N 3.1Å; I207-K209 VanDerWaalsContact C-N 3.28Å; I207-K209 PolarHBondContact O-N 2.8Å; I207-T210 WeakPolarHBondContact O-CB 3.36Å; I207-T210 WeakPolarHBondContact O-CG2 3.32Å; I207-T210 PolarHBondContact O-N 3.04Å; I207-T210 PolarHBondContact O-OG1 3.26Å; I207-V212 HydrophobicContact CG2-CG2 3.63Å
208	E	98.7	Very high	98.5	Very high	45 Å²	45	39.2 Å²	39.2	21%	0.21	21%	0.206	C	C	.	.	H	α-helix	trans	-55	-42.6	178.7	175.2	174.3	-128.9	0	0	112.2	V204 T210 G211 V242 S243 I244	V204-E208 PolarHBondContact O-N 2.82Å; E208-T210 PolarHBondContact O-N 3.37Å; E208-G211 PolarHBondContact O-N 3.24Å; E208-V242 HydrophobicContact CB-CG1 4.34Å; E208-S243 WeakPolarHBondContact OE1-CA 3.41Å; E208-S243 WeakPolarHBondContact OE1-CB 3.16Å; E208-S243 PolarHBondContact OE1-N 2.71Å; E208-I244 HydrophobicContact CB-CD1 4.07Å; E208-I244 HydrophobicContact CB-CG1 4.35Å; E208-I244 HydrophobicContact CG-CD1 4.36Å; E208-I244 HydrophobicContact CG-CG1 4.22Å; E208-I244 HydrophobicContact CG-CG2 4.01Å; E208-I244 PolarHBondContact OE1-N 3.4Å; E208-I244 VanDerWaalsContact OE1-N 3.11Å
209	K	98.6	Very high	98.5	Very high	164 Å²	164	32.7 Å²	32.7	71%	0.713	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-12.2	178.6	-69.2	171.6	-174.1	177.6	0	114.3	Q205 R206 I207 G211	Q205-K209 WeakPolarHBondContact O-CG 3.45Å; Q205-K209 PolarHBondContact O-N 2.66Å; R206-K209 PolarHBondContact O-N 3.46Å; I207-K209 VanDerWaalsContact C-N 3.28Å; I207-K209 PolarHBondContact O-N 2.8Å; K209-G211 VanDerWaalsContact C-N 3.3Å
210	T	98.6	Very high	98.5	Very high	9 Å²	9	28 Å²	28	6%	0.055	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-14	175.1	70.8	0	0	0	0	113	E173 L176 K177 I207 E208	E173-T210 HydrophobicContact CB-CG2 4.22Å; E173-T210 HydrophobicContact CG-CG2 3.95Å; L176-T210 HydrophobicContact CB-CG2 3.96Å; L176-T210 WeakPolarHBondContact CB-OG1 3.39Å; L176-T210 HydrophobicContact CD1-CG2 4.25Å; K177-T210 HydrophobicContact CG-CG2 4.1Å; I207-T210 WeakPolarHBondContact O-CB 3.36Å; I207-T210 WeakPolarHBondContact O-CG2 3.32Å; I207-T210 PolarHBondContact O-N 3.04Å; I207-T210 PolarHBondContact O-OG1 3.26Å; E208-T210 PolarHBondContact O-N 3.37Å
211	G	98.2	Very high	98.4	Very high	48 Å²	48	30.3 Å²	30.3	50%	0.495	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	89.7	16.3	-179	0	0	0	0	0	114.7	E208 K209	E208-G211 PolarHBondContact O-N 3.24Å; K209-G211 VanDerWaalsContact C-N 3.3Å
212	V	98.5	Very high	98.1	Very high	3 Å²	3	33.7 Å²	33.7	2%	0.018	18%	0.176	C	C	.	.			trans	-60	145.7	172.3	-69.6	0	0	0	0	111.7	L176 V180 V187 I207 I244	L176-V212 HydrophobicContact CB-CG1 4.25Å; L176-V212 HydrophobicContact CD1-CG1 3.89Å; L176-V212 HydrophobicContact CD2-CG1 3.85Å; L176-V212 HydrophobicContact CG-CG1 4.21Å; V180-V212 HydrophobicContact CG2-CG1 4.32Å; V187-V212 HydrophobicContact CG1-CG1 4.27Å; V187-V212 CarbonylContact O-C 3.59Å; V187-V212 VanDerWaalsContact O-CA 3.28Å; V187-V212 WeakPolarHBondContact O-CA 3.41Å; V187-V212 WeakPolarHBondContact O-CB 3.29Å; I207-V212 HydrophobicContact CG2-CG2 3.63Å; V212-I244 HydrophobicContact CG2-CD1 3.83Å
213	A	98.3	Very high	97.8	Very high	35 Å²	35	37.3 Å²	37.3	29%	0.289	19%	0.191	S	C	.	.	S	Bend	trans	-79.7	-23.1	-177	0	0	0	0	0	113.7	F45 P186 V187 T188 P245	F45-A213 HydrophobicContact CD2-CB 4.25Å; F45-A213 HydrophobicContact CE2-CB 4.31Å; P186-A213 HydrophobicContact CB-CB 3.71Å; V187-A213 PolarHBondContact O-N 3.31Å; T188-A213 HydrophobicContact CG2-CB 4.49Å; A213-P245 VanDerWaalsContact O-CD 3.27Å; A213-P245 WeakPolarHBondContact O-CD 3.36Å
214	A	98.6	Very high	97.6	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.8	162.9	176.2	0	0	0	0	0	111.5	F45 T188 C189 P245 I247	F45-A214 HydrophobicContact CB-CB 3.58Å; F45-A214 HydrophobicContact CD1-CB 4.28Å; F45-A214 HydrophobicContact CD2-CB 4.01Å; F45-A214 HydrophobicContact CG-CB 3.7Å; T188-A214 WeakPolarHBondContact CA-O 3.34Å; T188-A214 WeakPolarHBondContact CB-O 3.35Å; T188-A214 HydrophobicContact CG2-CB 3.87Å; C189-A214 PolarHBondContact N-O 3.48Å; A214-P245 WeakPolarHBondContact CA-O 3.35Å; A214-P245 HydrophobicContact CB-CB 4.11Å; A214-P245 WeakPolarHBondContact CB-O 3.34Å; A214-I247 HydrophobicContact CB-CD1 4.27Å
215	V	98.7	Very high	97.2	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	128.9	172.4	61.5	0	0	0	0	110.9	C189 I191 V204 V217 I244 P245 V246 I247	C189-V215 WeakPolarHBondContact O-CA 3.5Å; I191-V215 HydrophobicContact CD1-CG2 4.39Å; I191-V215 HydrophobicContact CG1-CG2 4.32Å; I191-V215 HydrophobicContact CG2-CG2 4.49Å; V204-V215 HydrophobicContact CG1-CG1 3.82Å; V215-V217 HydrophobicContact CG1-CG2 4.46Å; V215-V217 HydrophobicContact CG2-CG2 4.21Å; V215-I244 HydrophobicContact CB-CD1 4.33Å; V215-I244 HydrophobicContact CG1-CD1 4.05Å; V215-P245 PolarHBondContact N-O 3.1Å; V215-V246 HydrophobicContact CG1-CG2 3.91Å; V215-V246 CarbonylContact O-C 3.45Å; V215-V246 WeakPolarHBondContact O-CA 3.49Å; V215-I247 PolarHBondContact O-N 3.2Å
216	A	98.8	Very high	96.7	Very high	1 Å²	1	46.5 Å²	46.5	1%	0.008	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	123.5	171.3	0	0	0	0	0	110.4	C189 K190 I191 I247 M275	C189-A216 PolarHBondContact O-N 3.07Å; K190-A216 CarbonylContact C-O 3.37Å; K190-A216 WeakPolarHBondContact CA-O 3.31Å; K190-A216 HydrophobicContact CB-CB 4.07Å; K190-A216 HydrophobicContact CD-CB 4.48Å; K190-A216 HydrophobicContact CG-CB 3.86Å; I191-A216 PolarHBondContact N-O 3.42Å; A216-I247 WeakPolarHBondContact CA-O 3.43Å; A216-I247 HydrophobicContact CB-CB 4.08Å; A216-M275 HydrophobicContact CB-CE 3.83Å; A216-M275 HydrophobicContact CB-SD 4.3Å
217	V	98.8	Very high	96.4	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	112.1	-176.2	-175.7	0	0	0	0	109.6	I191 I193 V215 G219 I235 V238 V246 I247 N249	I191-V217 HydrophobicContact CD1-CG2 4.22Å; I191-V217 HydrophobicContact CG1-CB 4.49Å; I191-V217 HydrophobicContact CG1-CG1 4.4Å; I191-V217 HydrophobicContact CG1-CG2 4.13Å; I193-V217 HydrophobicContact CG2-CG1 3.74Å; V215-V217 HydrophobicContact CG1-CG2 4.46Å; V215-V217 HydrophobicContact CG2-CG2 4.21Å; V217-G219 PolarHBondContact O-N 2.94Å; V217-I235 HydrophobicContact CB-CG1 4.47Å; V217-I235 HydrophobicContact CG1-CG1 4.08Å; V217-V238 HydrophobicContact CG2-CG1 4.16Å; V217-V246 HydrophobicContact CB-CG1 4.48Å; V217-V246 HydrophobicContact CG2-CG1 3.89Å; V217-I247 PolarHBondContact N-O 3.14Å; V217-N249 PolarHBondContact O-N 3.34Å
218	H	98.4	Very high	96.1	Very high	26 Å²	26	54.4 Å²	54.4	12%	0.12	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	109	165.3	-171.8	172.8	0	0	0	108.4	I191 R192 I193 R220 N249	I191-H218 WeakPolarHBondContact O-CB 3.07Å; I191-H218 PolarHBondContact O-N 3.35Å; R192-H218 HydrophobicContact CG-CB 4.12Å; I193-H218 PolarHBondContact N-O 3.29Å; H218-R220 PolarHBondContact NE2-NH1 3.48Å; H218-R220 PolarHBondContact O-N 2.88Å; H218-N249 WeakPolarHBondContact CA-O 3.36Å; H218-N249 HydrophobicContact CB-CB 4.45Å
219	G	97.8	Very high	95.9	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	28%	0.282	C	S	.	.			trans	-71.2	45.2	-179.5	0	0	0	0	0	114.5	V217 V230 H231 N249	V217-G219 PolarHBondContact O-N 2.94Å; G219-V230 CarbonylContact O-C 3.58Å; G219-V230 WeakPolarHBondContact O-CA 3.25Å; G219-V230 WeakPolarHBondContact O-CG2 2.94Å; G219-H231 PolarHBondContact O-CD2 2.76Å; G219-H231 PolarHBondContact O-N 2.94Å; G219-N249 PolarHBondContact N-O 2.92Å
220	R	97.4	Very high	95.9	Very high	3 Å²	3	49.5 Å²	49.5	1%	0.011	25%	0.253	C	S	.	.	S	Bend	trans	-136.7	140.3	170.8	-75.5	-172.6	-179.4	86.3	-10.2	110	R192 H218 E224 P226 H228 G250 D254	R192-R220 WeakPolarHBondContact CB-O 3.42Å; R192-R220 WeakPolarHBondContact CG-O 3.23Å; H218-R220 PolarHBondContact NE2-NH1 3.48Å; H218-R220 PolarHBondContact O-N 2.88Å; R220-E224 WeakPolarHBondContact CA-OE2 3.21Å; R220-E224 HydrophobicContact CB-CB 4.04Å; R220-E224 WeakPolarHBondContact CB-OE2 3.48Å; R220-E224 HydrophobicContact CG-CB 4.44Å; R220-P226 PolarHBondContact NH2-O 3.24Å; R220-H228 PolarHBondContact NE-O 3.04Å; R220-H228 PolarHBondContact NH2-O 3.24Å; R220-G250 PolarHBondContact NH1-O 3.19Å; R220-D254 IonicContact CZ-OD2 3.55Å; R220-D254 IonicContact NH2-OD2 2.63Å; R220-D254 PolarHBondContact NH2-OD2 3.2Å
221	F	96.4	Very high	95.8	Very high	50 Å²	50	51.1 Å²	51.1	22%	0.219	26%	0.259	C	S	.	.			trans	-62.6	163.8	174.4	-52.9	-60.4	0	0	0	110.9	R192 I193 L194 D223 E224 H231 Y234	R192-F221 PolarHBondContact NH1-O 3.21Å; I193-F221 HydrophobicContact CB-CD1 4.47Å; I193-F221 HydrophobicContact CD1-CD1 3.69Å; I193-F221 HydrophobicContact CD1-CE1 3.46Å; I193-F221 VanDerWaalsContact CD1-CE1 3.46Å; I193-F221 HydrophobicContact CD1-CG 4.3Å; I193-F221 HydrophobicContact CD1-CZ 3.93Å; I193-F221 HydrophobicContact CG1-CD1 3.58Å; I193-F221 HydrophobicContact CG1-CE1 3.81Å; I193-F221 HydrophobicContact CG1-CG 4.29Å; L194-F221 WeakPolarHBondContact O-CD1 3.13Å; L194-F221 WeakPolarHBondContact O-CE1 3.31Å; F221-D223 VanDerWaalsContact C-N 3.29Å; F221-D223 PolarHBondContact O-N 3.46Å; F221-E224 HydrophobicContact CB-CB 4.49Å; F221-E224 HydrophobicContact CB-CG 4.05Å; F221-E224 HydrophobicContact CD2-CG 3.92Å; F221-E224 WeakPolarHBondContact CD2-OE1 3.27Å; F221-E224 WeakPolarHBondContact CD2-OE2 3.46Å; F221-E224 HydrophobicContact CG-CG 4.46Å; F221-E224 PolarHBondContact N-OE2 3.31Å; F221-E224 PolarHBondContact O-N 3.47Å; F221-H231 AromaticContact CD2-NE2 3.95Å; F221-H231 AromaticContact CE2-CE1 3.82Å; F221-H231 AromaticContact CE2-NE2 3.41Å; F221-H231 WeakPolarHBondContact CE2-NE2 3.27Å; F221-Y234 AromaticContact CE1-CE1 3.93Å; F221-Y234 HydrophobicContact CE1-CE1 3.93Å; F221-Y234 HydrophobicContact CZ-CE1 4.38Å; F221-Y234 HydrophobicContact CZ-CE2 4.42Å
222	K	93	Very high	95.8	Very high	97 Å²	97	50 Å²	50	42%	0.422	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-45.2	179.7	-179.8	-175.9	170	-172.3	0	113.1	P152 A163 E224	P152-K222 HydrophobicContact CB-CG 4.11Å; A163-K222 HydrophobicContact CB-CD 4.17Å; A163-K222 HydrophobicContact CB-CG 4.11Å; K222-E224 VanDerWaalsContact C-N 3.34Å
223	D	92.3	Very high	95.8	Very high	140 Å²	140	54 Å²	54	75%	0.749	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-6.3	-173.8	-56	-41.8	0	0	0	113	F221 R225	F221-D223 VanDerWaalsContact C-N 3.29Å; F221-D223 PolarHBondContact O-N 3.46Å; D223-R225 PolarHBondContact O-N 2.98Å
224	E	94.2	Very high	95.8	Very high	33 Å²	33	53.6 Å²	53.6	15%	0.154	26%	0.256	C	S	.	.			trans	-76.4	123.2	176.6	-76.6	-177.5	148.1	0	0	112.2	R192 R220 F221 K222 H228 H231	R192-E224 PolarHBondContact NH1-O 3.07Å; R192-E224 VanDerWaalsContact NH1-O 3.12Å; R220-E224 WeakPolarHBondContact CA-OE2 3.21Å; R220-E224 HydrophobicContact CB-CB 4.04Å; R220-E224 WeakPolarHBondContact CB-OE2 3.48Å; R220-E224 HydrophobicContact CG-CB 4.44Å; F221-E224 HydrophobicContact CB-CB 4.49Å; F221-E224 HydrophobicContact CB-CG 4.05Å; F221-E224 HydrophobicContact CD2-CG 3.92Å; F221-E224 WeakPolarHBondContact CD2-OE1 3.27Å; F221-E224 WeakPolarHBondContact CD2-OE2 3.46Å; F221-E224 HydrophobicContact CG-CG 4.46Å; F221-E224 PolarHBondContact N-OE2 3.31Å; F221-E224 PolarHBondContact O-N 3.47Å; K222-E224 VanDerWaalsContact C-N 3.34Å; E224-H228 HydrophobicContact CB-CB 4.21Å; E224-H228 HydrophobicContact CG-CB 4.19Å; E224-H231 IonicContact OE1-CD2 2.64Å; E224-H231 IonicContact OE1-CE1 3.69Å; E224-H231 IonicContact OE1-NE2 2.85Å; E224-H231 PolarHBondContact OE1-NE2 2.88Å; E224-H231 IonicContact OE2-CD2 3.32Å; E224-H231 PolarHBondContact OE2-CD2 2.64Å; E224-H231 IonicContact OE2-NE2 3.66Å; E224-H231 PolarHBondContact OE2-NE2 3.35Å
225	R	90	Very high	95.8	Very high	175 Å²	175	53.6 Å²	53.6	66%	0.66	26%	0.256	S	S	*	.			trans	-79.2	163.6	172.8	-62.1	-170.5	-176.1	-159.4	0.6	112.5	D223 R227 H228	D223-R225 PolarHBondContact O-N 2.98Å; R225-R227 HydrophobicContact CB-CG 4.27Å; R225-R227 PolarHBondContact O-N 3.5Å; R225-H228 PolarHBondContact N-ND1 3.36Å; R225-H228 WeakPolarHBondContact O-CB 3.48Å; R225-H228 PolarHBondContact O-N 3.13Å; R225-H228 PolarHBondContact O-ND1 3.09Å
226	P	89.3	Confident	95.8	Very high	72 Å²	72	57.3 Å²	57.3	47%	0.468	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-11.2	-178.1	-19.3	30.6	0	0	0	116.1	R220 R278	R220-P226 PolarHBondContact NH2-O 3.24Å; P226-R278 PolarHBondContact O-NH1 3.37Å
227	R	90.3	Very high	95.8	Very high	195 Å²	195	58.3 Å²	58.3	74%	0.736	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-19.5	172.6	69.4	177.7	178.6	83.4	1.6	114	R225	R225-R227 HydrophobicContact CB-CG 4.27Å; R225-R227 PolarHBondContact O-N 3.5Å
228	H	94.3	Very high	95.8	Very high	47 Å²	47	58.3 Å²	58.3	22%	0.218	28%	0.281	C	S	.	.	S	Bend	trans	-77.4	146.9	175.1	-56.5	91.3	0	0	0	108.5	R220 E224 R225	R220-H228 PolarHBondContact NE-O 3.04Å; R220-H228 PolarHBondContact NH2-O 3.24Å; E224-H228 HydrophobicContact CB-CB 4.21Å; E224-H228 HydrophobicContact CG-CB 4.19Å; R225-H228 PolarHBondContact N-ND1 3.36Å; R225-H228 WeakPolarHBondContact O-CB 3.48Å; R225-H228 PolarHBondContact O-N 3.13Å; R225-H228 PolarHBondContact O-ND1 3.09Å
229	P	94.5	Very high	95.8	Very high	89 Å²	89	58.2 Å²	58.2	58%	0.578	29%	0.286	S	S	*	.	P	Polyproline II helix	trans	-61.3	160.7	177.6	27	-34.5	0	0	0	111.3
230	V	97.1	Very high	95.8	Very high	17 Å²	17	65.2 Å²	65.2	10%	0.103	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-89.6	131.3	171.5	58.3	0	0	0	0	109.2	G219 C232 I235 L255 F265	G219-V230 CarbonylContact O-C 3.58Å; G219-V230 WeakPolarHBondContact O-CA 3.25Å; G219-V230 WeakPolarHBondContact O-CG2 2.94Å; V230-C232 PolarHBondContact O-N 3.19Å; V230-C232 VanDerWaalsContact O-N 3.16Å; V230-I235 HydrophobicContact CG2-CD1 4.22Å; V230-L255 HydrophobicContact CG1-CD1 3.48Å; V230-L255 VanDerWaalsContact CG1-CD1 3.48Å; V230-L255 HydrophobicContact CG1-CG 4.19Å; V230-F265 HydrophobicContact CG1-CE2 4.45Å
231	H	97.8	Very high	95.9	Very high	42 Å²	42	66.6 Å²	66.6	19%	0.194	33%	0.33	C	S	.	.			trans	-80.3	89.5	178	-61.3	-83.1	0	0	0	109.7	I193 G219 F221 E224 D233 Y234	I193-H231 HydrophobicContact CD1-CB 3.82Å; G219-H231 PolarHBondContact O-CD2 2.76Å; G219-H231 PolarHBondContact O-N 2.94Å; F221-H231 AromaticContact CD2-NE2 3.95Å; F221-H231 AromaticContact CE2-CE1 3.82Å; F221-H231 AromaticContact CE2-NE2 3.41Å; F221-H231 WeakPolarHBondContact CE2-NE2 3.27Å; E224-H231 IonicContact OE1-CD2 2.64Å; E224-H231 IonicContact OE1-CE1 3.69Å; E224-H231 IonicContact OE1-NE2 2.85Å; E224-H231 PolarHBondContact OE1-NE2 2.88Å; E224-H231 IonicContact OE2-CD2 3.32Å; E224-H231 PolarHBondContact OE2-CD2 2.64Å; E224-H231 IonicContact OE2-NE2 3.66Å; E224-H231 PolarHBondContact OE2-NE2 3.35Å; H231-D233 VanDerWaalsContact C-N 3.33Å; H231-D233 VanDerWaalsContact C-OD1 3.25Å; H231-D233 WeakPolarHBondContact CA-OD1 3.2Å; H231-D233 WeakPolarHBondContact CB-OD1 3.2Å; H231-Y234 HydrophobicContact CB-CD2 3.89Å; H231-Y234 HydrophobicContact CB-CG 4.24Å
232	C	97.9	Very high	95.9	Very high	24 Å²	24	65 Å²	65	16%	0.162	32%	0.324	C	S	.	.	H	α-helix	trans	-71.7	-31.1	-179.2	-64.7	0	0	0	0	112.3	V230 Y234 I235 Q236 T269	V230-C232 PolarHBondContact O-N 3.19Å; V230-C232 VanDerWaalsContact O-N 3.16Å; C232-Y234 VanDerWaalsContact C-N 3.34Å; C232-I235 PolarHBondContact O-N 2.91Å; C232-Q236 WeakPolarHBondContact O-CB 3.36Å; C232-Q236 PolarHBondContact O-N 3.23Å; C232-T269 HydrophobicContact CB-CG2 3.93Å
233	D	97.9	Very high	96.2	Very high	87 Å²	87	65 Å²	65	47%	0.465	34%	0.336	S	S	.	.	H	α-helix	trans	-57.6	-42.7	172.9	59.7	-40.5	0	0	0	112	H231 Q236 A237	H231-D233 VanDerWaalsContact C-N 3.33Å; H231-D233 VanDerWaalsContact C-OD1 3.25Å; H231-D233 WeakPolarHBondContact CA-OD1 3.2Å; H231-D233 WeakPolarHBondContact CB-OD1 3.2Å; D233-Q236 PolarHBondContact O-N 3.15Å; D233-A237 WeakPolarHBondContact O-CB 3.45Å; D233-A237 PolarHBondContact O-N 3.48Å
234	Y	98.6	Very high	96.4	Very high	28 Å²	28	59.6 Å²	59.6	11%	0.11	31%	0.307	C	S	.	.	H	α-helix	trans	-63.1	-45.8	174.3	-86.2	-114.8	0	0	0	112.1	I193 P195 L197 T200 F221 H231 C232 Q236 A237 V238	I193-Y234 HydrophobicContact CB-CD1 3.84Å; I193-Y234 HydrophobicContact CB-CE1 4.48Å; I193-Y234 HydrophobicContact CD1-CD1 3.83Å; I193-Y234 HydrophobicContact CD1-CD2 4.46Å; I193-Y234 HydrophobicContact CD1-CE1 4.31Å; I193-Y234 HydrophobicContact CD1-CG 3.9Å; I193-Y234 HydrophobicContact CG1-CD1 4.39Å; I193-Y234 HydrophobicContact CG2-CD1 4.04Å; I193-Y234 HydrophobicContact CG2-CG 4.38Å; P195-Y234 PolarHBondContact O-OH 3.33Å; L197-Y234 HydrophobicContact CB-CE1 4.17Å; L197-Y234 HydrophobicContact CD1-CD1 3.75Å; L197-Y234 HydrophobicContact CD1-CD2 3.87Å; L197-Y234 HydrophobicContact CD1-CE1 4.06Å; L197-Y234 HydrophobicContact CD1-CE2 4.14Å; L197-Y234 HydrophobicContact CD1-CG 3.66Å; L197-Y234 PolarHBondContact N-OH 2.85Å; T200-Y234 HydrophobicContact CG2-CD1 4.4Å; F221-Y234 AromaticContact CE1-CE1 3.93Å; F221-Y234 HydrophobicContact CE1-CE1 3.93Å; F221-Y234 HydrophobicContact CZ-CE1 4.38Å; F221-Y234 HydrophobicContact CZ-CE2 4.42Å; H231-Y234 HydrophobicContact CB-CD2 3.89Å; H231-Y234 HydrophobicContact CB-CG 4.24Å; C232-Y234 VanDerWaalsContact C-N 3.34Å; Y234-Q236 VanDerWaalsContact C-N 3.28Å; Y234-Q236 PolarHBondContact O-N 3.41Å; Y234-A237 PolarHBondContact O-N 3.14Å; Y234-V238 WeakPolarHBondContact O-CG2 3.03Å; Y234-V238 PolarHBondContact O-N 3.21Å
235	I	98.7	Very high	96.6	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-63.2	-41.1	179.1	-57.9	171.7	0	0	0	109.9	V217 V230 C232 V238 A239 V246 A248 F265 T269 T271	V217-I235 HydrophobicContact CB-CG1 4.47Å; V217-I235 HydrophobicContact CG1-CG1 4.08Å; V230-I235 HydrophobicContact CG2-CD1 4.22Å; C232-I235 PolarHBondContact O-N 2.91Å; I235-V238 PolarHBondContact O-N 3.13Å; I235-A239 WeakPolarHBondContact O-CB 3.43Å; I235-A239 PolarHBondContact O-N 3.16Å; I235-V246 HydrophobicContact CG2-CG1 4.26Å; I235-A248 HydrophobicContact CD1-CB 4.37Å; I235-A248 HydrophobicContact CG2-CB 4.01Å; I235-F265 HydrophobicContact CD1-CZ 4.38Å; I235-T269 HydrophobicContact CB-CG2 4.07Å; I235-T269 HydrophobicContact CD1-CG2 3.88Å; I235-T269 HydrophobicContact CG2-CG2 4.09Å; I235-T271 HydrophobicContact CG2-CG2 3.65Å
236	Q	98.6	Very high	97	Very high	77 Å²	77	50.7 Å²	50.7	36%	0.36	28%	0.275	S	S	.	.	H	α-helix	trans	-64.4	-45.9	178.4	-174	178.5	17.7	0	0	112.4	C232 D233 Y234 V238 A239 Q240 T269	C232-Q236 WeakPolarHBondContact O-CB 3.36Å; C232-Q236 PolarHBondContact O-N 3.23Å; D233-Q236 PolarHBondContact O-N 3.15Å; Y234-Q236 VanDerWaalsContact C-N 3.28Å; Y234-Q236 PolarHBondContact O-N 3.41Å; Q236-V238 VanDerWaalsContact C-N 3.3Å; Q236-V238 PolarHBondContact O-N 3.17Å; Q236-A239 PolarHBondContact O-N 3.29Å; Q236-Q240 WeakPolarHBondContact O-CG 3.14Å; Q236-Q240 PolarHBondContact O-N 3.04Å; Q236-T269 WeakPolarHBondContact CA-O 3.39Å; Q236-T269 WeakPolarHBondContact CB-O 3.45Å; Q236-T269 PolarHBondContact N-O 2.81Å
237	A	98.6	Very high	97.5	Very high	22 Å²	22	47.3 Å²	47.3	18%	0.182	25%	0.253	C	S	.	.	H	α-helix	trans	-60.5	-41.8	176.5	0	0	0	0	0	111.5	L197 V201 D233 Y234 Q240 A241	L197-A237 HydrophobicContact CD1-CB 3.65Å; L197-A237 HydrophobicContact CD2-CB 4.17Å; L197-A237 HydrophobicContact CG-CB 4.16Å; V201-A237 HydrophobicContact CG2-CB 4.25Å; D233-A237 WeakPolarHBondContact O-CB 3.45Å; D233-A237 PolarHBondContact O-N 3.48Å; Y234-A237 PolarHBondContact O-N 3.14Å; A237-Q240 PolarHBondContact O-N 3.11Å; A237-A241 VanDerWaalsContact O-CB 3.31Å; A237-A241 WeakPolarHBondContact O-CB 3.34Å; A237-A241 PolarHBondContact O-N 3.17Å; A237-A241 VanDerWaalsContact O-N 3.15Å
238	V	98.6	Very high	97.9	Very high	0 Å²	0	38 Å²	38	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-62	-47.9	174.1	171.1	0	0	0	0	111	T200 V201 V204 V217 Y234 I235 Q236 Q240 A241 V242 V246	T200-V238 HydrophobicContact CG2-CG2 3.73Å; V201-V238 HydrophobicContact CG2-CG2 4.26Å; V204-V238 HydrophobicContact CB-CG1 3.96Å; V204-V238 HydrophobicContact CG1-CG1 3.72Å; V204-V238 HydrophobicContact CG2-CG1 3.84Å; V204-V238 HydrophobicContact CG2-CG2 4.24Å; V217-V238 HydrophobicContact CG2-CG1 4.16Å; Y234-V238 WeakPolarHBondContact O-CG2 3.03Å; Y234-V238 PolarHBondContact O-N 3.21Å; I235-V238 PolarHBondContact O-N 3.13Å; Q236-V238 VanDerWaalsContact C-N 3.3Å; Q236-V238 PolarHBondContact O-N 3.17Å; V238-Q240 PolarHBondContact O-N 3.11Å; V238-A241 PolarHBondContact O-N 3.46Å; V238-V242 WeakPolarHBondContact O-CG2 3.36Å; V238-V242 PolarHBondContact O-N 3.24Å; V238-V246 HydrophobicContact CG1-CG1 4.41Å; V238-V246 HydrophobicContact CG1-CG2 4.12Å
239	A	98.4	Very high	98.1	Very high	25 Å²	25	36.1 Å²	36.1	21%	0.207	21%	0.209	C	C	.	.	H	α-helix	trans	-61.2	-30.1	-179.8	0	0	0	0	0	113.7	I235 Q236 V246 T271	I235-A239 WeakPolarHBondContact O-CB 3.43Å; I235-A239 PolarHBondContact O-N 3.16Å; Q236-A239 PolarHBondContact O-N 3.29Å; A239-V246 HydrophobicContact CB-CB 4.17Å; A239-V246 HydrophobicContact CB-CG1 4.48Å; A239-V246 HydrophobicContact CB-CG2 4.25Å; A239-T271 HydrophobicContact CB-CG2 4.03Å
240	Q	98.3	Very high	98.2	Very high	147 Å²	147	32.1 Å²	32.1	69%	0.687	18%	0.184	S	C	*	.	H	α-helix	trans	-79.5	-24.3	175.2	-70.6	171.7	-7.3	0	0	113.2	Q236 A237 V238	Q236-Q240 WeakPolarHBondContact O-CG 3.14Å; Q236-Q240 PolarHBondContact O-N 3.04Å; A237-Q240 PolarHBondContact O-N 3.11Å; V238-Q240 PolarHBondContact O-N 3.11Å
241	A	98.3	Very high	98	Very high	31 Å²	31	31.3 Å²	31.3	26%	0.256	18%	0.179	S	C	.	.	H	α-helix	trans	-90.7	-10.5	-171.9	0	0	0	0	0	114.7	V201 Q205 A237 V238	V201-A241 HydrophobicContact CG1-CB 3.53Å; Q205-A241 PolarHBondContact NE2-O 3.41Å; A237-A241 VanDerWaalsContact O-CB 3.31Å; A237-A241 WeakPolarHBondContact O-CB 3.34Å; A237-A241 PolarHBondContact O-N 3.17Å; A237-A241 VanDerWaalsContact O-N 3.15Å; V238-A241 PolarHBondContact O-N 3.46Å
242	V	98.2	Very high	97.7	Very high	16 Å²	16	29.4 Å²	29.4	10%	0.097	17%	0.171	C	C	.	.			trans	-132.3	156.9	-178.5	-59	0	0	0	0	111.9	V204 Q205 E208 V238 I244 V246	V204-V242 HydrophobicContact CG1-CG1 3.96Å; V204-V242 HydrophobicContact CG1-CG2 4.37Å; Q205-V242 HydrophobicContact CG-CG1 3.99Å; E208-V242 HydrophobicContact CB-CG1 4.34Å; V238-V242 WeakPolarHBondContact O-CG2 3.36Å; V238-V242 PolarHBondContact O-N 3.24Å; V242-I244 HydrophobicContact CB-CG1 4.21Å; V242-I244 HydrophobicContact CG2-CG1 3.9Å; V242-V246 HydrophobicContact CG2-CG2 3.76Å
243	S	97.6	Very high	96.9	Very high	97 Å²	97	31.7 Å²	31.7	68%	0.678	18%	0.181	S	C	*	.	S	Bend	trans	-91.9	-26.1	179.8	-58.5	0	0	0	0	113.1	R46 E208	R46-S243 PolarHBondContact NH2-O 3.15Å; E208-S243 WeakPolarHBondContact OE1-CA 3.41Å; E208-S243 WeakPolarHBondContact OE1-CB 3.16Å; E208-S243 PolarHBondContact OE1-N 2.71Å
244	I	97.7	Very high	96	Very high	27 Å²	27	30.7 Å²	30.7	14%	0.138	18%	0.176	C	C	.	.	S	Bend	trans	-66.2	149.5	175.3	60.1	168.7	0	0	0	111.7	E208 V212 V215 V242 V246	E208-I244 HydrophobicContact CB-CD1 4.07Å; E208-I244 HydrophobicContact CB-CG1 4.35Å; E208-I244 HydrophobicContact CG-CD1 4.36Å; E208-I244 HydrophobicContact CG-CG1 4.22Å; E208-I244 HydrophobicContact CG-CG2 4.01Å; E208-I244 PolarHBondContact OE1-N 3.4Å; E208-I244 VanDerWaalsContact OE1-N 3.11Å; V212-I244 HydrophobicContact CG2-CD1 3.83Å; V215-I244 HydrophobicContact CB-CD1 4.33Å; V215-I244 HydrophobicContact CG1-CD1 4.05Å; V242-I244 HydrophobicContact CB-CG1 4.21Å; V242-I244 HydrophobicContact CG2-CG1 3.9Å; I244-V246 PolarHBondContact O-N 2.84Å
245	P	98.3	Very high	95.4	Very high	14 Å²	14	32.8 Å²	32.8	9%	0.091	19%	0.188	C	C	.	.	P	Polyproline II helix	trans	-54.9	129.7	172.7	-23.1	32	0	0	0	112.9	F45 R46 A213 A214 V215	F45-P245 HydrophobicContact CB-CB 4.11Å; F45-P245 HydrophobicContact CB-CG 4.32Å; R46-P245 HydrophobicContact CG-CB 4.17Å; R46-P245 HydrophobicContact CG-CG 3.61Å; A213-P245 VanDerWaalsContact O-CD 3.27Å; A213-P245 WeakPolarHBondContact O-CD 3.36Å; A214-P245 WeakPolarHBondContact CA-O 3.35Å; A214-P245 HydrophobicContact CB-CB 4.11Å; A214-P245 WeakPolarHBondContact CB-O 3.34Å; V215-P245 PolarHBondContact N-O 3.1Å
246	V	98.8	Very high	95.1	Very high	8 Å²	8	32.8 Å²	32.8	5%	0.048	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	128.7	170.6	179.7	0	0	0	0	109.4	V215 V217 I235 V238 A239 V242 I244 T271	V215-V246 HydrophobicContact CG1-CG2 3.91Å; V215-V246 CarbonylContact O-C 3.45Å; V215-V246 WeakPolarHBondContact O-CA 3.49Å; V217-V246 HydrophobicContact CB-CG1 4.48Å; V217-V246 HydrophobicContact CG2-CG1 3.89Å; I235-V246 HydrophobicContact CG2-CG1 4.26Å; V238-V246 HydrophobicContact CG1-CG1 4.41Å; V238-V246 HydrophobicContact CG1-CG2 4.12Å; A239-V246 HydrophobicContact CB-CB 4.17Å; A239-V246 HydrophobicContact CB-CG1 4.48Å; A239-V246 HydrophobicContact CB-CG2 4.25Å; V242-V246 HydrophobicContact CG2-CG2 3.76Å; I244-V246 PolarHBondContact O-N 2.84Å; V246-T271 HydrophobicContact CB-CG2 4.16Å; V246-T271 HydrophobicContact CG1-CG2 3.94Å
247	I	98.8	Very high	94.6	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.005	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	109.6	180	-48.7	169.8	0	0	0	108.8	F45 I48 A214 V215 A216 V217 S273 M275	F45-I247 HydrophobicContact CB-CD1 4.49Å; F45-I247 HydrophobicContact CD1-CD1 3.89Å; I48-I247 HydrophobicContact CD1-CD1 4.37Å; A214-I247 HydrophobicContact CB-CD1 4.27Å; V215-I247 PolarHBondContact O-N 3.2Å; A216-I247 WeakPolarHBondContact CA-O 3.43Å; A216-I247 HydrophobicContact CB-CB 4.08Å; V217-I247 PolarHBondContact N-O 3.14Å; I247-S273 WeakPolarHBondContact CA-O 3.32Å; I247-M275 HydrophobicContact CG2-CB 3.6Å
248	A	98.7	Very high	94.1	Very high	0 Å²	0	37 Å²	37	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	131.9	-179.3	0	0	0	0	0	111.8	I235 F265 T269 T271 S273 V274 M275	I235-A248 HydrophobicContact CD1-CB 4.37Å; I235-A248 HydrophobicContact CG2-CB 4.01Å; A248-F265 HydrophobicContact CB-CD1 4.44Å; A248-F265 HydrophobicContact CB-CE1 3.81Å; A248-F265 HydrophobicContact CB-CZ 3.89Å; A248-T269 HydrophobicContact CB-CG2 4Å; A248-T269 WeakPolarHBondContact CB-OG1 3.22Å; A248-T271 HydrophobicContact CB-CG2 4.04Å; A248-T271 WeakPolarHBondContact CB-OG1 3.38Å; A248-S273 PolarHBondContact N-O 3.46Å; A248-V274 HydrophobicContact CB-CG2 4.33Å; A248-V274 WeakPolarHBondContact O-CA 3.32Å; A248-M275 PolarHBondContact O-N 3.03Å
249	N	98.5	Very high	93.9	Very high	6 Å²	6	39.1 Å²	39.1	3%	0.032	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	149.5	178	-178.5	-118.6	0	0	0	112.1	K190 V217 H218 G219 M275	K190-N249 WeakPolarHBondContact CE-OD1 3.49Å; K190-N249 PolarHBondContact NZ-OD1 2.99Å; V217-N249 PolarHBondContact O-N 3.34Å; H218-N249 WeakPolarHBondContact CA-O 3.36Å; H218-N249 HydrophobicContact CB-CB 4.45Å; G219-N249 PolarHBondContact N-O 2.92Å; N249-M275 HydrophobicContact CB-CB 4.32Å; N249-M275 PolarHBondContact ND2-O 3.06Å
250	G	96.3	Very high	93.6	Very high	5 Å²	5	41.5 Å²	41.5	5%	0.052	23%	0.232	C	C	.	.			trans	115.4	-9.7	175.8	0	0	0	0	0	115.1	R220 S252	R220-G250 PolarHBondContact NH1-O 3.19Å; G250-S252 VanDerWaalsContact C-N 3.31Å; G250-S252 PolarHBondContact O-N 3.19Å
251	G	93.4	Very high	93.4	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.204	C	C	.	.			trans	-73.7	-7.3	-175.7	0	0	0	0	0	116.7	L253 D254 L255 V256	G251-L253 PolarHBondContact O-N 3.38Å; G251-D254 PolarHBondContact O-N 3.44Å; G251-L255 WeakPolarHBondContact O-CA 3.31Å; G251-L255 PolarHBondContact O-N 3.38Å; G251-V256 PolarHBondContact O-N 3.28Å
252	S	91.7	Very high	93.3	Very high	2 Å²	2	34.2 Å²	34.2	1%	0.014	19%	0.193	C	C	.	.	B	Isolated β-bridge	trans	-57	139.3	-179.7	-58.1	0	0	0	0	112.3	G250 D254 R278 A279	G250-S252 VanDerWaalsContact C-N 3.31Å; G250-S252 PolarHBondContact O-N 3.19Å; S252-D254 PolarHBondContact O-N 3.45Å; S252-D254 VanDerWaalsContact O-N 3.08Å; S252-R278 PolarHBondContact O-NH2 2.99Å; S252-A279 PolarHBondContact OG-N 2.67Å
253	L	81.5	Confident	93	Very high	72 Å²	72	37.4 Å²	37.4	38%	0.377	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	74	-49	-175.1	-168.3	70.5	0	0	0	114.3	G251 V256 K257 W282	G251-L253 PolarHBondContact O-N 3.38Å; L253-V256 PolarHBondContact N-O 3.2Å; L253-V256 VanDerWaalsContact N-O 3.11Å; L253-K257 WeakPolarHBondContact O-CE 3.4Å; L253-W282 HydrophobicContact CB-CH2 3.95Å; L253-W282 HydrophobicContact CB-CZ3 3.89Å; L253-W282 HydrophobicContact CD1-CH2 4.01Å; L253-W282 HydrophobicContact CD1-CZ3 3.81Å; L253-W282 HydrophobicContact CD2-CH2 4.16Å; L253-W282 HydrophobicContact CG-CH2 4.26Å; L253-W282 HydrophobicContact CG-CZ3 4.34Å
254	D	78.4	Confident	92.9	Very high	67 Å²	67	38.9 Å²	38.9	36%	0.358	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-49.6	-172.6	-49	-43.2	0	0	0	110.9	R220 G251 S252 R278	R220-D254 IonicContact CZ-OD2 3.55Å; R220-D254 IonicContact NH2-OD2 2.63Å; R220-D254 PolarHBondContact NH2-OD2 3.2Å; G251-D254 PolarHBondContact O-N 3.44Å; S252-D254 PolarHBondContact O-N 3.45Å; S252-D254 VanDerWaalsContact O-N 3.08Å; D254-R278 IonicContact OD2-NH2 3.32Å
255	L	86.9	Confident	92.9	Very high	71 Å²	71	37.7 Å²	37.7	37%	0.372	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.4	-31.9	-174.9	-60.1	179	0	0	0	112.2	V230 G251 D261 F265	V230-L255 HydrophobicContact CG1-CD1 3.48Å; V230-L255 VanDerWaalsContact CG1-CD1 3.48Å; V230-L255 HydrophobicContact CG1-CG 4.19Å; G251-L255 WeakPolarHBondContact O-CA 3.31Å; G251-L255 PolarHBondContact O-N 3.38Å; L255-D261 WeakPolarHBondContact O-CB 3.44Å; L255-F265 HydrophobicContact CB-CD2 4.42Å; L255-F265 HydrophobicContact CD1-CD2 3.51Å; L255-F265 HydrophobicContact CD1-CE2 3.74Å; L255-F265 HydrophobicContact CD1-CG 4.49Å
256	V	90.9	Very high	92.8	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.198	C	C	.	.	B	Isolated β-bridge	trans	-119.1	112.5	-174.2	-174.7	0	0	0	0	110.6	G251 L253 D261 I262 F265 L276 V286	G251-V256 PolarHBondContact O-N 3.28Å; L253-V256 PolarHBondContact N-O 3.2Å; L253-V256 VanDerWaalsContact N-O 3.11Å; V256-D261 HydrophobicContact CB-CB 4.37Å; V256-D261 HydrophobicContact CG1-CB 4.25Å; V256-D261 HydrophobicContact CG2-CB 4.47Å; V256-I262 HydrophobicContact CG1-CG1 3.84Å; V256-F265 HydrophobicContact CG2-CB 3.78Å; V256-F265 HydrophobicContact CG2-CD1 4.07Å; V256-F265 HydrophobicContact CG2-CG 4.12Å; V256-L276 HydrophobicContact CB-CD2 4.19Å; V256-L276 HydrophobicContact CG1-CD1 3.98Å; V256-L276 HydrophobicContact CG1-CD2 3.94Å; V256-L276 HydrophobicContact CG2-CD2 4.21Å; V256-V286 HydrophobicContact CG1-CG2 4.47Å
257	K	88.3	Confident	92.7	Very high	147 Å²	147	45.9 Å²	45.9	64%	0.639	23%	0.227	S	C	*	.	S	Bend	trans	-118.1	-29.6	172.3	-63	178.5	-175.2	174.5	0	111.9	L253 D261	L253-K257 WeakPolarHBondContact O-CE 3.4Å; K257-D261 PolarHBondContact N-OD2 2.72Å; K257-D261 VanDerWaalsContact N-OD2 3.15Å
258	T	89.8	Confident	92.5	Very high	42 Å²	42	48.2 Å²	48.2	26%	0.258	25%	0.246	S	C	.	.	S	Bend	trans	-128.7	167.1	-179.6	66.8	0	0	0	0	111	S260 D261	T258-S260 PolarHBondContact O-N 3.38Å; T258-S260 PolarHBondContact OG1-OG 2.95Å; T258-D261 PolarHBondContact N-OD2 3.11Å; T258-D261 WeakPolarHBondContact O-CB 3.34Å; T258-D261 PolarHBondContact O-N 2.91Å; T258-D261 VanDerWaalsContact O-N 3.11Å; T258-D261 PolarHBondContact OG1-OD2 2.9Å
259	N	92.7	Very high	92.4	Very high	44 Å²	44	48.2 Å²	48.2	24%	0.235	25%	0.246	C	C	.	.	H	α-helix	trans	-54.8	-41.5	173.8	-179.1	-84.7	0	0	0	112.1	D261 I262 V286 F287 C288	N259-D261 PolarHBondContact O-N 3.28Å; N259-D261 VanDerWaalsContact O-N 3.11Å; N259-I262 VanDerWaalsContact O-CB 3.22Å; N259-I262 WeakPolarHBondContact O-CB 3.32Å; N259-I262 VanDerWaalsContact O-CG1 3.25Å; N259-I262 WeakPolarHBondContact O-CG1 3.5Å; N259-I262 PolarHBondContact O-N 3.27Å; N259-V286 WeakPolarHBondContact CA-O 3.48Å; N259-V286 WeakPolarHBondContact CB-O 3.46Å; N259-V286 PolarHBondContact N-O 2.81Å; N259-F287 PolarHBondContact ND2-O 3.33Å; N259-C288 WeakPolarHBondContact CB-O 3.42Å
260	S	92.5	Very high	92.3	Very high	75 Å²	75	50.1 Å²	50.1	52%	0.524	27%	0.268	S	S	.	.	H	α-helix	trans	-61.1	-24.1	179.9	74.3	0	0	0	0	114.1	T258 I262	T258-S260 PolarHBondContact O-N 3.38Å; T258-S260 PolarHBondContact OG1-OG 2.95Å; S260-I262 VanDerWaalsContact C-N 3.32Å
261	D	94.8	Very high	92.4	Very high	21 Å²	21	50.5 Å²	50.5	11%	0.112	27%	0.269	C	S	.	.	H	α-helix	trans	-79.4	-17	179.2	-60.5	-43.9	0	0	0	112.9	L255 V256 K257 T258 N259 E263 K264 F265	L255-D261 WeakPolarHBondContact O-CB 3.44Å; V256-D261 HydrophobicContact CB-CB 4.37Å; V256-D261 HydrophobicContact CG1-CB 4.25Å; V256-D261 HydrophobicContact CG2-CB 4.47Å; K257-D261 PolarHBondContact N-OD2 2.72Å; K257-D261 VanDerWaalsContact N-OD2 3.15Å; T258-D261 PolarHBondContact N-OD2 3.11Å; T258-D261 WeakPolarHBondContact O-CB 3.34Å; T258-D261 PolarHBondContact O-N 2.91Å; T258-D261 VanDerWaalsContact O-N 3.11Å; T258-D261 PolarHBondContact OG1-OD2 2.9Å; N259-D261 PolarHBondContact O-N 3.28Å; N259-D261 VanDerWaalsContact O-N 3.11Å; D261-E263 VanDerWaalsContact C-N 3.27Å; D261-E263 PolarHBondContact O-N 2.87Å; D261-K264 WeakPolarHBondContact O-CB 3.41Å; D261-K264 PolarHBondContact O-N 3.3Å; D261-K264 VanDerWaalsContact O-N 3.17Å; D261-K264 IonicContact OD1-NZ 2.58Å; D261-K264 PolarHBondContact OD1-NZ 2.89Å; D261-F265 PolarHBondContact O-N 3.04Å
262	I	94.8	Very high	92.3	Very high	3 Å²	3	52.1 Å²	52.1	2%	0.015	28%	0.28	C	S	.	.	H	α-helix	trans	-60.3	-42.3	178.3	-61.2	175.4	0	0	0	110	T49 V256 N259 S260 K264 F265 R266 V274 L276	T49-I262 HydrophobicContact CG2-CD1 3.82Å; T49-I262 HydrophobicContact CG2-CG2 4.06Å; V256-I262 HydrophobicContact CG1-CG1 3.84Å; N259-I262 VanDerWaalsContact O-CB 3.22Å; N259-I262 WeakPolarHBondContact O-CB 3.32Å; N259-I262 VanDerWaalsContact O-CG1 3.25Å; N259-I262 WeakPolarHBondContact O-CG1 3.5Å; N259-I262 PolarHBondContact O-N 3.27Å; S260-I262 VanDerWaalsContact C-N 3.32Å; I262-K264 VanDerWaalsContact C-N 3.34Å; I262-K264 PolarHBondContact O-N 3.3Å; I262-F265 PolarHBondContact O-N 2.98Å; I262-R266 PolarHBondContact O-N 3.19Å; I262-V274 HydrophobicContact CG2-CB 3.96Å; I262-V274 HydrophobicContact CG2-CG1 4.09Å; I262-V274 HydrophobicContact CG2-CG2 4.25Å; I262-L276 HydrophobicContact CD1-CD1 3.8Å; I262-L276 HydrophobicContact CG1-CD1 4.04Å
263	E	93.8	Very high	92.6	Very high	84 Å²	84	52 Å²	52	39%	0.393	28%	0.28	S	S	.	.	H	α-helix	trans	-67.7	-34.9	178	-175	53.7	-150	0	0	112.3	D261 F265 R266 K267	D261-E263 VanDerWaalsContact C-N 3.27Å; D261-E263 PolarHBondContact O-N 2.87Å; E263-F265 VanDerWaalsContact C-N 3.31Å; E263-F265 PolarHBondContact O-N 2.82Å; E263-R266 PolarHBondContact O-N 2.73Å; E263-R266 WeakPolarHBondContact OE2-CD 3.39Å; E263-R266 IonicContact OE2-NH1 2.92Å; E263-K267 WeakPolarHBondContact O-CG 3.33Å; E263-K267 PolarHBondContact O-N 2.89Å; E263-K267 WeakPolarHBondContact OE1-CE 3.37Å
264	K	94.8	Very high	93.4	Very high	127 Å²	127	48.6 Å²	48.6	55%	0.552	26%	0.262	S	S	*	.	H	α-helix	trans	-63.6	-40.7	173.1	-59.2	176.1	-167.9	156.1	0	110.7	D261 I262 K267 A268	D261-K264 WeakPolarHBondContact O-CB 3.41Å; D261-K264 PolarHBondContact O-N 3.3Å; D261-K264 VanDerWaalsContact O-N 3.17Å; D261-K264 IonicContact OD1-NZ 2.58Å; D261-K264 PolarHBondContact OD1-NZ 2.89Å; I262-K264 VanDerWaalsContact C-N 3.34Å; I262-K264 PolarHBondContact O-N 3.3Å; K264-K267 PolarHBondContact O-N 2.81Å; K264-A268 WeakPolarHBondContact O-CB 3.29Å; K264-A268 PolarHBondContact O-N 2.88Å
265	F	96.7	Very high	94.3	Very high	2 Å²	2	45.4 Å²	45.4	1%	0.009	25%	0.245	C	C	.	.	H	α-helix	trans	-69.4	-37.5	178	-173.4	-138	0	0	0	112.7	V230 I235 A248 L255 V256 D261 I262 E263 A268 T269 V274	V230-F265 HydrophobicContact CG1-CE2 4.45Å; I235-F265 HydrophobicContact CD1-CZ 4.38Å; A248-F265 HydrophobicContact CB-CD1 4.44Å; A248-F265 HydrophobicContact CB-CE1 3.81Å; A248-F265 HydrophobicContact CB-CZ 3.89Å; L255-F265 HydrophobicContact CB-CD2 4.42Å; L255-F265 HydrophobicContact CD1-CD2 3.51Å; L255-F265 HydrophobicContact CD1-CE2 3.74Å; L255-F265 HydrophobicContact CD1-CG 4.49Å; V256-F265 HydrophobicContact CG2-CB 3.78Å; V256-F265 HydrophobicContact CG2-CD1 4.07Å; V256-F265 HydrophobicContact CG2-CG 4.12Å; D261-F265 PolarHBondContact O-N 3.04Å; I262-F265 PolarHBondContact O-N 2.98Å; E263-F265 VanDerWaalsContact C-N 3.31Å; E263-F265 PolarHBondContact O-N 2.82Å; F265-A268 PolarHBondContact O-N 2.6Å; F265-T269 HydrophobicContact CD2-CG2 3.78Å; F265-T269 HydrophobicContact CE2-CG2 3.39Å; F265-T269 HydrophobicContact CZ-CG2 4.03Å; F265-T269 WeakPolarHBondContact O-CG2 3.49Å; F265-T269 PolarHBondContact O-N 3.22Å; F265-T269 VanDerWaalsContact O-N 3.1Å; F265-T269 PolarHBondContact O-OG1 3.33Å; F265-V274 HydrophobicContact CD1-CB 4.43Å; F265-V274 HydrophobicContact CD1-CG1 3.71Å; F265-V274 HydrophobicContact CD1-CG2 3.78Å; F265-V274 HydrophobicContact CE1-CG1 4.13Å; F265-V274 HydrophobicContact CE1-CG2 4.4Å; F265-V274 HydrophobicContact CG-CG2 4.48Å
266	R	96.6	Very high	94.9	Very high	42 Å²	42	42 Å²	42	16%	0.158	23%	0.227	C	C	.	.	H	α-helix	trans	-54.6	-53.8	169.5	-79.3	-177.6	176.1	130.9	4.8	111.3	I48 T49 I262 E263 A268 T269 G270 T271 S272 V274	I48-R266 VanDerWaalsContact C-NH2 3.28Å; I48-R266 PolarHBondContact O-NH2 3.49Å; T49-R266 PolarHBondContact OG1-NH2 3.03Å; I262-R266 PolarHBondContact O-N 3.19Å; E263-R266 PolarHBondContact O-N 2.73Å; E263-R266 WeakPolarHBondContact OE2-CD 3.39Å; E263-R266 IonicContact OE2-NH1 2.92Å; R266-A268 PolarHBondContact O-N 3Å; R266-T269 PolarHBondContact O-N 2.89Å; R266-T269 PolarHBondContact O-OG1 2.93Å; R266-G270 PolarHBondContact O-N 2.87Å; R266-T271 WeakPolarHBondContact CB-O 3.25Å; R266-T271 PolarHBondContact O-N 3.1Å; R266-T271 VanDerWaalsContact O-N 3.1Å; R266-S272 WeakPolarHBondContact CD-O 3.44Å; R266-S272 PolarHBondContact NE-O 2.94Å; R266-V274 HydrophobicContact CB-CG2 4.49Å; R266-V274 HydrophobicContact CG-CG2 3.51Å
267	K	96	Very high	95.2	Very high	153 Å²	153	43.1 Å²	43.1	67%	0.665	24%	0.236	S	C	*	.	H	α-helix	trans	-60.2	-46.3	179.3	-70.5	177.4	-177.7	179.6	0	112.5	E263 K264 T269 G270	E263-K267 WeakPolarHBondContact O-CG 3.33Å; E263-K267 PolarHBondContact O-N 2.89Å; E263-K267 WeakPolarHBondContact OE1-CE 3.37Å; K264-K267 PolarHBondContact O-N 2.81Å; K267-T269 PolarHBondContact O-N 3.26Å; K267-G270 PolarHBondContact O-N 3.19Å
268	A	95.8	Very high	95.5	Very high	49 Å²	49	38.4 Å²	38.4	41%	0.405	21%	0.214	S	C	.	.	H	α-helix	trans	-63.3	-27.3	-179.2	0	0	0	0	0	113.4	K264 F265 R266	K264-A268 WeakPolarHBondContact O-CB 3.29Å; K264-A268 PolarHBondContact O-N 2.88Å; F265-A268 PolarHBondContact O-N 2.6Å; R266-A268 PolarHBondContact O-N 3Å
269	T	97.1	Very high	95.8	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-101.9	-2.4	179.9	55.9	0	0	0	0	113.4	C232 I235 Q236 A248 F265 R266 K267 T271	C232-T269 HydrophobicContact CB-CG2 3.93Å; I235-T269 HydrophobicContact CB-CG2 4.07Å; I235-T269 HydrophobicContact CD1-CG2 3.88Å; I235-T269 HydrophobicContact CG2-CG2 4.09Å; Q236-T269 WeakPolarHBondContact CA-O 3.39Å; Q236-T269 WeakPolarHBondContact CB-O 3.45Å; Q236-T269 PolarHBondContact N-O 2.81Å; A248-T269 HydrophobicContact CB-CG2 4Å; A248-T269 WeakPolarHBondContact CB-OG1 3.22Å; F265-T269 HydrophobicContact CD2-CG2 3.78Å; F265-T269 HydrophobicContact CE2-CG2 3.39Å; F265-T269 HydrophobicContact CZ-CG2 4.03Å; F265-T269 WeakPolarHBondContact O-CG2 3.49Å; F265-T269 PolarHBondContact O-N 3.22Å; F265-T269 VanDerWaalsContact O-N 3.1Å; F265-T269 PolarHBondContact O-OG1 3.33Å; R266-T269 PolarHBondContact O-N 2.89Å; R266-T269 PolarHBondContact O-OG1 2.93Å; K267-T269 PolarHBondContact O-N 3.26Å; T269-T271 PolarHBondContact O-N 3.02Å; T269-T271 PolarHBondContact OG1-OG1 3.47Å
270	G	96.4	Very high	96	Very high	47 Å²	47	34.8 Å²	34.8	49%	0.485	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.4	22.1	-173.5	0	0	0	0	0	114.1	R266 K267	R266-G270 PolarHBondContact O-N 2.87Å; K267-G270 PolarHBondContact O-N 3.19Å
271	T	97.1	Very high	96.3	Very high	13 Å²	13	32.4 Å²	32.4	8%	0.08	18%	0.175	C	C	.	.			trans	-104.5	152.2	-177.9	62.8	0	0	0	0	111.8	I235 A239 V246 A248 R266 T269 S273	I235-T271 HydrophobicContact CG2-CG2 3.65Å; A239-T271 HydrophobicContact CB-CG2 4.03Å; V246-T271 HydrophobicContact CB-CG2 4.16Å; V246-T271 HydrophobicContact CG1-CG2 3.94Å; A248-T271 HydrophobicContact CB-CG2 4.04Å; A248-T271 WeakPolarHBondContact CB-OG1 3.38Å; R266-T271 WeakPolarHBondContact CB-O 3.25Å; R266-T271 PolarHBondContact O-N 3.1Å; R266-T271 VanDerWaalsContact O-N 3.1Å; T269-T271 PolarHBondContact O-N 3.02Å; T269-T271 PolarHBondContact OG1-OG1 3.47Å; T271-S273 PolarHBondContact OG1-O 3.08Å
272	S	91.2	Very high	96.4	Very high	34 Å²	34	33.7 Å²	33.7	24%	0.238	18%	0.178	C	C	.	.	S	Bend	trans	-83.3	-19	172	61.6	0	0	0	0	113.1	N47 R266	N47-S272 VanDerWaalsContact CA-O 3.31Å; N47-S272 WeakPolarHBondContact CA-O 3.39Å; N47-S272 WeakPolarHBondContact OD1-CB 3.38Å; R266-S272 WeakPolarHBondContact CD-O 3.44Å; R266-S272 PolarHBondContact NE-O 2.94Å
273	S	98.1	Very high	96.5	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	140.2	-165.7	-59.4	0	0	0	0	110.9	F45 N47 I48 I247 A248 T271	F45-S273 PolarHBondContact O-OG 3.01Å; N47-S273 PolarHBondContact N-OG 2.88Å; N47-S273 VanDerWaalsContact N-OG 3.16Å; I48-S273 PolarHBondContact N-OG 2.86Å; I48-S273 VanDerWaalsContact O-CA 3.27Å; I48-S273 WeakPolarHBondContact O-CA 3.27Å; I247-S273 WeakPolarHBondContact CA-O 3.32Å; A248-S273 PolarHBondContact N-O 3.46Å; T271-S273 PolarHBondContact OG1-O 3.08Å
274	V	98.4	Very high	96.6	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	140.5	-177.7	166.5	0	0	0	0	110	I48 T49 A50 A248 I262 F265 R266 L276	I48-V274 PolarHBondContact O-N 3.15Å; I48-V274 VanDerWaalsContact O-N 3.08Å; T49-V274 CarbonylContact C-O 3.45Å; T49-V274 WeakPolarHBondContact CA-O 3.31Å; A50-V274 PolarHBondContact N-O 3.34Å; A248-V274 HydrophobicContact CB-CG2 4.33Å; A248-V274 WeakPolarHBondContact O-CA 3.32Å; I262-V274 HydrophobicContact CG2-CB 3.96Å; I262-V274 HydrophobicContact CG2-CG1 4.09Å; I262-V274 HydrophobicContact CG2-CG2 4.25Å; F265-V274 HydrophobicContact CD1-CB 4.43Å; F265-V274 HydrophobicContact CD1-CG1 3.71Å; F265-V274 HydrophobicContact CD1-CG2 3.78Å; F265-V274 HydrophobicContact CE1-CG1 4.13Å; F265-V274 HydrophobicContact CE1-CG2 4.4Å; F265-V274 HydrophobicContact CG-CG2 4.48Å; R266-V274 HydrophobicContact CB-CG2 4.49Å; R266-V274 HydrophobicContact CG-CG2 3.51Å; V274-L276 HydrophobicContact CG1-CD2 3.61Å; V274-L276 HydrophobicContact CG1-CG 4.08Å
275	M	98.5	Very high	96.8	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	126.2	174.8	174.9	-172.3	-71.7	0	0	110.3	A50 A52 Y75 K190 A216 I247 A248 N249	A50-M275 HydrophobicContact CB-CB 4.24Å; A50-M275 HydrophobicContact CB-CG 4.36Å; A50-M275 CarbonylContact O-C 2.87Å; A50-M275 WeakPolarHBondContact O-CA 3.47Å; A52-M275 VanDerWaalsContact CA-CG 3.46Å; A52-M275 HydrophobicContact CB-CG 3.43Å; A52-M275 VanDerWaalsContact CB-CG 3.43Å; A52-M275 HydrophobicContact CB-SD 3.73Å; Y75-M275 HydrophobicContact CD1-CE 4.3Å; Y75-M275 HydrophobicContact CD2-CE 3.75Å; Y75-M275 HydrophobicContact CE1-CE 4.01Å; Y75-M275 HydrophobicContact CE2-CE 3.43Å; Y75-M275 VanDerWaalsContact CE2-CE 3.43Å; Y75-M275 HydrophobicContact CG-CE 4.19Å; K190-M275 HydrophobicContact CD-SD 4.02Å; K190-M275 VanDerWaalsContact CE-SD 3.54Å; A216-M275 HydrophobicContact CB-CE 3.83Å; A216-M275 HydrophobicContact CB-SD 4.3Å; I247-M275 HydrophobicContact CG2-CB 3.6Å; A248-M275 PolarHBondContact O-N 3.03Å; N249-M275 HydrophobicContact CB-CB 4.32Å; N249-M275 PolarHBondContact ND2-O 3.06Å
276	L	98	Very high	96.7	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	130.4	-177.4	-57.8	-176.8	0	0	0	112.1	A50 A52 V256 I262 V274 V286 F287	A50-L276 PolarHBondContact O-N 3.48Å; A52-L276 VanDerWaalsContact CB-O 3.3Å; A52-L276 WeakPolarHBondContact CB-O 3.25Å; A52-L276 PolarHBondContact N-O 3.41Å; V256-L276 HydrophobicContact CB-CD2 4.19Å; V256-L276 HydrophobicContact CG1-CD1 3.98Å; V256-L276 HydrophobicContact CG1-CD2 3.94Å; V256-L276 HydrophobicContact CG2-CD2 4.21Å; I262-L276 HydrophobicContact CD1-CD1 3.8Å; I262-L276 HydrophobicContact CG1-CD1 4.04Å; V274-L276 HydrophobicContact CG1-CD2 3.61Å; V274-L276 HydrophobicContact CG1-CG 4.08Å; L276-V286 HydrophobicContact CD1-CG1 4.03Å; L276-V286 HydrophobicContact CD1-CG2 4.17Å; L276-F287 HydrophobicContact CB-CE1 4.09Å; L276-F287 HydrophobicContact CB-CZ 4.05Å; L276-F287 HydrophobicContact CD1-CD1 4.35Å; L276-F287 HydrophobicContact CD1-CE1 3.82Å; L276-F287 HydrophobicContact CD1-CZ 4.42Å; L276-F287 HydrophobicContact CG-CE1 4.15Å
277	A	97	Very high	96.8	Very high	22 Å²	22	23.2 Å²	23.2	18%	0.182	14%	0.135	C	C	.	.	S	Bend	trans	-107.6	-84.7	177.8	0	0	0	0	0	110.9	A52 M54 A279 A280 M281	A52-A277 HydrophobicContact CB-CB 3.55Å; M54-A277 HydrophobicContact CG-CB 4.1Å; M54-A277 VanDerWaalsContact SD-CA 3.57Å; M54-A277 HydrophobicContact SD-CB 3.79Å; M54-A277 VanDerWaalsContact SD-O 3.37Å; A277-A279 VanDerWaalsContact C-N 3.33Å; A277-A279 PolarHBondContact O-N 3.08Å; A277-A280 PolarHBondContact O-N 3.05Å; A277-A280 VanDerWaalsContact O-N 3.1Å; A277-M281 PolarHBondContact O-N 3.2Å
278	R	96.4	Very high	96.8	Very high	49 Å²	49	16.8 Å²	16.8	19%	0.185	11%	0.109	C	C	.	.	H	α-helix	trans	-57.8	-40.6	-173.1	-69	176.9	-72.2	161.8	-2.4	113.4	P226 S252 D254 A280 M281 W282	P226-R278 PolarHBondContact O-NH1 3.37Å; S252-R278 PolarHBondContact O-NH2 2.99Å; D254-R278 IonicContact OD2-NH2 3.32Å; R278-A280 VanDerWaalsContact C-N 3.32Å; R278-A280 PolarHBondContact O-N 3.36Å; R278-M281 PolarHBondContact O-N 3.03Å; R278-W282 HydrophobicContact CB-CD2 4.46Å; R278-W282 HydrophobicContact CB-CE3 4.43Å; R278-W282 HydrophobicContact CB-CH2 3.89Å; R278-W282 HydrophobicContact CB-CZ2 3.91Å; R278-W282 HydrophobicContact CB-CZ3 4.15Å; R278-W282 HydrophobicContact CG-CZ2 4.4Å; R278-W282 VanDerWaalsContact O-CG 3.23Å; R278-W282 PolarHBondContact O-N 3.45Å
279	A	95.9	Very high	96.6	Very high	9 Å²	9	20.7 Å²	20.7	7%	0.074	12%	0.122	C	C	.	.	H	α-helix	trans	-60	-44.8	179.2	0	0	0	0	0	111.2	S252 A277 W282 N283 V286	S252-A279 PolarHBondContact OG-N 2.67Å; A277-A279 VanDerWaalsContact C-N 3.33Å; A277-A279 PolarHBondContact O-N 3.08Å; A279-W282 PolarHBondContact O-N 3.3Å; A279-N283 CarbonylContact O-C 3.45Å; A279-N283 PolarHBondContact O-N 3.15Å; A279-V286 HydrophobicContact CB-CG1 4.38Å; A279-V286 HydrophobicContact CB-CG2 4.15Å
280	A	97.1	Very high	96.2	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-71.8	-34.9	176.6	0	0	0	0	0	112.9	L51 A277 R278 W282 N283 P284 V286 F287	L51-A280 HydrophobicContact CD1-CB 3.52Å; A277-A280 PolarHBondContact O-N 3.05Å; A277-A280 VanDerWaalsContact O-N 3.1Å; R278-A280 VanDerWaalsContact C-N 3.32Å; R278-A280 PolarHBondContact O-N 3.36Å; A280-W282 VanDerWaalsContact C-N 3.32Å; A280-W282 PolarHBondContact O-N 2.82Å; A280-N283 CarbonylContact O-C 3.58Å; A280-N283 VanDerWaalsContact O-C 3.29Å; A280-N283 PolarHBondContact O-N 3.31Å; A280-P284 WeakPolarHBondContact O-CA 3.29Å; A280-P284 WeakPolarHBondContact O-CD 3.37Å; A280-V286 HydrophobicContact CB-CG1 4.05Å; A280-F287 HydrophobicContact CB-CE2 3.57Å; A280-F287 HydrophobicContact CB-CZ 3.82Å
281	M	97.8	Very high	95.8	Very high	26 Å²	26	27.8 Å²	27.8	13%	0.128	15%	0.148	C	C	.	.	H	α-helix	trans	-61	-39.8	173.8	178.7	-178.1	79.5	0	0	112.4	M54 V57 A277 R278 Q322	M54-M281 HydrophobicContact CE-CB 4.29Å; M54-M281 HydrophobicContact SD-CB 3.88Å; V57-M281 HydrophobicContact CG1-CB 4.13Å; V57-M281 HydrophobicContact CG1-CG 3.89Å; V57-M281 HydrophobicContact CG2-CG 3.9Å; V57-M281 HydrophobicContact CG2-SD 3.81Å; A277-M281 PolarHBondContact O-N 3.2Å; R278-M281 PolarHBondContact O-N 3.03Å; M281-Q322 HydrophobicContact CE-CB 4.34Å; M281-Q322 HydrophobicContact CE-CG 4.47Å; M281-Q322 HydrophobicContact CG-CB 3.77Å; M281-Q322 HydrophobicContact CG-CG 4.11Å; M281-Q322 HydrophobicContact SD-CB 4.15Å; M281-Q322 HydrophobicContact SD-CG 3.95Å
282	W	96.3	Very high	95.4	Very high	47 Å²	47	30.5 Å²	30.5	18%	0.178	17%	0.166	C	C	.	.	H	α-helix	trans	-76.8	-40.3	178.3	-61.1	-34.3	0	0	0	112.1	L253 R278 A279 A280 R325	L253-W282 HydrophobicContact CB-CH2 3.95Å; L253-W282 HydrophobicContact CB-CZ3 3.89Å; L253-W282 HydrophobicContact CD1-CH2 4.01Å; L253-W282 HydrophobicContact CD1-CZ3 3.81Å; L253-W282 HydrophobicContact CD2-CH2 4.16Å; L253-W282 HydrophobicContact CG-CH2 4.26Å; L253-W282 HydrophobicContact CG-CZ3 4.34Å; R278-W282 HydrophobicContact CB-CD2 4.46Å; R278-W282 HydrophobicContact CB-CE3 4.43Å; R278-W282 HydrophobicContact CB-CH2 3.89Å; R278-W282 HydrophobicContact CB-CZ2 3.91Å; R278-W282 HydrophobicContact CB-CZ3 4.15Å; R278-W282 HydrophobicContact CG-CZ2 4.4Å; R278-W282 VanDerWaalsContact O-CG 3.23Å; R278-W282 PolarHBondContact O-N 3.45Å; A279-W282 PolarHBondContact O-N 3.3Å; A280-W282 VanDerWaalsContact C-N 3.32Å; A280-W282 PolarHBondContact O-N 2.82Å; W282-R325 HydrophobicContact CG-CG 4.36Å
283	N	97.1	Very high	95.5	Very high	28 Å²	28	31.2 Å²	31.2	15%	0.15	17%	0.167	C	C	.	.			trans	-154.3	102	176.1	-169.2	-21.8	0	0	0	110.1	A279 A280 S285 V286 L293 V298	A279-N283 CarbonylContact O-C 3.45Å; A279-N283 PolarHBondContact O-N 3.15Å; A280-N283 CarbonylContact O-C 3.58Å; A280-N283 VanDerWaalsContact O-C 3.29Å; A280-N283 PolarHBondContact O-N 3.31Å; N283-S285 VanDerWaalsContact CG-OG 3.25Å; N283-S285 PolarHBondContact ND2-OG 2.83Å; N283-S285 PolarHBondContact O-N 3.39Å; N283-S285 VanDerWaalsContact O-N 3.08Å; N283-S285 WeakPolarHBondContact OD1-CB 3.47Å; N283-S285 PolarHBondContact OD1-N 2.87Å; N283-S285 PolarHBondContact OD1-OG 2.58Å; N283-V286 WeakPolarHBondContact O-CB 3.46Å; N283-V286 PolarHBondContact O-N 3.43Å; N283-L293 PolarHBondContact ND2-O 2.92Å; N283-V298 WeakPolarHBondContact OD1-CG2 3.26Å
284	P	97.4	Very high	95.4	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-62.8	-16.4	-179.5	22.2	-33.9	0	0	0	113.6	M62 L65 Y69 A280 V286 F287 V298 M323	M62-P284 HydrophobicContact SD-CB 3.86Å; M62-P284 HydrophobicContact SD-CG 3.98Å; L65-P284 HydrophobicContact CD2-CG 3.62Å; L65-P284 HydrophobicContact CG-CB 4.43Å; L65-P284 HydrophobicContact CG-CG 3.92Å; Y69-P284 VanDerWaalsContact CD2-C 3.49Å; Y69-P284 HydrophobicContact CD2-CB 4.08Å; Y69-P284 HydrophobicContact CD2-CG 4.31Å; Y69-P284 HydrophobicContact CE2-CB 4.48Å; Y69-P284 HydrophobicContact CE2-CG 4.21Å; A280-P284 WeakPolarHBondContact O-CA 3.29Å; A280-P284 WeakPolarHBondContact O-CD 3.37Å; P284-V286 PolarHBondContact O-N 2.85Å; P284-F287 WeakPolarHBondContact O-CD2 3.3Å; P284-F287 PolarHBondContact O-N 3.41Å; P284-V298 HydrophobicContact CG-CG1 3.5Å; P284-V298 VanDerWaalsContact CG-CG1 3.5Å; P284-M323 HydrophobicContact CG-CE 4.39Å
285	S	97.3	Very high	95.2	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-69.1	1.8	171.8	74.2	0	0	0	0	114.1	N283 F287 C288 P292 L293	N283-S285 VanDerWaalsContact CG-OG 3.25Å; N283-S285 PolarHBondContact ND2-OG 2.83Å; N283-S285 PolarHBondContact O-N 3.39Å; N283-S285 VanDerWaalsContact O-N 3.08Å; N283-S285 WeakPolarHBondContact OD1-CB 3.47Å; N283-S285 PolarHBondContact OD1-N 2.87Å; N283-S285 PolarHBondContact OD1-OG 2.58Å; S285-F287 PolarHBondContact O-N 2.87Å; S285-F287 VanDerWaalsContact O-N 3.15Å; S285-C288 WeakPolarHBondContact O-CB 3.14Å; S285-C288 PolarHBondContact O-N 3.44Å; S285-P292 WeakPolarHBondContact OG-CA 3.47Å; S285-L293 PolarHBondContact OG-N 2.77Å
286	V	96.3	Very high	95	Very high	5 Å²	5	40.5 Å²	40.5	3%	0.03	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-55.9	-24.9	166.4	70.6	0	0	0	0	112.6	V256 N259 L276 A279 A280 N283 P284 C288	V256-V286 HydrophobicContact CG1-CG2 4.47Å; N259-V286 WeakPolarHBondContact CA-O 3.48Å; N259-V286 WeakPolarHBondContact CB-O 3.46Å; N259-V286 PolarHBondContact N-O 2.81Å; L276-V286 HydrophobicContact CD1-CG1 4.03Å; L276-V286 HydrophobicContact CD1-CG2 4.17Å; A279-V286 HydrophobicContact CB-CG1 4.38Å; A279-V286 HydrophobicContact CB-CG2 4.15Å; A280-V286 HydrophobicContact CB-CG1 4.05Å; N283-V286 WeakPolarHBondContact O-CB 3.46Å; N283-V286 PolarHBondContact O-N 3.43Å; P284-V286 PolarHBondContact O-N 2.85Å; V286-C288 VanDerWaalsContact C-N 3.31Å
287	F	96.8	Very high	94.9	Very high	6 Å²	6	45.9 Å²	45.9	3%	0.026	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-77	-15.9	174.2	-59.5	-65	0	0	0	113.2	T49 L51 A66 Y69 A71 N259 L276 A280 P284 S285 N289	T49-F287 HydrophobicContact CG2-CD1 3.66Å; T49-F287 HydrophobicContact CG2-CE1 3.72Å; L51-F287 HydrophobicContact CB-CE2 4.36Å; L51-F287 HydrophobicContact CB-CZ 4.23Å; L51-F287 HydrophobicContact CD1-CE2 4.16Å; L51-F287 HydrophobicContact CD1-CZ 4.34Å; A66-F287 HydrophobicContact CB-CD2 4.06Å; A66-F287 HydrophobicContact CB-CE2 3.9Å; Y69-F287 CarbonylContact O-C 3.54Å; Y69-F287 WeakPolarHBondContact O-CB 3.37Å; A71-F287 HydrophobicContact CB-CD1 4.2Å; A71-F287 HydrophobicContact CB-CD2 3.96Å; A71-F287 HydrophobicContact CB-CE1 4.39Å; A71-F287 HydrophobicContact CB-CE2 4.16Å; A71-F287 HydrophobicContact CB-CG 3.99Å; A71-F287 HydrophobicContact CB-CZ 4.38Å; N259-F287 PolarHBondContact ND2-O 3.33Å; L276-F287 HydrophobicContact CB-CE1 4.09Å; L276-F287 HydrophobicContact CB-CZ 4.05Å; L276-F287 HydrophobicContact CD1-CD1 4.35Å; L276-F287 HydrophobicContact CD1-CE1 3.82Å; L276-F287 HydrophobicContact CD1-CZ 4.42Å; L276-F287 HydrophobicContact CG-CE1 4.15Å; A280-F287 HydrophobicContact CB-CE2 3.57Å; A280-F287 HydrophobicContact CB-CZ 3.82Å; P284-F287 WeakPolarHBondContact O-CD2 3.3Å; P284-F287 PolarHBondContact O-N 3.41Å; S285-F287 PolarHBondContact O-N 2.87Å; S285-F287 VanDerWaalsContact O-N 3.15Å; F287-N289 PolarHBondContact O-N 3.1Å
288	C	96.1	Very high	95	Very high	18 Å²	18	44.8 Å²	44.8	12%	0.122	23%	0.234	C	C	.	.			trans	-69.7	122.6	-176.1	-174.9	0	0	0	0	111.2	Y69 N259 S285 V286 Q290 G291	Y69-C288 HydrophobicContact CD1-CB 4.48Å; Y69-C288 VanDerWaalsContact O-CA 3.23Å; Y69-C288 WeakPolarHBondContact O-CA 3.29Å; Y69-C288 PolarHBondContact O-N 3.39Å; N259-C288 WeakPolarHBondContact CB-O 3.42Å; S285-C288 WeakPolarHBondContact O-CB 3.14Å; S285-C288 PolarHBondContact O-N 3.44Å; V286-C288 VanDerWaalsContact C-N 3.31Å; C288-Q290 PolarHBondContact O-N 3.2Å; C288-G291 WeakPolarHBondContact CB-O 3.43Å; C288-G291 PolarHBondContact O-N 2.7Å; C288-G291 VanDerWaalsContact O-N 3.08Å
289	N	91.9	Very high	95.1	Very high	130 Å²	130	42.5 Å²	42.5	70%	0.695	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-24.3	179.5	62.7	-4.9	0	0	0	113.8	F287 G291	F287-N289 PolarHBondContact O-N 3.1Å; N289-G291 VanDerWaalsContact C-N 3.25Å; N289-G291 PolarHBondContact O-N 3.2Å
290	Q	90.1	Very high	95.2	Very high	178 Å²	178	45.4 Å²	45.4	83%	0.832	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-3.2	176.9	-65.7	171.4	23.3	0	0	113.1	C288	C288-Q290 PolarHBondContact O-N 3.2Å
291	G	87.4	Confident	95.2	Very high	19 Å²	19	47.7 Å²	47.7	20%	0.196	25%	0.248	C	C	.	.			trans	104.3	169.3	-176.9	0	0	0	0	0	113.4	C288 N289	C288-G291 WeakPolarHBondContact CB-O 3.43Å; C288-G291 PolarHBondContact O-N 2.7Å; C288-G291 VanDerWaalsContact O-N 3.08Å; N289-G291 VanDerWaalsContact C-N 3.25Å; N289-G291 PolarHBondContact O-N 3.2Å
292	P	87.5	Confident	95.3	Very high	70 Å²	70	46.4 Å²	46.4	46%	0.455	24%	0.242	S	C	.	.	P	Polyproline II helix	trans	-68.6	134.3	-176.3	28.9	-34.1	0	0	0	111.2	S285	S285-P292 WeakPolarHBondContact OG-CA 3.47Å
293	L	94.9	Very high	95.4	Very high	48 Å²	48	44.3 Å²	44.3	25%	0.251	23%	0.234	S	C	.	.	P	Polyproline II helix	trans	-79.3	157.8	173.1	-64.6	-178.5	0	0	0	111.5	Y69 N283 S285 V295 K297 V298	Y69-L293 HydrophobicContact CD1-CD1 4.28Å; Y69-L293 HydrophobicContact CE1-CD1 3.41Å; Y69-L293 VanDerWaalsContact CE1-CD1 3.41Å; Y69-L293 HydrophobicContact CE1-CG 4.48Å; N283-L293 PolarHBondContact ND2-O 2.92Å; S285-L293 PolarHBondContact OG-N 2.77Å; L293-V295 PolarHBondContact O-N 3.16Å; L293-K297 HydrophobicContact CD1-CD 4.4Å; L293-V298 HydrophobicContact CB-CG2 3.88Å
294	P	95.4	Very high	95.5	Very high	84 Å²	84	44.5 Å²	44.5	55%	0.545	23%	0.233	S	C	.	.	P	Polyproline II helix	trans	-53.4	133.2	170.4	-25.4	34.9	0	0	0	111.5	E296 K297 V298	P294-E296 PolarHBondContact O-N 3.05Å; P294-K297 PolarHBondContact O-N 2.87Å; P294-K297 VanDerWaalsContact O-N 3.15Å; P294-V298 WeakPolarHBondContact O-CG2 3.5Å; P294-V298 PolarHBondContact O-N 2.97Å
295	V	94.3	Very high	95.5	Very high	24 Å²	24	45.3 Å²	45.3	15%	0.145	24%	0.236	C	C	.	.	H	α-helix	trans	-61.7	-30.5	-174.3	66.8	0	0	0	0	111.9	L293 V298 M299 M323	L293-V295 PolarHBondContact O-N 3.16Å; V295-V298 PolarHBondContact O-N 3.33Å; V295-M299 HydrophobicContact CG1-CE 4.32Å; V295-M299 HydrophobicContact CG2-CE 4.29Å; V295-M299 HydrophobicContact CG2-CG 4.32Å; V295-M299 HydrophobicContact CG2-SD 4.45Å; V295-M299 WeakPolarHBondContact O-CB 3.4Å; V295-M299 WeakPolarHBondContact O-CG 3.34Å; V295-M299 PolarHBondContact O-N 3.19Å; V295-M323 HydrophobicContact CG2-CB 3.98Å
296	E	94.4	Very high	95.6	Very high	88 Å²	88	45.3 Å²	45.3	41%	0.411	24%	0.236	S	C	.	.	H	α-helix	trans	-60.6	-46.5	177.5	-63.2	75	-164.2	0	0	111.4	P294 V298 M299 E300 K327	P294-E296 PolarHBondContact O-N 3.05Å; E296-V298 VanDerWaalsContact C-N 3.32Å; E296-V298 PolarHBondContact O-N 3.46Å; E296-M299 HydrophobicContact CG-CE 4.35Å; E296-M299 PolarHBondContact O-N 3.34Å; E296-E300 PolarHBondContact O-N 2.89Å; E296-E300 VanDerWaalsContact O-N 3.09Å; E296-K327 IonicContact OE1-NZ 2.66Å; E296-K327 PolarHBondContact OE1-NZ 3.21Å
297	K	96.3	Very high	95.7	Very high	112 Å²	112	45.1 Å²	45.1	49%	0.487	24%	0.235	S	C	.	.	H	α-helix	trans	-63.3	-40.5	174.7	-178.5	176.1	179.4	178.8	0	111.5	L293 P294 E300 E301	L293-K297 HydrophobicContact CD1-CD 4.4Å; P294-K297 PolarHBondContact O-N 2.87Å; P294-K297 VanDerWaalsContact O-N 3.15Å; K297-E300 WeakPolarHBondContact O-CB 3.38Å; K297-E300 PolarHBondContact O-N 2.79Å; K297-E301 PolarHBondContact O-N 2.9Å; K297-E301 VanDerWaalsContact O-N 3.13Å
298	V	98	Very high	95.8	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-67.7	-39	-178.7	177.3	0	0	0	0	111.6	L65 Y69 N283 P284 L293 P294 V295 E296 E301 Y302	L65-V298 HydrophobicContact CD2-CG1 4.11Å; Y69-V298 HydrophobicContact CE2-CG1 4.13Å; Y69-V298 HydrophobicContact CE2-CG2 4.31Å; N283-V298 WeakPolarHBondContact OD1-CG2 3.26Å; P284-V298 HydrophobicContact CG-CG1 3.5Å; P284-V298 VanDerWaalsContact CG-CG1 3.5Å; L293-V298 HydrophobicContact CB-CG2 3.88Å; P294-V298 WeakPolarHBondContact O-CG2 3.5Å; P294-V298 PolarHBondContact O-N 2.97Å; V295-V298 PolarHBondContact O-N 3.33Å; E296-V298 VanDerWaalsContact C-N 3.32Å; E296-V298 PolarHBondContact O-N 3.46Å; V298-E301 PolarHBondContact O-N 3.28Å; V298-Y302 WeakPolarHBondContact O-CB 3.46Å; V298-Y302 PolarHBondContact O-N 2.65Å
299	M	98.2	Very high	95.9	Very high	1 Å²	1	50.4 Å²	50.4	1%	0.005	25%	0.253	C	S	.	.	H	α-helix	trans	-64.3	-41.8	173.8	-73.9	-175.7	-63.5	0	0	111.7	V295 E296 Y302 I303 L320 M323 L324 Y349	V295-M299 HydrophobicContact CG1-CE 4.32Å; V295-M299 HydrophobicContact CG2-CE 4.29Å; V295-M299 HydrophobicContact CG2-CG 4.32Å; V295-M299 HydrophobicContact CG2-SD 4.45Å; V295-M299 WeakPolarHBondContact O-CB 3.4Å; V295-M299 WeakPolarHBondContact O-CG 3.34Å; V295-M299 PolarHBondContact O-N 3.19Å; E296-M299 HydrophobicContact CG-CE 4.35Å; E296-M299 PolarHBondContact O-N 3.34Å; M299-Y302 WeakPolarHBondContact O-CB 3.41Å; M299-Y302 PolarHBondContact O-N 2.64Å; M299-I303 WeakPolarHBondContact O-CD1 3.45Å; M299-I303 VanDerWaalsContact O-CG1 3.25Å; M299-I303 WeakPolarHBondContact O-CG1 3.27Å; M299-I303 PolarHBondContact O-N 2.93Å; M299-L320 HydrophobicContact CB-CD2 3.79Å; M299-L320 HydrophobicContact CG-CD2 3.77Å; M299-L320 HydrophobicContact SD-CD2 4.25Å; M299-M323 HydrophobicContact CG-CB 3.98Å; M299-M323 HydrophobicContact CG-CG 4.47Å; M299-M323 HydrophobicContact CG-SD 3.59Å; M299-M323 VanDerWaalsContact CG-SD 3.59Å; M299-M323 HydrophobicContact SD-CB 4.11Å; M299-L324 HydrophobicContact CE-CD2 3.93Å; M299-L324 HydrophobicContact SD-CD2 3.86Å; M299-L324 HydrophobicContact SD-CG 3.85Å; M299-Y349 HydrophobicContact CB-CE1 3.86Å; M299-Y349 HydrophobicContact CE-CE1 4.12Å; M299-Y349 HydrophobicContact SD-CE1 4.34Å; M299-Y349 PolarHBondContact SD-OH 2.85Å
300	E	98.2	Very high	96.1	Very high	69 Å²	69	48.4 Å²	48.4	32%	0.322	24%	0.242	S	C	.	.	H	α-helix	trans	-58	-49.3	175.9	-166.3	-167	131.1	0	0	111.5	E296 K297 Y302 I303 K304 L351	E296-E300 PolarHBondContact O-N 2.89Å; E296-E300 VanDerWaalsContact O-N 3.09Å; K297-E300 WeakPolarHBondContact O-CB 3.38Å; K297-E300 PolarHBondContact O-N 2.79Å; E300-Y302 PolarHBondContact O-N 2.8Å; E300-I303 PolarHBondContact O-N 2.79Å; E300-K304 WeakPolarHBondContact O-CG 3.27Å; E300-K304 PolarHBondContact O-N 2.95Å; E300-K304 VanDerWaalsContact OE1-CE 3.28Å; E300-K304 WeakPolarHBondContact OE1-CE 3.21Å; E300-K304 IonicContact OE1-NZ 3.71Å; E300-K304 PolarHBondContact OE1-NZ 2.84Å; E300-L351 HydrophobicContact CG-CD1 3.89Å; E300-L351 HydrophobicContact CG-CD2 3.92Å; E300-L351 HydrophobicContact CG-CG 4.29Å
301	E	98.4	Very high	96.5	Very high	48 Å²	48	41 Å²	41	22%	0.224	21%	0.208	C	C	.	.	H	α-helix	trans	-65.2	-37.5	177.7	-66.4	-54.2	132	0	0	112.7	L65 K297 V298 I303 K304 Y305	L65-E301 HydrophobicContact CD1-CB 3.84Å; K297-E301 PolarHBondContact O-N 2.9Å; K297-E301 VanDerWaalsContact O-N 3.13Å; V298-E301 PolarHBondContact O-N 3.28Å; E301-I303 VanDerWaalsContact C-N 3.35Å; E301-I303 PolarHBondContact O-N 3.08Å; E301-K304 PolarHBondContact O-N 3Å; E301-K304 IonicContact OE1-NZ 2.7Å; E301-K304 PolarHBondContact OE1-NZ 3.21Å; E301-Y305 WeakPolarHBondContact O-CD2 3.38Å; E301-Y305 PolarHBondContact O-N 3.27Å
302	Y	98.8	Very high	96.9	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-60.2	-44.4	172.9	178.6	-98.5	0	0	0	112	P61 M62 L65 V298 M299 E300 K304 Y305 A306 T316 C319 L320 M323	P61-Y302 HydrophobicContact CB-CD2 4.04Å; P61-Y302 HydrophobicContact CB-CE2 3.63Å; M62-Y302 HydrophobicContact CB-CE2 4.13Å; M62-Y302 HydrophobicContact CE-CD2 4.38Å; M62-Y302 HydrophobicContact CE-CE2 4.24Å; L65-Y302 HydrophobicContact CD2-CD2 4.17Å; L65-Y302 HydrophobicContact CD2-CG 4.43Å; V298-Y302 WeakPolarHBondContact O-CB 3.46Å; V298-Y302 PolarHBondContact O-N 2.65Å; M299-Y302 WeakPolarHBondContact O-CB 3.41Å; M299-Y302 PolarHBondContact O-N 2.64Å; E300-Y302 PolarHBondContact O-N 2.8Å; Y302-K304 VanDerWaalsContact C-N 3.33Å; Y302-K304 PolarHBondContact O-N 3.3Å; Y302-Y305 PolarHBondContact O-N 3.05Å; Y302-A306 PolarHBondContact O-N 2.91Å; Y302-T316 HydrophobicContact CE1-CG2 4.04Å; Y302-C319 HydrophobicContact CE1-CB 3.73Å; Y302-C319 HydrophobicContact CE2-CB 4.22Å; Y302-C319 VanDerWaalsContact CZ-CB 3.47Å; Y302-C319 WeakPolarHBondContact OH-CB 3.47Å; Y302-C319 PolarHBondContact OH-SG 2.91Å; Y302-L320 HydrophobicContact CD1-CD2 3.95Å; Y302-L320 HydrophobicContact CD1-CG 4.29Å; Y302-L320 HydrophobicContact CE1-CG 4.45Å; Y302-M323 HydrophobicContact CD1-CE 4.48Å; Y302-M323 HydrophobicContact CD2-CE 4Å; Y302-M323 HydrophobicContact CG-CE 3.95Å
303	I	98.7	Very high	97.3	Very high	2 Å²	2	43.9 Å²	43.9	1%	0.01	21%	0.212	C	C	.	.	H	α-helix	trans	-63.3	-41.4	178.3	-68.8	161.6	0	0	0	110.3	M299 E300 E301 Y305 A306 I307 L320 I345 Y349 L351	M299-I303 WeakPolarHBondContact O-CD1 3.45Å; M299-I303 VanDerWaalsContact O-CG1 3.25Å; M299-I303 WeakPolarHBondContact O-CG1 3.27Å; M299-I303 PolarHBondContact O-N 2.93Å; E300-I303 PolarHBondContact O-N 2.79Å; E301-I303 VanDerWaalsContact C-N 3.35Å; E301-I303 PolarHBondContact O-N 3.08Å; I303-Y305 VanDerWaalsContact C-N 3.31Å; I303-Y305 PolarHBondContact O-N 3.08Å; I303-A306 WeakPolarHBondContact O-CB 3.5Å; I303-A306 PolarHBondContact O-N 2.99Å; I303-A306 VanDerWaalsContact O-N 3.07Å; I303-I307 HydrophobicContact CG2-CD1 3.63Å; I303-I307 HydrophobicContact CG2-CG1 4.15Å; I303-I307 VanDerWaalsContact O-CG1 3.28Å; I303-I307 WeakPolarHBondContact O-CG1 3.29Å; I303-I307 PolarHBondContact O-N 3.05Å; I303-L320 HydrophobicContact CD1-CD1 3.95Å; I303-L320 HydrophobicContact CD1-CD2 4.1Å; I303-L320 HydrophobicContact CG1-CD1 3.93Å; I303-L320 HydrophobicContact CG1-CD2 4.02Å; I303-L320 HydrophobicContact CG1-CG 4.5Å; I303-I345 HydrophobicContact CD1-CG2 4.07Å; I303-I345 HydrophobicContact CG1-CG2 4.18Å; I303-Y349 HydrophobicContact CD1-CD1 3.91Å; I303-Y349 HydrophobicContact CD1-CD2 3.34Å; I303-Y349 HydrophobicContact CD1-CE1 4.13Å; I303-Y349 HydrophobicContact CD1-CE2 3.57Å; I303-Y349 HydrophobicContact CD1-CG 3.51Å; I303-L351 HydrophobicContact CB-CD1 3.97Å; I303-L351 HydrophobicContact CD1-CD1 4.49Å; I303-L351 HydrophobicContact CG2-CD1 3.63Å
304	K	98.7	Very high	97.4	Very high	32 Å²	32	47.3 Å²	47.3	14%	0.139	23%	0.225	C	C	.	.	H	α-helix	trans	-57.4	-43.8	176.5	-70	173	-172.3	162.6	0	111.8	E300 E301 Y302 I307 R308 F354	E300-K304 WeakPolarHBondContact O-CG 3.27Å; E300-K304 PolarHBondContact O-N 2.95Å; E300-K304 VanDerWaalsContact OE1-CE 3.28Å; E300-K304 WeakPolarHBondContact OE1-CE 3.21Å; E300-K304 IonicContact OE1-NZ 3.71Å; E300-K304 PolarHBondContact OE1-NZ 2.84Å; E301-K304 PolarHBondContact O-N 3Å; E301-K304 IonicContact OE1-NZ 2.7Å; E301-K304 PolarHBondContact OE1-NZ 3.21Å; Y302-K304 VanDerWaalsContact C-N 3.33Å; Y302-K304 PolarHBondContact O-N 3.3Å; K304-I307 PolarHBondContact O-N 3.23Å; K304-R308 WeakPolarHBondContact O-CB 3.32Å; K304-R308 VanDerWaalsContact O-CG 3.31Å; K304-R308 WeakPolarHBondContact O-CG 3.13Å; K304-R308 PolarHBondContact O-N 3.48Å; K304-F354 HydrophobicContact CB-CE1 3.88Å; K304-F354 HydrophobicContact CB-CZ 3.92Å; K304-F354 HydrophobicContact CG-CD1 4.16Å; K304-F354 HydrophobicContact CG-CE1 3.77Å; K304-F354 HydrophobicContact CG-CE2 4.45Å; K304-F354 HydrophobicContact CG-CZ 3.92Å
305	Y	98.8	Very high	97.6	Very high	17 Å²	17	44.2 Å²	44.2	7%	0.067	21%	0.205	C	C	.	.	H	α-helix	trans	-65.6	-42.1	172.8	-77.2	-56.3	0	0	0	113.1	L64 L65 D68 R114 E301 Y302 I303 I307 R308 Y309	L64-Y305 HydrophobicContact CB-CD1 4.3Å; L64-Y305 HydrophobicContact CB-CD2 4.49Å; L64-Y305 HydrophobicContact CB-CE1 4.13Å; L64-Y305 HydrophobicContact CB-CE2 4.31Å; L64-Y305 HydrophobicContact CB-CG 4.49Å; L64-Y305 HydrophobicContact CD1-CD1 3.96Å; L64-Y305 HydrophobicContact CD1-CE1 4.05Å; L65-Y305 HydrophobicContact CB-CD2 4.2Å; L65-Y305 HydrophobicContact CB-CE2 4.27Å; L65-Y305 HydrophobicContact CD1-CD2 4.41Å; L65-Y305 HydrophobicContact CD1-CE2 4.12Å; D68-Y305 VanDerWaalsContact CG-OH 3.25Å; D68-Y305 PolarHBondContact OD1-OH 3.11Å; D68-Y305 WeakPolarHBondContact OD2-CE2 3.43Å; D68-Y305 VanDerWaalsContact OD2-CZ 3.24Å; D68-Y305 PolarHBondContact OD2-OH 3.43Å; R114-Y305 PolarHBondContact NH1-OH 2.84Å; E301-Y305 WeakPolarHBondContact O-CD2 3.38Å; E301-Y305 PolarHBondContact O-N 3.27Å; Y302-Y305 PolarHBondContact O-N 3.05Å; I303-Y305 VanDerWaalsContact C-N 3.31Å; I303-Y305 PolarHBondContact O-N 3.08Å; Y305-I307 VanDerWaalsContact C-N 3.25Å; Y305-I307 PolarHBondContact O-N 3.16Å; Y305-R308 PolarHBondContact O-N 3.42Å; Y305-Y309 HydrophobicContact CD1-CD2 4.1Å; Y305-Y309 AromaticContact CD1-CE2 3.78Å; Y305-Y309 HydrophobicContact CD1-CE2 3.78Å; Y305-Y309 HydrophobicContact CE1-CE2 4.34Å; Y305-Y309 WeakPolarHBondContact O-CD2 3.28Å; Y305-Y309 PolarHBondContact O-N 3.05Å
306	A	98.6	Very high	97.8	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-59.4	-37.9	178.2	0	0	0	0	0	112.2	P61 Y302 I303 D310 N311 T316	P61-A306 HydrophobicContact CG-CB 4.31Å; Y302-A306 PolarHBondContact O-N 2.91Å; I303-A306 WeakPolarHBondContact O-CB 3.5Å; I303-A306 PolarHBondContact O-N 2.99Å; I303-A306 VanDerWaalsContact O-N 3.07Å; A306-D310 PolarHBondContact O-N 3.25Å; A306-N311 HydrophobicContact CB-CB 3.95Å; A306-N311 WeakPolarHBondContact O-CB 3.45Å; A306-N311 PolarHBondContact O-N 2.81Å; A306-T316 HydrophobicContact CB-CG2 3.7Å
307	I	98.3	Very high	97.9	Very high	2 Å²	2	41.1 Å²	41.1	1%	0.01	19%	0.188	C	C	.	.	H	α-helix	trans	-71.3	-50.5	176.2	-63.4	165.5	0	0	0	110.9	I303 K304 Y305 Y309 D310 S346 F354 Y355 I358	I303-I307 HydrophobicContact CG2-CD1 3.63Å; I303-I307 HydrophobicContact CG2-CG1 4.15Å; I303-I307 VanDerWaalsContact O-CG1 3.28Å; I303-I307 WeakPolarHBondContact O-CG1 3.29Å; I303-I307 PolarHBondContact O-N 3.05Å; K304-I307 PolarHBondContact O-N 3.23Å; Y305-I307 VanDerWaalsContact C-N 3.25Å; Y305-I307 PolarHBondContact O-N 3.16Å; I307-Y309 VanDerWaalsContact C-N 3.26Å; I307-Y309 PolarHBondContact O-N 3.28Å; I307-D310 PolarHBondContact O-N 3.27Å; I307-S346 VanDerWaalsContact CD1-OG 3.25Å; I307-S346 WeakPolarHBondContact CD1-OG 3.38Å; I307-F354 HydrophobicContact CB-CE1 4.21Å; I307-F354 HydrophobicContact CD1-CD1 3.86Å; I307-F354 HydrophobicContact CD1-CE1 4.07Å; I307-F354 HydrophobicContact CG2-CE1 4.24Å; I307-Y355 HydrophobicContact CD1-CD2 4.13Å; I307-Y355 HydrophobicContact CG1-CD2 4.02Å; I307-Y355 HydrophobicContact CG2-CD2 3.88Å; I307-I358 HydrophobicContact CG2-CB 3.92Å; I307-I358 HydrophobicContact CG2-CG1 4.32Å; I307-I358 HydrophobicContact CG2-CG2 3.86Å
308	R	98.3	Very high	98	Very high	94 Å²	94	38.8 Å²	38.8	36%	0.355	18%	0.176	S	C	.	.	H	α-helix	trans	-58	-38.6	-177.9	-76.3	177.1	-176.2	137.7	1.3	113	K304 Y305 F354 I358	K304-R308 WeakPolarHBondContact O-CB 3.32Å; K304-R308 VanDerWaalsContact O-CG 3.31Å; K304-R308 WeakPolarHBondContact O-CG 3.13Å; K304-R308 PolarHBondContact O-N 3.48Å; Y305-R308 PolarHBondContact O-N 3.42Å; R308-F354 HydrophobicContact CG-CZ 4.18Å; R308-I358 HydrophobicContact CG-CD1 4.19Å; R308-I358 HydrophobicContact CG-CG1 4.48Å
309	Y	98.1	Very high	98	Very high	40 Å²	40	38.9 Å²	38.9	16%	0.157	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.2	21.8	-176.2	-67.6	-67.1	0	0	0	113.4	L60 L64 T97 R110 C112 Y305 I307 N311	L60-Y309 HydrophobicContact CD2-CD1 3.7Å; L60-Y309 HydrophobicContact CD2-CD2 4.08Å; L60-Y309 HydrophobicContact CD2-CE1 4.14Å; L60-Y309 HydrophobicContact CD2-CE2 4.48Å; L60-Y309 HydrophobicContact CD2-CG 3.66Å; L60-Y309 HydrophobicContact CG-CD2 4.5Å; L60-Y309 HydrophobicContact CG-CG 4.48Å; L64-Y309 HydrophobicContact CD1-CD2 3.86Å; L64-Y309 HydrophobicContact CD1-CE2 3.2Å; T97-Y309 HydrophobicContact CG2-CD1 3.55Å; T97-Y309 HydrophobicContact CG2-CE1 3.77Å; R110-Y309 PolarHBondContact NH1-O 3.15Å; C112-Y309 HydrophobicContact CB-CE1 4.44Å; Y305-Y309 HydrophobicContact CD1-CD2 4.1Å; Y305-Y309 AromaticContact CD1-CE2 3.78Å; Y305-Y309 HydrophobicContact CD1-CE2 3.78Å; Y305-Y309 HydrophobicContact CE1-CE2 4.34Å; Y305-Y309 WeakPolarHBondContact O-CD2 3.28Å; Y305-Y309 PolarHBondContact O-N 3.05Å; I307-Y309 VanDerWaalsContact C-N 3.26Å; I307-Y309 PolarHBondContact O-N 3.28Å; Y309-N311 PolarHBondContact O-N 2.87Å; Y309-N311 VanDerWaalsContact O-N 3.1Å
310	D	96.3	Very high	98	Very high	89 Å²	89	38.8 Å²	38.8	48%	0.476	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	44.6	47.9	177.1	-172.1	38.1	0	0	0	112.7	L95 R110 A306 I307	L95-D310 HydrophobicContact CD1-CB 3.94Å; L95-D310 HydrophobicContact CD2-CB 4.15Å; R110-D310 PolarHBondContact NH1-O 3.22Å; A306-D310 PolarHBondContact O-N 3.25Å; I307-D310 PolarHBondContact O-N 3.27Å
311	N	98.3	Very high	98	Very high	21 Å²	21	36.7 Å²	36.7	11%	0.112	17%	0.169	C	C	.	.			trans	-73.4	135.1	-179.7	-171.7	63.1	0	0	0	109.5	P61 A306 Y309 A313 N315 T316 N342	P61-N311 HydrophobicContact CG-CB 3.82Å; A306-N311 HydrophobicContact CB-CB 3.95Å; A306-N311 WeakPolarHBondContact O-CB 3.45Å; A306-N311 PolarHBondContact O-N 2.81Å; Y309-N311 PolarHBondContact O-N 2.87Å; Y309-N311 VanDerWaalsContact O-N 3.1Å; N311-A313 PolarHBondContact O-N 2.87Å; N311-N315 PolarHBondContact ND2-OD1 2.83Å; N311-N315 PolarHBondContact OD1-OD1 3.09Å; N311-T316 PolarHBondContact ND2-N 2.99Å; N311-T316 PolarHBondContact ND2-OG1 3.31Å; N311-N342 PolarHBondContact O-ND2 2.92Å
312	H	96.6	Very high	97.9	Very high	137 Å²	137	37 Å²	37	63%	0.634	17%	0.17	S	C	*	.			trans	-58.9	130.8	-175.4	-172.2	-78.2	0	0	0	112.2	F314 N315 T316	H312-F314 VanDerWaalsContact C-N 3.29Å; H312-F314 VanDerWaalsContact ND1-CB 3.33Å; H312-F314 WeakPolarHBondContact ND1-CB 3.34Å; H312-F314 PolarHBondContact ND1-N 2.77Å; H312-F314 VanDerWaalsContact ND1-N 3.16Å; H312-F314 PolarHBondContact O-N 3.08Å; H312-F314 VanDerWaalsContact O-N 3.15Å; H312-N315 WeakPolarHBondContact O-CA 3.5Å; H312-N315 VanDerWaalsContact O-CB 3.31Å; H312-N315 WeakPolarHBondContact O-CB 3.27Å; H312-N315 PolarHBondContact O-N 3.36Å; H312-T316 PolarHBondContact O-N 2.71Å; H312-T316 PolarHBondContact O-OG1 3.42Å
313	A	95.9	Very high	97.8	Very high	13 Å²	13	37.3 Å²	37.3	11%	0.107	17%	0.172	C	C	.	.	H	α-helix	trans	-54.6	-40.2	-173.2	0	0	0	0	0	114	N311 N315 T316 K317 Q340 N342 I345	N311-A313 PolarHBondContact O-N 2.87Å; A313-N315 VanDerWaalsContact C-N 3.29Å; A313-N315 PolarHBondContact O-N 3.02Å; A313-T316 PolarHBondContact O-N 3.11Å; A313-K317 VanDerWaalsContact O-CB 3.29Å; A313-K317 WeakPolarHBondContact O-CB 3.22Å; A313-K317 PolarHBondContact O-N 3.34Å; A313-Q340 WeakPolarHBondContact CB-O 3.39Å; A313-N342 WeakPolarHBondContact CA-OD1 3.25Å; A313-I345 HydrophobicContact CB-CD1 4.5Å
314	F	97.1	Very high	97.7	Very high	120 Å²	120	37.4 Å²	37.4	53%	0.526	17%	0.173	S	C	.	.	H	α-helix	trans	-57.8	-39.9	173.5	179.9	-93.9	0	0	0	113	H312 Y318	H312-F314 VanDerWaalsContact C-N 3.29Å; H312-F314 VanDerWaalsContact ND1-CB 3.33Å; H312-F314 WeakPolarHBondContact ND1-CB 3.34Å; H312-F314 PolarHBondContact ND1-N 2.77Å; H312-F314 VanDerWaalsContact ND1-N 3.16Å; H312-F314 PolarHBondContact O-N 3.08Å; H312-F314 VanDerWaalsContact O-N 3.15Å; F314-Y318 WeakPolarHBondContact O-CB 3.46Å; F314-Y318 PolarHBondContact O-N 3.4Å
315	N	98.4	Very high	97.4	Very high	20 Å²	20	42 Å²	42	11%	0.107	19%	0.189	C	C	.	.	H	α-helix	trans	-70.8	-45.9	177.8	-178.9	-92.8	0	0	0	110.9	R56 T59 N311 H312 A313 K317 Y318 C319	R56-N315 PolarHBondContact O-ND2 2.74Å; T59-N315 PolarHBondContact OG1-OD1 3.49Å; N311-N315 PolarHBondContact ND2-OD1 2.83Å; N311-N315 PolarHBondContact OD1-OD1 3.09Å; H312-N315 WeakPolarHBondContact O-CA 3.5Å; H312-N315 VanDerWaalsContact O-CB 3.31Å; H312-N315 WeakPolarHBondContact O-CB 3.27Å; H312-N315 PolarHBondContact O-N 3.36Å; A313-N315 VanDerWaalsContact C-N 3.29Å; A313-N315 PolarHBondContact O-N 3.02Å; N315-K317 PolarHBondContact O-N 3.11Å; N315-Y318 WeakPolarHBondContact O-CB 3.35Å; N315-Y318 PolarHBondContact O-N 2.94Å; N315-Y318 VanDerWaalsContact O-N 3.15Å; N315-C319 PolarHBondContact O-N 3.47Å; N315-C319 VanDerWaalsContact O-N 3.07Å
316	T	98.5	Very high	96.9	Very high	1 Å²	1	47.6 Å²	47.6	1%	0.006	22%	0.22	C	C	.	.	H	α-helix	trans	-53	-53.6	174.8	-53.5	0	0	0	0	110.9	Y302 A306 N311 H312 A313 Y318 C319 L320 N342 I345	Y302-T316 HydrophobicContact CE1-CG2 4.04Å; A306-T316 HydrophobicContact CB-CG2 3.7Å; N311-T316 PolarHBondContact ND2-N 2.99Å; N311-T316 PolarHBondContact ND2-OG1 3.31Å; H312-T316 PolarHBondContact O-N 2.71Å; H312-T316 PolarHBondContact O-OG1 3.42Å; A313-T316 PolarHBondContact O-N 3.11Å; T316-Y318 PolarHBondContact O-N 2.9Å; T316-C319 PolarHBondContact O-N 2.99Å; T316-L320 HydrophobicContact CG2-CD1 4.19Å; T316-L320 WeakPolarHBondContact O-CG 3.48Å; T316-L320 PolarHBondContact O-N 3.29Å; T316-N342 PolarHBondContact OG1-OD1 2.86Å; T316-I345 HydrophobicContact CG2-CD1 4.06Å; T316-I345 HydrophobicContact CG2-CG2 4.43Å
317	K	97.8	Very high	96.5	Very high	46 Å²	46	52 Å²	52	20%	0.2	24%	0.24	C	C	.	.	H	α-helix	trans	-57.4	-44.1	175.8	169.8	175.1	153.4	175.4	0	112.7	A313 N315 C319 L320 C321 V336 Q337 A339 I345	A313-K317 VanDerWaalsContact O-CB 3.29Å; A313-K317 WeakPolarHBondContact O-CB 3.22Å; A313-K317 PolarHBondContact O-N 3.34Å; N315-K317 PolarHBondContact O-N 3.11Å; K317-C319 PolarHBondContact O-N 3.27Å; K317-L320 PolarHBondContact O-N 3.43Å; K317-C321 PolarHBondContact O-N 3.43Å; K317-C321 PolarHBondContact O-SG 2.9Å; K317-C321 VanDerWaalsContact O-SG 3.34Å; K317-V336 WeakPolarHBondContact CD-O 3.45Å; K317-V336 HydrophobicContact CG-CG1 4.43Å; K317-Q337 WeakPolarHBondContact CE-O 3.5Å; K317-Q337 PolarHBondContact NZ-O 3.46Å; K317-A339 PolarHBondContact NZ-O 2.99Å; K317-I345 HydrophobicContact CB-CD1 4.11Å
318	Y	98.1	Very high	96.1	Very high	62 Å²	62	53 Å²	53	24%	0.243	25%	0.245	C	C	.	.	H	α-helix	trans	-57.4	-48	178.7	175.6	-96.4	0	0	0	111.8	R56 V57 F314 N315 T316 C321 Q322	R56-Y318 HydrophobicContact CB-CD1 3.59Å; R56-Y318 HydrophobicContact CB-CE1 3.53Å; R56-Y318 HydrophobicContact CB-CG 4.43Å; R56-Y318 HydrophobicContact CG-CD1 4.48Å; R56-Y318 HydrophobicContact CG-CE1 4.38Å; V57-Y318 HydrophobicContact CG2-CE1 3.81Å; F314-Y318 WeakPolarHBondContact O-CB 3.46Å; F314-Y318 PolarHBondContact O-N 3.4Å; N315-Y318 WeakPolarHBondContact O-CB 3.35Å; N315-Y318 PolarHBondContact O-N 2.94Å; N315-Y318 VanDerWaalsContact O-N 3.15Å; T316-Y318 PolarHBondContact O-N 2.9Å; Y318-C321 PolarHBondContact O-N 3.35Å; Y318-Q322 HydrophobicContact CD1-CG 4.44Å; Y318-Q322 HydrophobicContact CE1-CG 4.02Å; Y318-Q322 WeakPolarHBondContact O-CG 3.35Å; Y318-Q322 PolarHBondContact O-N 3.44Å; Y318-Q322 VanDerWaalsContact O-N 3.15Å
319	C	98.6	Very high	95.8	Very high	2 Å²	2	54.4 Å²	54.4	1%	0.014	26%	0.256	C	S	.	.	H	α-helix	trans	-65.7	-43	179.1	-66.9	0	0	0	0	112.4	Y302 N315 T316 K317 C321 Q322 M323	Y302-C319 HydrophobicContact CE1-CB 3.73Å; Y302-C319 HydrophobicContact CE2-CB 4.22Å; Y302-C319 VanDerWaalsContact CZ-CB 3.47Å; Y302-C319 WeakPolarHBondContact OH-CB 3.47Å; Y302-C319 PolarHBondContact OH-SG 2.91Å; N315-C319 PolarHBondContact O-N 3.47Å; N315-C319 VanDerWaalsContact O-N 3.07Å; T316-C319 PolarHBondContact O-N 2.99Å; K317-C319 PolarHBondContact O-N 3.27Å; C319-C321 VanDerWaalsContact C-N 3.32Å; C319-C321 PolarHBondContact O-N 2.98Å; C319-Q322 WeakPolarHBondContact O-CA 3.33Å; C319-Q322 WeakPolarHBondContact O-CB 3.42Å; C319-Q322 PolarHBondContact O-N 3.43Å; C319-M323 PolarHBondContact O-N 3.43Å
320	L	98.1	Very high	95.6	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-59.1	-42.4	175.3	-68.7	174.3	0	0	0	111.9	M299 Y302 I303 T316 K317 Q322 M323 L324 V336 I345 Y349	M299-L320 HydrophobicContact CB-CD2 3.79Å; M299-L320 HydrophobicContact CG-CD2 3.77Å; M299-L320 HydrophobicContact SD-CD2 4.25Å; Y302-L320 HydrophobicContact CD1-CD2 3.95Å; Y302-L320 HydrophobicContact CD1-CG 4.29Å; Y302-L320 HydrophobicContact CE1-CG 4.45Å; I303-L320 HydrophobicContact CD1-CD1 3.95Å; I303-L320 HydrophobicContact CD1-CD2 4.1Å; I303-L320 HydrophobicContact CG1-CD1 3.93Å; I303-L320 HydrophobicContact CG1-CD2 4.02Å; I303-L320 HydrophobicContact CG1-CG 4.5Å; T316-L320 HydrophobicContact CG2-CD1 4.19Å; T316-L320 WeakPolarHBondContact O-CG 3.48Å; T316-L320 PolarHBondContact O-N 3.29Å; K317-L320 PolarHBondContact O-N 3.43Å; L320-Q322 VanDerWaalsContact C-N 3.28Å; L320-Q322 PolarHBondContact O-N 3.07Å; L320-M323 PolarHBondContact O-N 3.12Å; L320-M323 VanDerWaalsContact O-N 3.12Å; L320-L324 WeakPolarHBondContact O-CB 3.39Å; L320-L324 WeakPolarHBondContact O-CG 3.49Å; L320-L324 PolarHBondContact O-N 3.15Å; L320-V336 HydrophobicContact CB-CG1 4.05Å; L320-V336 HydrophobicContact CD1-CG1 4.13Å; L320-I345 HydrophobicContact CD1-CG2 3.62Å; L320-Y349 HydrophobicContact CD1-CE2 4.21Å
321	C	97.1	Very high	95.5	Very high	25 Å²	25	55.1 Å²	55.1	17%	0.169	27%	0.271	C	S	.	.	H	α-helix	trans	-62.2	-33.7	173.9	-70.8	0	0	0	0	112.7	K317 Y318 C319 R325	K317-C321 PolarHBondContact O-N 3.43Å; K317-C321 PolarHBondContact O-SG 2.9Å; K317-C321 VanDerWaalsContact O-SG 3.34Å; Y318-C321 PolarHBondContact O-N 3.35Å; C319-C321 VanDerWaalsContact C-N 3.32Å; C319-C321 PolarHBondContact O-N 2.98Å; C321-R325 PolarHBondContact O-N 3.16Å
322	Q	97.3	Very high	95.2	Very high	53 Å²	53	56.4 Å²	56.4	25%	0.248	28%	0.278	C	S	.	.	H	α-helix	trans	-68.1	-35.3	173.8	-59	-45.1	-63.8	0	0	112.3	M281 Y318 C319 L320 R325	M281-Q322 HydrophobicContact CE-CB 4.34Å; M281-Q322 HydrophobicContact CE-CG 4.47Å; M281-Q322 HydrophobicContact CG-CB 3.77Å; M281-Q322 HydrophobicContact CG-CG 4.11Å; M281-Q322 HydrophobicContact SD-CB 4.15Å; M281-Q322 HydrophobicContact SD-CG 3.95Å; Y318-Q322 HydrophobicContact CD1-CG 4.44Å; Y318-Q322 HydrophobicContact CE1-CG 4.02Å; Y318-Q322 WeakPolarHBondContact O-CG 3.35Å; Y318-Q322 PolarHBondContact O-N 3.44Å; Y318-Q322 VanDerWaalsContact O-N 3.15Å; C319-Q322 WeakPolarHBondContact O-CA 3.33Å; C319-Q322 WeakPolarHBondContact O-CB 3.42Å; C319-Q322 PolarHBondContact O-N 3.43Å; L320-Q322 VanDerWaalsContact C-N 3.28Å; L320-Q322 PolarHBondContact O-N 3.07Å; Q322-R325 WeakPolarHBondContact O-CG 3.43Å
323	M	97.2	Very high	95	Very high	7 Å²	7	49.9 Å²	49.9	3%	0.034	25%	0.248	C	C	.	.	H	α-helix	trans	-72.2	-40.6	176.3	-64.6	178	-173.4	0	0	111.9	M62 P284 V295 M299 Y302 C319 L320 R325	M62-M323 HydrophobicContact CE-CE 3.38Å; P284-M323 HydrophobicContact CG-CE 4.39Å; V295-M323 HydrophobicContact CG2-CB 3.98Å; M299-M323 HydrophobicContact CG-CB 3.98Å; M299-M323 HydrophobicContact CG-CG 4.47Å; M299-M323 HydrophobicContact CG-SD 3.59Å; M299-M323 VanDerWaalsContact CG-SD 3.59Å; M299-M323 HydrophobicContact SD-CB 4.11Å; Y302-M323 HydrophobicContact CD1-CE 4.48Å; Y302-M323 HydrophobicContact CD2-CE 4Å; Y302-M323 HydrophobicContact CG-CE 3.95Å; C319-M323 PolarHBondContact O-N 3.43Å; L320-M323 PolarHBondContact O-N 3.12Å; L320-M323 VanDerWaalsContact O-N 3.12Å; M323-R325 VanDerWaalsContact C-N 3.33Å; M323-R325 PolarHBondContact O-N 3.04Å
324	L	95.4	Very high	94.9	Very high	5 Å²	5	54.5 Å²	54.5	3%	0.026	27%	0.265	C	S	.	.	H	α-helix	trans	-64.9	-33.5	178.4	-75.4	168.6	0	0	0	112.9	M299 L320 D326 K327 V328	M299-L324 HydrophobicContact CE-CD2 3.93Å; M299-L324 HydrophobicContact SD-CD2 3.86Å; M299-L324 HydrophobicContact SD-CG 3.85Å; L320-L324 WeakPolarHBondContact O-CB 3.39Å; L320-L324 WeakPolarHBondContact O-CG 3.49Å; L320-L324 PolarHBondContact O-N 3.15Å; L324-D326 PolarHBondContact O-N 3.39Å; L324-K327 HydrophobicContact CD2-CB 4.18Å; L324-K327 WeakPolarHBondContact O-CA 3.27Å; L324-K327 VanDerWaalsContact O-CB 3.28Å; L324-K327 WeakPolarHBondContact O-CB 3.16Å; L324-K327 PolarHBondContact O-N 3.4Å; L324-V328 HydrophobicContact CB-CG2 3.57Å
325	R	91.9	Very high	94.8	Very high	128 Å²	128	53.9 Å²	53.9	48%	0.483	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	50.6	-106.8	178.8	-60.1	-178.3	64.1	-166.2	-6.8	113.2	W282 C321 Q322 M323 V328	W282-R325 HydrophobicContact CG-CG 4.36Å; C321-R325 PolarHBondContact O-N 3.16Å; Q322-R325 WeakPolarHBondContact O-CG 3.43Å; M323-R325 VanDerWaalsContact C-N 3.33Å; M323-R325 PolarHBondContact O-N 3.04Å; R325-V328 WeakPolarHBondContact O-CB 3.43Å; R325-V328 WeakPolarHBondContact O-CG2 3.23Å
326	D	89.6	Confident	94.6	Very high	135 Å²	135	53 Å²	53	72%	0.722	26%	0.259	S	S	*	.	G	3₁₀ helix	trans	-76.9	-21.4	178.7	55.7	-51	0	0	0	112.7	L324 V328	L324-D326 PolarHBondContact O-N 3.39Å; D326-V328 PolarHBondContact O-N 2.96Å
327	K	90.4	Very high	94.4	Very high	92 Å²	92	56.8 Å²	56.8	40%	0.4	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-78.6	5.4	175	-57.3	-176.8	177.6	-179.5	0	113.7	E296 L324 E329 S330	E296-K327 IonicContact OE1-NZ 2.66Å; E296-K327 PolarHBondContact OE1-NZ 3.21Å; L324-K327 HydrophobicContact CD2-CB 4.18Å; L324-K327 WeakPolarHBondContact O-CA 3.27Å; L324-K327 VanDerWaalsContact O-CB 3.28Å; L324-K327 WeakPolarHBondContact O-CB 3.16Å; L324-K327 PolarHBondContact O-N 3.4Å; K327-E329 PolarHBondContact O-N 3.35Å; K327-S330 WeakPolarHBondContact O-CB 3.28Å; K327-S330 PolarHBondContact O-N 2.88Å; K327-S330 PolarHBondContact O-OG 3.36Å
328	V	89.8	Confident	94.2	Very high	22 Å²	22	57.8 Å²	57.8	13%	0.133	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-63.2	-27.4	-179.7	169.4	0	0	0	0	112.3	L324 R325 D326 S330 G333 K334 Q337	L324-V328 HydrophobicContact CB-CG2 3.57Å; R325-V328 WeakPolarHBondContact O-CB 3.43Å; R325-V328 WeakPolarHBondContact O-CG2 3.23Å; D326-V328 PolarHBondContact O-N 2.96Å; V328-S330 VanDerWaalsContact C-N 3.31Å; V328-G333 CarbonylContact O-C 3.37Å; V328-G333 VanDerWaalsContact O-CA 3.27Å; V328-G333 WeakPolarHBondContact O-CA 3.44Å; V328-K334 PolarHBondContact O-N 2.67Å; V328-Q337 HydrophobicContact CG1-CG 4.32Å
329	E	91.6	Very high	94.1	Very high	124 Å²	124	55.1 Å²	55.1	58%	0.579	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-84	-2.5	175.7	-66.5	-56.6	140.5	0	0	114.3	K327 K334	K327-E329 PolarHBondContact O-N 3.35Å; E329-K334 VanDerWaalsContact O-CE 3.27Å; E329-K334 WeakPolarHBondContact O-CE 3.43Å; E329-K334 WeakPolarHBondContact OE2-CE 3.4Å; E329-K334 IonicContact OE2-NZ 2.85Å
330	S	93.3	Very high	93.9	Very high	36 Å²	36	61.6 Å²	61.6	25%	0.252	32%	0.315	S	S	.	.	S	Bend	trans	-63.9	161.8	174.3	70.2	0	0	0	0	111.4	K327 V328 L332 G333 K334	K327-S330 WeakPolarHBondContact O-CB 3.28Å; K327-S330 PolarHBondContact O-N 2.88Å; K327-S330 PolarHBondContact O-OG 3.36Å; V328-S330 VanDerWaalsContact C-N 3.31Å; S330-L332 PolarHBondContact O-N 3.01Å; S330-G333 PolarHBondContact O-N 3.34Å; S330-G333 PolarHBondContact OG-N 3.44Å; S330-K334 PolarHBondContact O-N 3.04Å
331	P	94.2	Very high	93.8	Very high	108 Å²	108	64.3 Å²	64.3	70%	0.701	33%	0.332	S	S	*	.	H	α-helix	trans	-52	-44.3	174.9	-27.9	35.8	0	0	0	112.8	K334 Q335	P331-K334 PolarHBondContact O-N 3.39Å; P331-Q335 WeakPolarHBondContact O-CG 3.37Å; P331-Q335 PolarHBondContact O-N 3.37Å; P331-Q335 VanDerWaalsContact O-N 3.13Å
332	L	91.6	Very high	93.7	Very high	48 Å²	48	64 Å²	64	25%	0.251	33%	0.328	S	S	.	.	H	α-helix	trans	-63.7	-46.2	175.2	178.9	62.8	0	0	0	111.7	S330 K334 Q335 V336 A348 Y349	S330-L332 PolarHBondContact O-N 3.01Å; L332-K334 VanDerWaalsContact C-N 3.31Å; L332-K334 PolarHBondContact O-N 3.15Å; L332-Q335 WeakPolarHBondContact O-CB 3.5Å; L332-Q335 PolarHBondContact O-N 3.41Å; L332-Q335 VanDerWaalsContact O-N 3.16Å; L332-V336 HydrophobicContact CD1-CG2 4.41Å; L332-V336 WeakPolarHBondContact O-CG2 3.26Å; L332-V336 PolarHBondContact O-N 2.92Å; L332-A348 HydrophobicContact CD1-CB 4.09Å; L332-A348 WeakPolarHBondContact CD1-O 3.45Å; L332-Y349 HydrophobicContact CD1-CD2 4.33Å; L332-Y349 HydrophobicContact CD1-CE2 4.14Å; L332-Y349 HydrophobicContact CD2-CE1 3.96Å
333	G	93.5	Very high	93.6	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-59.8	-40.3	179.4	0	0	0	0	0	112.9	V328 S330 V336 Q337	V328-G333 CarbonylContact O-C 3.37Å; V328-G333 VanDerWaalsContact O-CA 3.27Å; V328-G333 WeakPolarHBondContact O-CA 3.44Å; S330-G333 PolarHBondContact O-N 3.34Å; S330-G333 PolarHBondContact OG-N 3.44Å; G333-V336 PolarHBondContact O-N 3.48Å; G333-Q337 WeakPolarHBondContact O-CG 3.34Å; G333-Q337 PolarHBondContact O-N 2.95Å
334	K	94.3	Very high	93.6	Very high	110 Å²	110	66.6 Å²	66.6	48%	0.478	35%	0.346	S	S	.	.	H	α-helix	trans	-65.5	-39.4	174.7	-71.4	178.4	177.9	173.5	0	112.6	V328 E329 S330 P331 L332 Q337 A338	V328-K334 PolarHBondContact O-N 2.67Å; E329-K334 VanDerWaalsContact O-CE 3.27Å; E329-K334 WeakPolarHBondContact O-CE 3.43Å; E329-K334 WeakPolarHBondContact OE2-CE 3.4Å; E329-K334 IonicContact OE2-NZ 2.85Å; S330-K334 PolarHBondContact O-N 3.04Å; P331-K334 PolarHBondContact O-N 3.39Å; L332-K334 VanDerWaalsContact C-N 3.31Å; L332-K334 PolarHBondContact O-N 3.15Å; K334-Q337 PolarHBondContact O-N 3.03Å; K334-A338 WeakPolarHBondContact O-CB 3.28Å; K334-A338 PolarHBondContact O-N 3.15Å
335	Q	94.7	Very high	93.7	Very high	108 Å²	108	66.4 Å²	66.4	51%	0.505	35%	0.345	S	S	.	.	H	α-helix	trans	-61.8	-46.9	173.5	-72.5	173.3	-15.8	0	0	111.3	P331 L332 Q337 A338 A339 A348	P331-Q335 WeakPolarHBondContact O-CG 3.37Å; P331-Q335 PolarHBondContact O-N 3.37Å; P331-Q335 VanDerWaalsContact O-N 3.13Å; L332-Q335 WeakPolarHBondContact O-CB 3.5Å; L332-Q335 PolarHBondContact O-N 3.41Å; L332-Q335 VanDerWaalsContact O-N 3.16Å; Q335-Q337 VanDerWaalsContact C-N 3.31Å; Q335-Q337 PolarHBondContact O-N 2.93Å; Q335-A338 PolarHBondContact O-N 2.96Å; Q335-A338 VanDerWaalsContact O-N 3.15Å; Q335-A339 PolarHBondContact O-N 3.05Å; Q335-A348 HydrophobicContact CB-CB 4.04Å
336	V	94.2	Very high	93.9	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-61.8	-39.2	176.8	175	0	0	0	0	111.8	K317 L320 L332 G333 A339 A348 Y349	K317-V336 WeakPolarHBondContact CD-O 3.45Å; K317-V336 HydrophobicContact CG-CG1 4.43Å; L320-V336 HydrophobicContact CB-CG1 4.05Å; L320-V336 HydrophobicContact CD1-CG1 4.13Å; L332-V336 HydrophobicContact CD1-CG2 4.41Å; L332-V336 WeakPolarHBondContact O-CG2 3.26Å; L332-V336 PolarHBondContact O-N 2.92Å; G333-V336 PolarHBondContact O-N 3.48Å; V336-A339 PolarHBondContact O-N 3.36Å; V336-A348 HydrophobicContact CG2-CB 4.43Å; V336-Y349 HydrophobicContact CG2-CD2 4.43Å; V336-Y349 HydrophobicContact CG2-CE2 3.48Å; V336-Y349 VanDerWaalsContact CG2-CE2 3.48Å
337	Q	93.8	Very high	94.2	Very high	81 Å²	81	59.7 Å²	59.7	38%	0.379	32%	0.315	S	S	.	.	H	α-helix	trans	-66.1	-37.4	174.9	-76.4	-171.9	-2.5	0	0	112.9	K317 V328 G333 K334 Q335 A339	K317-Q337 WeakPolarHBondContact CE-O 3.5Å; K317-Q337 PolarHBondContact NZ-O 3.46Å; V328-Q337 HydrophobicContact CG1-CG 4.32Å; G333-Q337 WeakPolarHBondContact O-CG 3.34Å; G333-Q337 PolarHBondContact O-N 2.95Å; K334-Q337 PolarHBondContact O-N 3.03Å; Q335-Q337 VanDerWaalsContact C-N 3.31Å; Q335-Q337 PolarHBondContact O-N 2.93Å; Q337-A339 VanDerWaalsContact C-N 3.33Å
338	A	94.8	Very high	94.4	Very high	68 Å²	68	56.4 Å²	56.4	56%	0.562	31%	0.305	S	S	*	.	H	α-helix	trans	-71	-30.7	179.4	0	0	0	0	0	112.4	K334 Q335 Q340	K334-A338 WeakPolarHBondContact O-CB 3.28Å; K334-A338 PolarHBondContact O-N 3.15Å; Q335-A338 PolarHBondContact O-N 2.96Å; Q335-A338 VanDerWaalsContact O-N 3.15Å; A338-Q340 PolarHBondContact O-NE2 3.04Å
339	A	95.5	Very high	94.7	Very high	6 Å²	6	57.1 Å²	57.1	5%	0.05	31%	0.306	C	S	.	.			trans	-59	136.1	-177.5	0	0	0	0	0	113.5	K317 Q335 V336 Q337 E344 I345	K317-A339 PolarHBondContact NZ-O 2.99Å; Q335-A339 PolarHBondContact O-N 3.05Å; V336-A339 PolarHBondContact O-N 3.36Å; Q337-A339 VanDerWaalsContact C-N 3.33Å; A339-E344 WeakPolarHBondContact CA-OE2 3.3Å; A339-E344 HydrophobicContact CB-CB 3.79Å; A339-I345 HydrophobicContact CB-CG1 3.66Å
340	Q	94.1	Very high	94.9	Very high	138 Å²	138	53.9 Å²	53.9	65%	0.645	31%	0.305	S	S	*	.			trans	-110.5	-22.1	177.4	-56.5	-54.8	-47.3	0	0	112.4	A313 A338 E344	A313-Q340 WeakPolarHBondContact CB-O 3.39Å; A338-Q340 PolarHBondContact O-NE2 3.04Å; Q340-E344 PolarHBondContact N-OE2 3.39Å
341	T	96.6	Very high	95.1	Very high	57 Å²	57	52.9 Å²	52.9	35%	0.35	30%	0.297	S	S	.	.	S	Bend	trans	-124.2	158.9	-177.5	69.1	0	0	0	0	112	A343 E344 I345	T341-A343 PolarHBondContact O-N 3.13Å; T341-E344 PolarHBondContact N-OE2 3.16Å; T341-E344 PolarHBondContact O-N 3.36Å; T341-E344 WeakPolarHBondContact OG1-CG 3.38Å; T341-E344 PolarHBondContact OG1-N 3.48Å; T341-I345 WeakPolarHBondContact O-CG1 3.4Å; T341-I345 PolarHBondContact O-N 3.27Å; T341-I345 VanDerWaalsContact O-N 3.1Å
342	N	93.6	Very high	95.2	Very high	18 Å²	18	51 Å²	51	10%	0.096	28%	0.279	C	S	.	.	H	α-helix	trans	-64.9	-25.8	172.3	-77.1	-28.3	0	0	0	112	N311 A313 T316 S346 Y355	N311-N342 PolarHBondContact O-ND2 2.92Å; A313-N342 WeakPolarHBondContact CA-OD1 3.25Å; T316-N342 PolarHBondContact OG1-OD1 2.86Å; N342-S346 WeakPolarHBondContact O-CB 3.33Å; N342-S346 PolarHBondContact O-N 2.63Å; N342-S346 PolarHBondContact O-OG 2.7Å; N342-Y355 HydrophobicContact CB-CE2 3.93Å
343	A	96	Very high	95.5	Very high	34 Å²	34	53 Å²	53	28%	0.281	29%	0.293	S	S	.	.	H	α-helix	trans	-63.5	-48.4	174	0	0	0	0	0	111.3	T341 S346 E347 Y355	T341-A343 PolarHBondContact O-N 3.13Å; A343-S346 WeakPolarHBondContact O-CB 3.39Å; A343-S346 PolarHBondContact O-N 3.49Å; A343-S346 VanDerWaalsContact O-N 3.17Å; A343-E347 PolarHBondContact O-N 3.02Å; A343-Y355 HydrophobicContact CB-CD1 4.14Å; A343-Y355 HydrophobicContact CB-CE1 3.59Å; A343-Y355 HydrophobicContact CB-CE2 4.34Å
344	E	96.8	Very high	95.7	Very high	80 Å²	80	54.8 Å²	54.8	37%	0.374	30%	0.301	S	S	.	.	H	α-helix	trans	-65.5	-38.1	177.1	-70.6	163	-162.1	0	0	112.1	A339 Q340 T341 S346 E347 A348	A339-E344 WeakPolarHBondContact CA-OE2 3.3Å; A339-E344 HydrophobicContact CB-CB 3.79Å; Q340-E344 PolarHBondContact N-OE2 3.39Å; T341-E344 PolarHBondContact N-OE2 3.16Å; T341-E344 PolarHBondContact O-N 3.36Å; T341-E344 WeakPolarHBondContact OG1-CG 3.38Å; T341-E344 PolarHBondContact OG1-N 3.48Å; E344-S346 VanDerWaalsContact C-N 3.33Å; E344-E347 PolarHBondContact O-N 3.01Å; E344-A348 PolarHBondContact O-N 3.44Å; E344-A348 VanDerWaalsContact O-N 3.14Å
345	I	97.2	Very high	95.9	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.005	29%	0.288	C	S	.	.	H	α-helix	trans	-61.9	-44.2	172	-65.4	170.1	0	0	0	110.1	I303 A313 T316 K317 L320 A339 T341 E347 A348 Y349	I303-I345 HydrophobicContact CD1-CG2 4.07Å; I303-I345 HydrophobicContact CG1-CG2 4.18Å; A313-I345 HydrophobicContact CB-CD1 4.5Å; T316-I345 HydrophobicContact CG2-CD1 4.06Å; T316-I345 HydrophobicContact CG2-CG2 4.43Å; K317-I345 HydrophobicContact CB-CD1 4.11Å; L320-I345 HydrophobicContact CD1-CG2 3.62Å; A339-I345 HydrophobicContact CB-CG1 3.66Å; T341-I345 WeakPolarHBondContact O-CG1 3.4Å; T341-I345 PolarHBondContact O-N 3.27Å; T341-I345 VanDerWaalsContact O-N 3.1Å; I345-E347 VanDerWaalsContact C-N 3.27Å; I345-E347 PolarHBondContact O-N 2.59Å; I345-A348 PolarHBondContact O-N 3.22Å; I345-Y349 WeakPolarHBondContact O-CD2 3.15Å; I345-Y349 PolarHBondContact O-N 3.36Å
346	S	96.6	Very high	96	Very high	1 Å²	1	52.3 Å²	52.3	1%	0.007	29%	0.289	C	S	.	.	H	α-helix	trans	-62.7	-38.1	178.7	-55.6	0	0	0	0	111.2	I307 N342 A343 E344 Y349 G350 L351	I307-S346 VanDerWaalsContact CD1-OG 3.25Å; I307-S346 WeakPolarHBondContact CD1-OG 3.38Å; N342-S346 WeakPolarHBondContact O-CB 3.33Å; N342-S346 PolarHBondContact O-N 2.63Å; N342-S346 PolarHBondContact O-OG 2.7Å; A343-S346 WeakPolarHBondContact O-CB 3.39Å; A343-S346 PolarHBondContact O-N 3.49Å; A343-S346 VanDerWaalsContact O-N 3.17Å; E344-S346 VanDerWaalsContact C-N 3.33Å; S346-Y349 CarbonylContact O-C 3.5Å; S346-Y349 PolarHBondContact O-N 2.72Å; S346-G350 PolarHBondContact O-N 3.11Å; S346-G350 VanDerWaalsContact O-N 3.13Å; S346-L351 PolarHBondContact O-N 3.05Å
347	E	95.6	Very high	96.2	Very high	121 Å²	121	57.6 Å²	57.6	57%	0.565	31%	0.314	S	S	*	.	H	α-helix	trans	-61.5	-44.5	175.9	170.8	167.8	-145.7	0	0	113	A343 E344 I345 Y349 G350 Q352	A343-E347 PolarHBondContact O-N 3.02Å; E344-E347 PolarHBondContact O-N 3.01Å; I345-E347 VanDerWaalsContact C-N 3.27Å; I345-E347 PolarHBondContact O-N 2.59Å; E347-Y349 PolarHBondContact O-N 2.89Å; E347-Y349 VanDerWaalsContact O-N 3.11Å; E347-G350 PolarHBondContact O-N 3.24Å; E347-G350 VanDerWaalsContact O-N 3.11Å; E347-Q352 HydrophobicContact CB-CG 3.93Å; E347-Q352 HydrophobicContact CG-CG 4.43Å; E347-Q352 PolarHBondContact O-NE2 3.04Å
348	A	94.9	Very high	96.3	Very high	23 Å²	23	55.1 Å²	55.1	19%	0.19	30%	0.303	C	S	.	.	H	α-helix	trans	-58.8	-25.8	177.7	0	0	0	0	0	113.3	L332 Q335 V336 E344 I345	L332-A348 HydrophobicContact CD1-CB 4.09Å; L332-A348 WeakPolarHBondContact CD1-O 3.45Å; Q335-A348 HydrophobicContact CB-CB 4.04Å; V336-A348 HydrophobicContact CG2-CB 4.43Å; E344-A348 PolarHBondContact O-N 3.44Å; E344-A348 VanDerWaalsContact O-N 3.14Å; I345-A348 PolarHBondContact O-N 3.22Å
349	Y	95.5	Very high	96.3	Very high	38 Å²	38	54.1 Å²	54.1	15%	0.149	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.3	6.7	-179.9	-74.5	-96.7	0	0	0	114.1	M299 I303 L320 L332 V336 I345 S346 E347 L351	M299-Y349 HydrophobicContact CB-CE1 3.86Å; M299-Y349 HydrophobicContact CE-CE1 4.12Å; M299-Y349 HydrophobicContact SD-CE1 4.34Å; M299-Y349 PolarHBondContact SD-OH 2.85Å; I303-Y349 HydrophobicContact CD1-CD1 3.91Å; I303-Y349 HydrophobicContact CD1-CD2 3.34Å; I303-Y349 HydrophobicContact CD1-CE1 4.13Å; I303-Y349 HydrophobicContact CD1-CE2 3.57Å; I303-Y349 HydrophobicContact CD1-CG 3.51Å; L320-Y349 HydrophobicContact CD1-CE2 4.21Å; L332-Y349 HydrophobicContact CD1-CD2 4.33Å; L332-Y349 HydrophobicContact CD1-CE2 4.14Å; L332-Y349 HydrophobicContact CD2-CE1 3.96Å; V336-Y349 HydrophobicContact CG2-CD2 4.43Å; V336-Y349 HydrophobicContact CG2-CE2 3.48Å; V336-Y349 VanDerWaalsContact CG2-CE2 3.48Å; I345-Y349 WeakPolarHBondContact O-CD2 3.15Å; I345-Y349 PolarHBondContact O-N 3.36Å; S346-Y349 CarbonylContact O-C 3.5Å; S346-Y349 PolarHBondContact O-N 2.72Å; E347-Y349 PolarHBondContact O-N 2.89Å; E347-Y349 VanDerWaalsContact O-N 3.11Å; Y349-L351 VanDerWaalsContact C-N 3.3Å; Y349-L351 PolarHBondContact O-N 3.4Å
350	G	96.2	Very high	96.3	Very high	55 Å²	55	59.9 Å²	59.9	57%	0.567	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.1	24.5	-178.8	0	0	0	0	0	114.3	S346 E347	S346-G350 PolarHBondContact O-N 3.11Å; S346-G350 VanDerWaalsContact O-N 3.13Å; E347-G350 PolarHBondContact O-N 3.24Å; E347-G350 VanDerWaalsContact O-N 3.11Å
351	L	97.3	Very high	96.4	Very high	16 Å²	16	56.9 Å²	56.9	8%	0.084	30%	0.301	C	S	.	.			trans	-103.2	21.2	-177.4	-64.6	176.4	0	0	0	113.2	E300 I303 S346 Y349 T353 F354 Y355	E300-L351 HydrophobicContact CG-CD1 3.89Å; E300-L351 HydrophobicContact CG-CD2 3.92Å; E300-L351 HydrophobicContact CG-CG 4.29Å; I303-L351 HydrophobicContact CB-CD1 3.97Å; I303-L351 HydrophobicContact CD1-CD1 4.49Å; I303-L351 HydrophobicContact CG2-CD1 3.63Å; S346-L351 PolarHBondContact O-N 3.05Å; Y349-L351 VanDerWaalsContact C-N 3.3Å; Y349-L351 PolarHBondContact O-N 3.4Å; L351-T353 PolarHBondContact O-N 2.84Å; L351-F354 PolarHBondContact O-N 3.23Å; L351-Y355 WeakPolarHBondContact O-CB 3.41Å; L351-Y355 PolarHBondContact O-N 3.35Å
352	Q	96.8	Very high	96.2	Very high	69 Å²	69	55 Å²	55	32%	0.322	29%	0.288	S	S	.	.	H	α-helix	trans	-60.1	-46.1	-176.3	-59.9	88.3	-27.6	0	0	112.1	E347 Y355 Q356	E347-Q352 HydrophobicContact CB-CG 3.93Å; E347-Q352 HydrophobicContact CG-CG 4.43Å; E347-Q352 PolarHBondContact O-NE2 3.04Å; Q352-Y355 WeakPolarHBondContact O-CB 3.16Å; Q352-Y355 PolarHBondContact O-N 3.45Å; Q352-Q356 WeakPolarHBondContact O-CG 3.34Å; Q352-Q356 PolarHBondContact O-N 2.98Å
353	T	97.8	Very high	96	Very high	90 Å²	90	60 Å²	60	55%	0.552	31%	0.311	S	S	*	.	H	α-helix	trans	-61	-48	179.6	-49.9	0	0	0	0	110.6	L351 Y355 Q356 E357	L351-T353 PolarHBondContact O-N 2.84Å; T353-Y355 VanDerWaalsContact C-N 3.33Å; T353-Y355 PolarHBondContact O-N 3.07Å; T353-Q356 PolarHBondContact O-N 2.93Å; T353-E357 WeakPolarHBondContact O-CG 3.25Å; T353-E357 PolarHBondContact O-N 2.58Å
354	F	97.9	Very high	95.8	Very high	37 Å²	37	61.1 Å²	61.1	16%	0.162	32%	0.32	C	S	.	.	H	α-helix	trans	-59.3	-43.7	176.5	179	-94.1	0	0	0	111.9	K304 I307 R308 L351 Q356 E357 I358	K304-F354 HydrophobicContact CB-CE1 3.88Å; K304-F354 HydrophobicContact CB-CZ 3.92Å; K304-F354 HydrophobicContact CG-CD1 4.16Å; K304-F354 HydrophobicContact CG-CE1 3.77Å; K304-F354 HydrophobicContact CG-CE2 4.45Å; K304-F354 HydrophobicContact CG-CZ 3.92Å; I307-F354 HydrophobicContact CB-CE1 4.21Å; I307-F354 HydrophobicContact CD1-CD1 3.86Å; I307-F354 HydrophobicContact CD1-CE1 4.07Å; I307-F354 HydrophobicContact CG2-CE1 4.24Å; R308-F354 HydrophobicContact CG-CZ 4.18Å; L351-F354 PolarHBondContact O-N 3.23Å; F354-Q356 PolarHBondContact O-N 3.39Å; F354-E357 PolarHBondContact O-N 2.81Å; F354-I358 HydrophobicContact CD1-CG1 4.29Å; F354-I358 HydrophobicContact CD2-CG1 4.47Å; F354-I358 HydrophobicContact CE1-CG1 3.84Å; F354-I358 HydrophobicContact CE2-CD1 4.21Å; F354-I358 HydrophobicContact CE2-CG1 4.05Å; F354-I358 HydrophobicContact CZ-CD1 4.07Å; F354-I358 HydrophobicContact CZ-CG1 3.72Å; F354-I358 VanDerWaalsContact O-CG1 3.31Å; F354-I358 WeakPolarHBondContact O-CG1 3.42Å; F354-I358 PolarHBondContact O-N 3.05Å; F354-I358 VanDerWaalsContact O-N 3.08Å
355	Y	97.3	Very high	95.5	Very high	54 Å²	54	60 Å²	60	21%	0.212	31%	0.314	C	S	.	.	H	α-helix	trans	-58.5	-49.2	175.8	177.3	-93.7	0	0	0	111.6	I307 N342 A343 L351 Q352 T353 I358 Q359	I307-Y355 HydrophobicContact CD1-CD2 4.13Å; I307-Y355 HydrophobicContact CG1-CD2 4.02Å; I307-Y355 HydrophobicContact CG2-CD2 3.88Å; N342-Y355 HydrophobicContact CB-CE2 3.93Å; A343-Y355 HydrophobicContact CB-CD1 4.14Å; A343-Y355 HydrophobicContact CB-CE1 3.59Å; A343-Y355 HydrophobicContact CB-CE2 4.34Å; L351-Y355 WeakPolarHBondContact O-CB 3.41Å; L351-Y355 PolarHBondContact O-N 3.35Å; Q352-Y355 WeakPolarHBondContact O-CB 3.16Å; Q352-Y355 PolarHBondContact O-N 3.45Å; T353-Y355 VanDerWaalsContact C-N 3.33Å; T353-Y355 PolarHBondContact O-N 3.07Å; Y355-I358 PolarHBondContact O-N 2.88Å; Y355-Q359 HydrophobicContact CD1-CG 4.05Å; Y355-Q359 HydrophobicContact CD2-CG 4.39Å; Y355-Q359 HydrophobicContact CE1-CG 3.62Å; Y355-Q359 HydrophobicContact CE2-CG 4Å; Y355-Q359 HydrophobicContact CG-CG 4.41Å; Y355-Q359 VanDerWaalsContact O-CG 3.27Å; Y355-Q359 WeakPolarHBondContact O-CG 3.43Å; Y355-Q359 PolarHBondContact O-N 2.86Å
356	Q	97.2	Very high	94.9	Very high	112 Å²	112	64 Å²	64	52%	0.523	33%	0.334	S	S	.	.	H	α-helix	trans	-63	-44.1	-178.7	-71	172	-0	0	0	112.3	Q352 T353 F354 Q359 Q360	Q352-Q356 WeakPolarHBondContact O-CG 3.34Å; Q352-Q356 PolarHBondContact O-N 2.98Å; T353-Q356 PolarHBondContact O-N 2.93Å; F354-Q356 PolarHBondContact O-N 3.39Å; Q356-Q359 PolarHBondContact O-N 3.02Å; Q356-Q360 VanDerWaalsContact O-CG 3.3Å; Q356-Q360 WeakPolarHBondContact O-CG 3.32Å; Q356-Q360 PolarHBondContact O-N 3.17Å
357	E	98.1	Very high	94.3	Very high	111 Å²	111	66.4 Å²	66.4	52%	0.519	35%	0.354	S	S	.	.	H	α-helix	trans	-58.6	-48.5	176.7	-73.7	171.6	179.3	0	0	111.5	T353 F354 Q360 D361	T353-E357 WeakPolarHBondContact O-CG 3.25Å; T353-E357 PolarHBondContact O-N 2.58Å; F354-E357 PolarHBondContact O-N 2.81Å; E357-Q360 PolarHBondContact O-N 2.97Å; E357-D361 PolarHBondContact O-N 3Å
358	I	97.4	Very high	93.7	Very high	29 Å²	29	63.3 Å²	63.3	15%	0.149	35%	0.349	C	S	.	.	H	α-helix	trans	-64.9	-42.6	178.4	-63	-60.7	0	0	0	111.1	I307 R308 F354 Y355 Q360 D361 L362	I307-I358 HydrophobicContact CG2-CB 3.92Å; I307-I358 HydrophobicContact CG2-CG1 4.32Å; I307-I358 HydrophobicContact CG2-CG2 3.86Å; R308-I358 HydrophobicContact CG-CD1 4.19Å; R308-I358 HydrophobicContact CG-CG1 4.48Å; F354-I358 HydrophobicContact CD1-CG1 4.29Å; F354-I358 HydrophobicContact CD2-CG1 4.47Å; F354-I358 HydrophobicContact CE1-CG1 3.84Å; F354-I358 HydrophobicContact CE2-CD1 4.21Å; F354-I358 HydrophobicContact CE2-CG1 4.05Å; F354-I358 HydrophobicContact CZ-CD1 4.07Å; F354-I358 HydrophobicContact CZ-CG1 3.72Å; F354-I358 VanDerWaalsContact O-CG1 3.31Å; F354-I358 WeakPolarHBondContact O-CG1 3.42Å; F354-I358 PolarHBondContact O-N 3.05Å; F354-I358 VanDerWaalsContact O-N 3.08Å; Y355-I358 PolarHBondContact O-N 2.88Å; I358-Q360 VanDerWaalsContact C-N 3.29Å; I358-Q360 PolarHBondContact O-N 3.4Å; I358-D361 PolarHBondContact O-N 2.96Å; I358-L362 HydrophobicContact CG2-CD1 4.1Å; I358-L362 HydrophobicContact CG2-CG 4.18Å; I358-L362 VanDerWaalsContact O-CG 3.29Å; I358-L362 WeakPolarHBondContact O-CG 3.37Å; I358-L362 PolarHBondContact O-N 3.23Å
359	Q	94.2	Very high	92.9	Very high	47 Å²	47	65 Å²	65	22%	0.22	36%	0.355	C	S	.	.	H	α-helix	trans	-62.2	-37.3	177.6	-69.3	-55.1	-64.8	0	0	112.5	Y355 Q356 Q363	Y355-Q359 HydrophobicContact CD1-CG 4.05Å; Y355-Q359 HydrophobicContact CD2-CG 4.39Å; Y355-Q359 HydrophobicContact CE1-CG 3.62Å; Y355-Q359 HydrophobicContact CE2-CG 4Å; Y355-Q359 HydrophobicContact CG-CG 4.41Å; Y355-Q359 VanDerWaalsContact O-CG 3.27Å; Y355-Q359 WeakPolarHBondContact O-CG 3.43Å; Y355-Q359 PolarHBondContact O-N 2.86Å; Q356-Q359 PolarHBondContact O-N 3.02Å; Q359-Q363 WeakPolarHBondContact O-CB 3.34Å; Q359-Q363 VanDerWaalsContact O-CG 3.23Å; Q359-Q363 WeakPolarHBondContact O-CG 3.44Å; Q359-Q363 PolarHBondContact O-N 3.22Å
360	Q	95.8	Very high	91.6	Very high	126 Å²	126	69.9 Å²	69.9	59%	0.589	38%	0.379	S	S	*	.	H	α-helix	trans	-65.5	-43.9	174.9	-73.1	172.9	11.5	0	0	111.7	Q356 E357 I358 Q363 A364	Q356-Q360 VanDerWaalsContact O-CG 3.3Å; Q356-Q360 WeakPolarHBondContact O-CG 3.32Å; Q356-Q360 PolarHBondContact O-N 3.17Å; E357-Q360 PolarHBondContact O-N 2.97Å; I358-Q360 VanDerWaalsContact C-N 3.29Å; I358-Q360 PolarHBondContact O-N 3.4Å; Q360-Q363 PolarHBondContact O-N 2.71Å; Q360-A364 WeakPolarHBondContact O-CB 3.4Å; Q360-A364 PolarHBondContact O-N 2.87Å
361	D	96.3	Very high	89.8	Confident	75 Å²	75	71.7 Å²	71.7	40%	0.401	38%	0.383	S	S	.	.	H	α-helix	trans	-60.4	-47.5	176	-177.6	55.3	0	0	0	111.6	E357 I358 Q363 A364 K365	E357-D361 PolarHBondContact O-N 3Å; I358-D361 PolarHBondContact O-N 2.96Å; D361-Q363 VanDerWaalsContact C-N 3.34Å; D361-Q363 PolarHBondContact O-N 3.46Å; D361-A364 PolarHBondContact O-N 2.98Å; D361-K365 WeakPolarHBondContact O-CG 3.46Å; D361-K365 PolarHBondContact O-N 2.84Å; D361-K365 WeakPolarHBondContact OD2-CE 3.49Å; D361-K365 IonicContact OD2-NZ 3.46Å
362	L	91.3	Very high	87.6	Confident	17 Å²	17	74.9 Å²	74.9	9%	0.089	41%	0.406	C	S	.	.	H	α-helix	trans	-61	-42.1	177.6	-64.9	-177	0	0	0	112	V94 L95 I358 K365 M366	V94-L362 HydrophobicContact CG1-CB 4.31Å; V94-L362 HydrophobicContact CG1-CD2 4.04Å; L95-L362 HydrophobicContact CD2-CD1 3.94Å; L95-L362 HydrophobicContact CD2-CD2 3.72Å; L95-L362 HydrophobicContact CD2-CG 4.47Å; I358-L362 HydrophobicContact CG2-CD1 4.1Å; I358-L362 HydrophobicContact CG2-CG 4.18Å; I358-L362 VanDerWaalsContact O-CG 3.29Å; I358-L362 WeakPolarHBondContact O-CG 3.37Å; I358-L362 PolarHBondContact O-N 3.23Å; L362-K365 PolarHBondContact O-N 3.2Å; L362-M366 WeakPolarHBondContact O-CB 3.47Å; L362-M366 VanDerWaalsContact O-CG 3.27Å; L362-M366 WeakPolarHBondContact O-CG 3.4Å; L362-M366 PolarHBondContact O-N 2.88Å
363	Q	89.7	Confident	85.3	Confident	124 Å²	124	77.1 Å²	77.1	58%	0.579	42%	0.421	S	S	*	.	H	α-helix	trans	-64.5	-40.8	175.5	-74.7	173.6	9.6	0	0	112.2	Q359 Q360 D361 M366 A367	Q359-Q363 WeakPolarHBondContact O-CB 3.34Å; Q359-Q363 VanDerWaalsContact O-CG 3.23Å; Q359-Q363 WeakPolarHBondContact O-CG 3.44Å; Q359-Q363 PolarHBondContact O-N 3.22Å; Q360-Q363 PolarHBondContact O-N 2.71Å; D361-Q363 VanDerWaalsContact C-N 3.34Å; D361-Q363 PolarHBondContact O-N 3.46Å; Q363-M366 PolarHBondContact O-N 2.79Å; Q363-A367 WeakPolarHBondContact O-CB 3.34Å; Q363-A367 PolarHBondContact O-N 3.05Å
364	A	92.8	Very high	82.6	Confident	57 Å²	57	78.9 Å²	78.9	47%	0.471	42%	0.423	S	S	.	.	H	α-helix	trans	-64	-44.2	176.4	0	0	0	0	0	111.5	Q360 D361 M366 A367 A368	Q360-A364 WeakPolarHBondContact O-CB 3.4Å; Q360-A364 PolarHBondContact O-N 2.87Å; D361-A364 PolarHBondContact O-N 2.98Å; A364-M366 PolarHBondContact O-N 2.95Å; A364-A367 PolarHBondContact O-N 3.43Å; A364-A368 WeakPolarHBondContact O-CB 3.4Å; A364-A368 PolarHBondContact O-N 3.25Å
365	K	90.6	Very high	80.2	Confident	57 Å²	57	82.2 Å²	82.2	25%	0.248	45%	0.448	C	S	.	.	H	α-helix	trans	-59.7	-45.3	173.8	-71.7	-177.1	-176.5	-175.3	0	111.7	V94 E96 D361 L362 A367 A368 L369	V94-K365 HydrophobicContact CG1-CB 4.45Å; V94-K365 WeakPolarHBondContact O-CD 3.32Å; E96-K365 IonicContact OE1-NZ 3.61Å; E96-K365 PolarHBondContact OE1-NZ 3.36Å; D361-K365 WeakPolarHBondContact O-CG 3.46Å; D361-K365 PolarHBondContact O-N 2.84Å; D361-K365 WeakPolarHBondContact OD2-CE 3.49Å; D361-K365 IonicContact OD2-NZ 3.46Å; L362-K365 PolarHBondContact O-N 3.2Å; K365-A367 PolarHBondContact O-N 3.1Å; K365-A368 PolarHBondContact O-N 3.32Å; K365-L369 WeakPolarHBondContact O-CG 3.41Å; K365-L369 PolarHBondContact O-N 2.93Å
366	M	84.1	Confident	78.4	Confident	84 Å²	84	83.2 Å²	83.2	41%	0.414	46%	0.457	S	S	.	.	H	α-helix	trans	-58.9	-46.3	175.2	-74.2	176.9	72.8	0	0	112.1	V94 L362 Q363 A364 L369 Q370	V94-M366 HydrophobicContact CB-CG 4.26Å; V94-M366 HydrophobicContact CG1-CG 3.7Å; V94-M366 HydrophobicContact CG1-SD 4.43Å; V94-M366 HydrophobicContact CG2-CB 4.43Å; V94-M366 HydrophobicContact CG2-CG 3.49Å; V94-M366 VanDerWaalsContact CG2-CG 3.49Å; L362-M366 WeakPolarHBondContact O-CB 3.47Å; L362-M366 VanDerWaalsContact O-CG 3.27Å; L362-M366 WeakPolarHBondContact O-CG 3.4Å; L362-M366 PolarHBondContact O-N 2.88Å; Q363-M366 PolarHBondContact O-N 2.79Å; A364-M366 PolarHBondContact O-N 2.95Å; M366-L369 PolarHBondContact O-N 3.1Å; M366-Q370 WeakPolarHBondContact O-CB 3.3Å; M366-Q370 VanDerWaalsContact O-CG 3.29Å; M366-Q370 WeakPolarHBondContact O-CG 3.45Å; M366-Q370 PolarHBondContact O-N 3.48Å
367	A	82.8	Confident	76.8	Confident	53 Å²	53	85.1 Å²	85.1	44%	0.438	46%	0.464	S	S	.	.	H	α-helix	trans	-65.3	-40.1	178.6	0	0	0	0	0	112.2	Q363 A364 K365 Q370 S371	Q363-A367 WeakPolarHBondContact O-CB 3.34Å; Q363-A367 PolarHBondContact O-N 3.05Å; A364-A367 PolarHBondContact O-N 3.43Å; K365-A367 PolarHBondContact O-N 3.1Å; A367-Q370 PolarHBondContact O-N 3.2Å; A367-S371 WeakPolarHBondContact O-CB 3.09Å; A367-S371 PolarHBondContact O-N 3.06Å; A367-S371 PolarHBondContact O-OG 3.49Å
368	A	84.7	Confident	75.7	Confident	55 Å²	55	83 Å²	83	46%	0.455	46%	0.459	S	S	.	.	H	α-helix	trans	-61.9	-44.7	175.2	0	0	0	0	0	111.9	A364 K365 Q370 S371 S372	A364-A368 WeakPolarHBondContact O-CB 3.4Å; A364-A368 PolarHBondContact O-N 3.25Å; K365-A368 PolarHBondContact O-N 3.32Å; A368-Q370 PolarHBondContact O-N 3.47Å; A368-S371 WeakPolarHBondContact CA-OG 3.09Å; A368-S371 PolarHBondContact O-N 3.4Å; A368-S371 PolarHBondContact O-OG 2.83Å; A368-S372 WeakPolarHBondContact O-CB 3.48Å; A368-S372 PolarHBondContact O-N 2.85Å; A368-S372 PolarHBondContact O-OG 3.32Å
369	L	77.9	Confident	74.8	Confident	60 Å²	60	85.9 Å²	85.9	31%	0.314	48%	0.478	S	S	.	.	H	α-helix	trans	-65.1	-40.2	176.5	-71.1	166.3	0	0	0	112.1	D93 V94 K365 M366 S371 S372 N373	D93-L369 HydrophobicContact CB-CD1 3.73Å; D93-L369 HydrophobicContact CB-CD2 4.13Å; V94-L369 HydrophobicContact CG2-CD1 3.61Å; K365-L369 WeakPolarHBondContact O-CG 3.41Å; K365-L369 PolarHBondContact O-N 2.93Å; M366-L369 PolarHBondContact O-N 3.1Å; L369-S371 VanDerWaalsContact C-N 3.32Å; L369-S371 PolarHBondContact O-N 3.45Å; L369-S372 PolarHBondContact O-N 3.01Å; L369-S372 PolarHBondContact O-OG 3.25Å; L369-N373 PolarHBondContact O-N 2.92Å; L369-N373 VanDerWaalsContact O-N 3.08Å
370	Q	68.3	Low	74.2	Confident	140 Å²	140	89.8 Å²	89.8	65%	0.654	50%	0.499	S	S	*	.	H	α-helix	trans	-66.1	-31.8	176.1	-74.4	177.6	0.9	0	0	113.4	M366 A367 A368 N373	M366-Q370 WeakPolarHBondContact O-CB 3.3Å; M366-Q370 VanDerWaalsContact O-CG 3.29Å; M366-Q370 WeakPolarHBondContact O-CG 3.45Å; M366-Q370 PolarHBondContact O-N 3.48Å; A367-Q370 PolarHBondContact O-N 3.2Å; A368-Q370 PolarHBondContact O-N 3.47Å; Q370-N373 VanDerWaalsContact O-O 3.06Å
371	S	57.5	Low	73	Confident	93 Å²	93	89.6 Å²	89.6	65%	0.65	50%	0.502	S	S	*	.	H	α-helix	trans	-82	-29.7	176.7	55.8	0	0	0	0	113.4	A367 A368 L369	A367-S371 WeakPolarHBondContact O-CB 3.09Å; A367-S371 PolarHBondContact O-N 3.06Å; A367-S371 PolarHBondContact O-OG 3.49Å; A368-S371 WeakPolarHBondContact CA-OG 3.09Å; A368-S371 PolarHBondContact O-N 3.4Å; A368-S371 PolarHBondContact O-OG 2.83Å; L369-S371 VanDerWaalsContact C-N 3.32Å; L369-S371 PolarHBondContact O-N 3.45Å
372	S	51.9	Low	72.2	Confident	82 Å²	82	88.9 Å²	88.9	57%	0.573	51%	0.513	S	S	*	.	H	α-helix	trans	-72.7	-30.8	174	73.7	0	0	0	0	112.9	A368 L369 Q374	A368-S372 WeakPolarHBondContact O-CB 3.48Å; A368-S372 PolarHBondContact O-N 2.85Å; A368-S372 PolarHBondContact O-OG 3.32Å; L369-S372 PolarHBondContact O-N 3.01Å; L369-S372 PolarHBondContact O-OG 3.25Å; S372-Q374 PolarHBondContact O-N 3.17Å
373	N	47	Very low	71.9	Confident	117 Å²	117	95.1 Å²	95.1	63%	0.626	55%	0.546	S	S	*	.	S	Bend	trans	-72.2	93.8	162.7	-81.2	-32.2	0	0	0	107.9	L369 Q370	L369-N373 PolarHBondContact O-N 2.92Å; L369-N373 VanDerWaalsContact O-N 3.08Å; Q370-N373 VanDerWaalsContact O-O 3.06Å
374	Q	42.5	Very low	71.8	Confident	126 Å²	126	90.3 Å²	90.3	59%	0.589	53%	0.525	S	S	*	.			trans	-44.8	136.7	165.9	-74.4	-158.6	-4.2	0	0	108.6	S372 N376 K377	S372-Q374 PolarHBondContact O-N 3.17Å; Q374-N376 PolarHBondContact O-N 3.1Å; Q374-K377 VanDerWaalsContact OE1-CE 3.28Å
375	P	47.3	Very low	71.7	Confident	108 Å²	108	88.5 Å²	88.5	70%	0.701	51%	0.508	S	S	*	.	S	Bend	trans	-51	114.6	178.3	20.5	-31.1	0	0	0	107.6	K377	P375-K377 PolarHBondContact O-N 2.9Å
376	N	58.6	Low	71.6	Confident	74 Å²	74	87 Å²	87	40%	0.396	50%	0.504	S	S	.	.			trans	-34.7	106.3	-168.2	-87.1	-52.5	0	0	0	111	Q374 M387 A388	Q374-N376 PolarHBondContact O-N 3.1Å; N376-M387 HydrophobicContact CB-CB 4.26Å; N376-M387 HydrophobicContact CB-CE 4.49Å; N376-M387 WeakPolarHBondContact O-CE 3.28Å; N376-M387 WeakPolarHBondContact O-CG 3.45Å; N376-A388 WeakPolarHBondContact ND2-CB 3.28Å; N376-A388 PolarHBondContact ND2-O 3.05Å
377	K	63.6	Low	71.7	Confident	152 Å²	152	83.5 Å²	83.5	66%	0.661	49%	0.487	S	S	*	.	P	Polyproline II helix	trans	-56.2	130.7	-178.3	-79.8	-177.4	179.6	174	0	108.3	Q374 P375 V379	Q374-K377 VanDerWaalsContact OE1-CE 3.28Å; P375-K377 PolarHBondContact O-N 2.9Å; K377-V379 PolarHBondContact O-N 3.35Å
378	P	75.2	Confident	71.9	Confident	66 Å²	66	82.3 Å²	82.3	43%	0.429	48%	0.477	S	S	.	.	P	Polyproline II helix	trans	-58.8	124.1	176.3	18.6	-27.3	0	0	0	110.2	T385 T386 M387 V465	P378-T385 HydrophobicContact CB-CG2 3.46Å; P378-T385 VanDerWaalsContact CB-CG2 3.46Å; P378-T386 WeakPolarHBondContact CA-O 3.27Å; P378-M387 HydrophobicContact CB-CG 3.86Å; P378-M387 HydrophobicContact CB-SD 4.06Å; P378-M387 HydrophobicContact CG-SD 4.5Å; P378-V465 HydrophobicContact CB-CG2 3.85Å; P378-V465 HydrophobicContact CG-CG2 4.23Å
379	V	79.8	Confident	72	Confident	90 Å²	90	79.9 Å²	79.9	55%	0.545	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	125	173.7	-178.8	0	0	0	0	107.7	K377 T386	K377-V379 PolarHBondContact O-N 3.35Å; V379-T386 PolarHBondContact N-O 2.8Å; V379-T386 PolarHBondContact O-N 2.8Å; V379-T386 PolarHBondContact O-OG1 3.15Å
380	I	80.8	Confident	72.4	Confident	130 Å²	130	80.7 Å²	80.7	67%	0.667	46%	0.458	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.2	110.7	176.3	-57.7	174	0	0	0	107.4	G382	I380-G382 VanDerWaalsContact CG2-O 3.25Å; I380-G382 WeakPolarHBondContact CG2-O 3.37Å
381	D	70.2	Confident	73.4	Confident	121 Å²	121	74.4 Å²	74.4	65%	0.647	43%	0.428	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110	96.5	173.9	-174.8	13.3	0	0	0	108.5	D383 V384	D381-D383 PolarHBondContact O-N 3.18Å; D381-V384 PolarHBondContact N-O 3.11Å; D381-V384 PolarHBondContact O-N 3.02Å; D381-V384 VanDerWaalsContact O-N 3.12Å
382	G	79	Confident	74.8	Confident	60 Å²	60	72.7 Å²	72.7	62%	0.619	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.6	-122.6	-169.1	0	0	0	0	0	112.1	I380 V384	I380-G382 VanDerWaalsContact CG2-O 3.25Å; I380-G382 WeakPolarHBondContact CG2-O 3.37Å; G382-V384 VanDerWaalsContact C-N 3.33Å
383	D	85.9	Confident	76.4	Confident	149 Å²	149	73.3 Å²	73.3	80%	0.797	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	2.5	179.4	-67.5	-24.4	0	0	0	113.8	D381	D381-D383 PolarHBondContact O-N 3.18Å
384	V	87.5	Confident	78.2	Confident	22 Å²	22	76.6 Å²	76.6	13%	0.133	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	122.3	-174.1	-170.4	0	0	0	0	110.8	D381 G382 T386 T434 K441 R443	D381-V384 PolarHBondContact N-O 3.11Å; D381-V384 PolarHBondContact O-N 3.02Å; D381-V384 VanDerWaalsContact O-N 3.12Å; G382-V384 VanDerWaalsContact C-N 3.33Å; V384-T386 HydrophobicContact CG1-CG2 4.12Å; V384-T434 HydrophobicContact CG1-CG2 4.19Å; V384-K441 HydrophobicContact CB-CB 4.3Å; V384-K441 HydrophobicContact CG1-CB 4.19Å; V384-K441 HydrophobicContact CG2-CB 3.91Å; V384-K441 HydrophobicContact CG2-CD 4.14Å; V384-R443 HydrophobicContact CG1-CB 3.7Å
385	T	90.3	Very high	80.1	Confident	20 Å²	20	72.7 Å²	72.7	12%	0.123	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	123.3	169.8	-55.7	0	0	0	0	109.8	P378 K441 Y442 R443 V465	P378-T385 HydrophobicContact CB-CG2 3.46Å; P378-T385 VanDerWaalsContact CB-CG2 3.46Å; T385-K441 PolarHBondContact N-O 3Å; T385-Y442 HydrophobicContact CG2-CD1 4.32Å; T385-Y442 CarbonylContact O-C 3.49Å; T385-Y442 VanDerWaalsContact O-CA 3.31Å; T385-Y442 WeakPolarHBondContact O-CA 3.48Å; T385-R443 PolarHBondContact O-N 3.2Å; T385-V465 HydrophobicContact CG2-CG1 4.34Å; T385-V465 HydrophobicContact CG2-CG2 3.77Å
386	T	88.9	Confident	81.9	Confident	24 Å²	24	67.8 Å²	67.8	15%	0.147	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	140.8	-176.6	60.3	0	0	0	0	112	P378 V379 V384 R443	P378-T386 WeakPolarHBondContact CA-O 3.27Å; V379-T386 PolarHBondContact N-O 2.8Å; V379-T386 PolarHBondContact O-N 2.8Å; V379-T386 PolarHBondContact O-OG1 3.15Å; V384-T386 HydrophobicContact CG1-CG2 4.12Å; T386-R443 VanDerWaalsContact CA-O 3.28Å; T386-R443 WeakPolarHBondContact CA-O 3.45Å; T386-R443 HydrophobicContact CG2-CB 4.23Å
387	M	86.4	Confident	83.1	Confident	11 Å²	11	65.6 Å²	65.6	5%	0.054	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	145.7	170.7	-67.7	169.2	72	0	0	108.6	N376 P378 V389 R443 S444 S445 V461 R464 V465	N376-M387 HydrophobicContact CB-CB 4.26Å; N376-M387 HydrophobicContact CB-CE 4.49Å; N376-M387 WeakPolarHBondContact O-CE 3.28Å; N376-M387 WeakPolarHBondContact O-CG 3.45Å; P378-M387 HydrophobicContact CB-CG 3.86Å; P378-M387 HydrophobicContact CB-SD 4.06Å; P378-M387 HydrophobicContact CG-SD 4.5Å; M387-V389 HydrophobicContact CB-CG2 3.97Å; M387-V389 PolarHBondContact O-N 3.27Å; M387-V389 VanDerWaalsContact O-N 3.13Å; M387-R443 PolarHBondContact N-O 3.08Å; M387-S444 VanDerWaalsContact O-CA 3.24Å; M387-S444 WeakPolarHBondContact O-CA 3.36Å; M387-S444 PolarHBondContact O-OG 3.27Å; M387-S445 PolarHBondContact O-N 2.9Å; M387-V461 HydrophobicContact CB-CG1 3.98Å; M387-V461 HydrophobicContact CB-CG2 4.02Å; M387-V461 HydrophobicContact CG-CG1 4.03Å; M387-V461 HydrophobicContact SD-CG1 3.99Å; M387-R464 HydrophobicContact CE-CB 4.03Å; M387-R464 HydrophobicContact SD-CB 4.31Å; M387-V465 HydrophobicContact SD-CG2 3.56Å; M387-V465 VanDerWaalsContact SD-CG2 3.56Å
388	A	87.1	Confident	83.8	Confident	29 Å²	29	63.4 Å²	63.4	24%	0.24	35%	0.345	C	S	.	.			trans	-76.4	101.7	173.2	0	0	0	0	0	109.9	N376 S445 L446	N376-A388 WeakPolarHBondContact ND2-CB 3.28Å; N376-A388 PolarHBondContact ND2-O 3.05Å; A388-S445 WeakPolarHBondContact CA-OG 3.44Å; A388-S445 VanDerWaalsContact CB-OG 3.27Å; A388-S445 WeakPolarHBondContact CB-OG 3.34Å; A388-S445 PolarHBondContact N-OG 3.44Å; A388-L446 HydrophobicContact CB-CD1 4.43Å; A388-L446 HydrophobicContact CB-CD2 4.21Å; A388-L446 HydrophobicContact CB-CG 4.11Å
389	V	86.3	Confident	84.1	Confident	4 Å²	4	65.2 Å²	65.2	2%	0.024	35%	0.348	C	S	.	.			trans	-137.7	132.1	-178.9	-177.9	0	0	0	0	110.7	M387 S444 I460 V461	M387-V389 HydrophobicContact CB-CG2 3.97Å; M387-V389 PolarHBondContact O-N 3.27Å; M387-V389 VanDerWaalsContact O-N 3.13Å; V389-S444 PolarHBondContact N-OG 2.78Å; V389-S444 VanDerWaalsContact N-OG 3.15Å; V389-S444 WeakPolarHBondContact O-CB 3.38Å; V389-S444 PolarHBondContact O-OG 3.14Å; V389-I460 HydrophobicContact CG1-CB 3.9Å; V389-I460 HydrophobicContact CG1-CD1 4.03Å; V389-I460 HydrophobicContact CG1-CG2 3.56Å; V389-V461 HydrophobicContact CB-CG2 3.99Å; V389-V461 HydrophobicContact CG2-CG2 3.86Å
390	K	87	Confident	84.3	Confident	77 Å²	77	62 Å²	62	34%	0.335	33%	0.327	S	S	.	.			trans	-106.2	144	173.2	-159.1	-176	178.6	-176.4	0	109.4	E105 L446 E448	E105-K390 IonicContact OE1-NZ 3.15Å; E105-K390 PolarHBondContact OE1-NZ 3.39Å; K390-L446 HydrophobicContact CB-CD1 4.17Å; K390-E448 WeakPolarHBondContact CG-OE1 3.41Å
391	F	89.7	Confident	84.8	Confident	7 Å²	7	56.9 Å²	56.9	3%	0.031	30%	0.302	C	S	.	.			trans	-90.1	112.2	169.5	171.5	-104.3	0	0	0	109.9	R393 Y396 P402 E448 F453 Q456 I460	F391-R393 HydrophobicContact CE1-CB 4.3Å; F391-Y396 AromaticContact CD2-CD2 3.88Å; F391-Y396 HydrophobicContact CD2-CD2 3.88Å; F391-Y396 AromaticContact CD2-CE2 3.52Å; F391-Y396 HydrophobicContact CD2-CE2 3.52Å; F391-Y396 AromaticContact CE2-CD2 3.32Å; F391-Y396 HydrophobicContact CE2-CD2 3.32Å; F391-Y396 AromaticContact CE2-CE2 3.47Å; F391-Y396 HydrophobicContact CE2-CE2 3.47Å; F391-Y396 VanDerWaalsContact CE2-CE2 3.47Å; F391-Y396 HydrophobicContact CE2-CG 4.03Å; F391-Y396 HydrophobicContact CZ-CD2 4.15Å; F391-P402 HydrophobicContact CD2-CG 3.97Å; F391-P402 HydrophobicContact CE2-CG 3.95Å; F391-E448 PolarHBondContact N-OE1 3.27Å; F391-F453 HydrophobicContact CD1-CB 4.43Å; F391-F453 AromaticContact CD1-CD1 3.8Å; F391-F453 HydrophobicContact CD1-CD1 3.8Å; F391-F453 HydrophobicContact CD1-CD2 4.49Å; F391-F453 HydrophobicContact CD1-CE1 4.14Å; F391-F453 HydrophobicContact CD1-CG 4Å; F391-F453 HydrophobicContact CE1-CD1 4.05Å; F391-F453 HydrophobicContact CE1-CE1 4Å; F391-Q456 HydrophobicContact CB-CB 3.69Å; F391-Q456 HydrophobicContact CD1-CB 3.83Å; F391-Q456 HydrophobicContact CD1-CG 3.98Å; F391-Q456 HydrophobicContact CD2-CB 3.58Å; F391-Q456 HydrophobicContact CD2-CG 4.16Å; F391-Q456 HydrophobicContact CE1-CB 4.37Å; F391-Q456 HydrophobicContact CE1-CG 4.08Å; F391-Q456 HydrophobicContact CE2-CB 4.15Å; F391-Q456 HydrophobicContact CE2-CG 4.25Å; F391-Q456 HydrophobicContact CG-CB 3.39Å; F391-Q456 HydrophobicContact CG-CG 4.02Å; F391-Q456 HydrophobicContact CZ-CG 4.21Å; F391-I460 HydrophobicContact CB-CD1 4.14Å; F391-I460 HydrophobicContact CD2-CD1 4.09Å
392	E	85.5	Confident	85.9	Confident	57 Å²	57	51.1 Å²	51.1	27%	0.266	27%	0.271	S	S	.	.			trans	-104	117	174.1	-61.1	-159.7	171.7	0	0	110.7	R394 D395 Y396	E392-R394 HydrophobicContact CB-CG 4.25Å; E392-R394 PolarHBondContact O-N 3.34Å; E392-R394 VanDerWaalsContact O-N 3.1Å; E392-R394 IonicContact OE1-NH2 2.67Å; E392-R394 IonicContact OE2-CZ 3.45Å; E392-R394 IonicContact OE2-NE 3.65Å; E392-R394 PolarHBondContact OE2-NE 2.83Å; E392-R394 IonicContact OE2-NH2 3.7Å; E392-R394 PolarHBondContact OE2-NH2 2.99Å; E392-D395 WeakPolarHBondContact O-CB 3.37Å; E392-D395 PolarHBondContact O-N 3.42Å; E392-Y396 VanDerWaalsContact O-CD2 3.25Å; E392-Y396 WeakPolarHBondContact O-CD2 3.47Å
393	R	86.9	Confident	86.7	Confident	96 Å²	96	51.2 Å²	51.2	36%	0.362	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-58.1	-32.3	-173.9	179.9	57.4	-175.9	130.2	-20.8	113.6	F391 D395 Y396 P397 P398	F391-R393 HydrophobicContact CE1-CB 4.3Å; R393-D395 PolarHBondContact O-N 2.98Å; R393-Y396 PolarHBondContact NH1-O 2.94Å; R393-Y396 PolarHBondContact O-N 3.48Å; R393-P397 PolarHBondContact NH1-O 3.19Å; R393-P397 PolarHBondContact NH2-O 3.46Å; R393-P398 PolarHBondContact NH2-O 2.96Å
394	R	83.2	Confident	86.9	Confident	186 Å²	186	48 Å²	48	70%	0.702	24%	0.236	S	C	*	.	G	3₁₀ helix	trans	-65.9	-23.5	-179.6	62.7	-180	173.6	-174.3	-1.7	113.6	E392 Y396 I473	E392-R394 HydrophobicContact CB-CG 4.25Å; E392-R394 PolarHBondContact O-N 3.34Å; E392-R394 VanDerWaalsContact O-N 3.1Å; E392-R394 IonicContact OE1-NH2 2.67Å; E392-R394 IonicContact OE2-CZ 3.45Å; E392-R394 IonicContact OE2-NE 3.65Å; E392-R394 PolarHBondContact OE2-NE 2.83Å; E392-R394 IonicContact OE2-NH2 3.7Å; E392-R394 PolarHBondContact OE2-NH2 2.99Å; R394-Y396 PolarHBondContact O-N 3.41Å; R394-I473 WeakPolarHBondContact O-CD1 3.32Å
395	D	82.8	Confident	87	Confident	43 Å²	43	47.3 Å²	47.3	23%	0.23	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-79.2	-8.1	-178	-66.1	-1.9	0	0	0	112.7	E392 R393 R472 I473	E392-D395 WeakPolarHBondContact O-CB 3.37Å; E392-D395 PolarHBondContact O-N 3.42Å; R393-D395 PolarHBondContact O-N 2.98Å; D395-R472 HydrophobicContact CB-CG 4.38Å; D395-R472 WeakPolarHBondContact O-CG 3.35Å; D395-R472 IonicContact OD2-CZ 3.64Å; D395-R472 IonicContact OD2-NH1 2.81Å; D395-R472 IonicContact OD2-NH2 3.52Å; D395-I473 WeakPolarHBondContact O-CG1 3.32Å; D395-I473 PolarHBondContact O-N 3.33Å
396	Y	85.9	Confident	87.1	Confident	5 Å²	5	46.3 Å²	46.3	2%	0.02	23%	0.225	C	C	.	.	S	Bend	trans	-127	145.8	-172.3	-57.7	-87.8	0	0	0	112.1	F391 E392 R393 R394 P402 I460 E470 G471 R472	F391-Y396 AromaticContact CD2-CD2 3.88Å; F391-Y396 HydrophobicContact CD2-CD2 3.88Å; F391-Y396 AromaticContact CD2-CE2 3.52Å; F391-Y396 HydrophobicContact CD2-CE2 3.52Å; F391-Y396 AromaticContact CE2-CD2 3.32Å; F391-Y396 HydrophobicContact CE2-CD2 3.32Å; F391-Y396 AromaticContact CE2-CE2 3.47Å; F391-Y396 HydrophobicContact CE2-CE2 3.47Å; F391-Y396 VanDerWaalsContact CE2-CE2 3.47Å; F391-Y396 HydrophobicContact CE2-CG 4.03Å; F391-Y396 HydrophobicContact CZ-CD2 4.15Å; E392-Y396 VanDerWaalsContact O-CD2 3.25Å; E392-Y396 WeakPolarHBondContact O-CD2 3.47Å; R393-Y396 PolarHBondContact NH1-O 2.94Å; R393-Y396 PolarHBondContact O-N 3.48Å; R394-Y396 PolarHBondContact O-N 3.41Å; Y396-P402 HydrophobicContact CD1-CG 4.03Å; Y396-P402 HydrophobicContact CE1-CG 3.52Å; Y396-P402 HydrophobicContact CE2-CG 4.18Å; Y396-I460 WeakPolarHBondContact OH-CD1 3.34Å; Y396-E470 HydrophobicContact CE1-CB 4.49Å; Y396-E470 HydrophobicContact CE1-CG 4.15Å; Y396-E470 PolarHBondContact OH-OE1 2.93Å; Y396-G471 WeakPolarHBondContact CD1-O 3.41Å; Y396-R472 HydrophobicContact CE1-CB 4.17Å
397	P	84.4	Confident	87.3	Confident	28 Å²	28	47 Å²	47	18%	0.182	23%	0.227	C	C	.	.			trans	-56.7	151.2	175.3	-24.5	33.9	0	0	0	113.5	R393 Q399 I400 G471 I473	R393-P397 PolarHBondContact NH1-O 3.19Å; R393-P397 PolarHBondContact NH2-O 3.46Å; P397-Q399 PolarHBondContact O-N 2.93Å; P397-I400 HydrophobicContact CB-CB 4.26Å; P397-I400 HydrophobicContact CB-CG1 4.26Å; P397-I400 HydrophobicContact CG-CB 4.38Å; P397-I400 HydrophobicContact CG-CD1 4.33Å; P397-I400 HydrophobicContact CG-CG1 4.49Å; P397-I400 PolarHBondContact O-N 3.31Å; P397-I400 VanDerWaalsContact O-N 3.11Å; P397-I400 VanDerWaalsContact O-O 3.04Å; P397-G471 VanDerWaalsContact CD-O 3.31Å; P397-G471 WeakPolarHBondContact CD-O 3.41Å; P397-I473 HydrophobicContact CG-CG1 4.08Å
398	P	78.1	Confident	87.4	Confident	107 Å²	107	49.6 Å²	49.6	70%	0.695	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-28.3	-178.8	-28.8	35.7	0	0	0	115.2	R393	R393-P398 PolarHBondContact NH2-O 2.96Å
399	Q	81.4	Confident	87.6	Confident	103 Å²	103	49.7 Å²	49.7	48%	0.481	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.3	-4.4	-175.8	60.7	-76.7	-0.9	0	0	114.4	P397 M404	P397-Q399 PolarHBondContact O-N 2.93Å; Q399-M404 WeakPolarHBondContact O-CE 3.41Å
400	I	84.1	Confident	87.8	Confident	23 Å²	23	49.5 Å²	49.5	12%	0.118	23%	0.233	C	C	.	.			trans	-121.1	138.3	-174	-56.4	-171.1	0	0	0	109.7	P397 F405 V481	P397-I400 HydrophobicContact CB-CB 4.26Å; P397-I400 HydrophobicContact CB-CG1 4.26Å; P397-I400 HydrophobicContact CG-CB 4.38Å; P397-I400 HydrophobicContact CG-CD1 4.33Å; P397-I400 HydrophobicContact CG-CG1 4.49Å; P397-I400 PolarHBondContact O-N 3.31Å; P397-I400 VanDerWaalsContact O-N 3.11Å; P397-I400 VanDerWaalsContact O-O 3.04Å; I400-F405 HydrophobicContact CD1-CE2 4.27Å; I400-F405 HydrophobicContact CG2-CD2 3.36Å; I400-F405 HydrophobicContact CG2-CE2 3.42Å; I400-F405 VanDerWaalsContact CG2-CE2 3.42Å; I400-V481 HydrophobicContact CG1-CG1 4.47Å
401	T	91	Very high	88	Confident	22 Å²	22	52.6 Å²	52.6	14%	0.135	24%	0.242	C	C	.	.			trans	-135.8	150.2	171.3	64.9	0	0	0	0	110.2	K403 M404 F405	T401-K403 PolarHBondContact O-N 3.15Å; T401-M404 HydrophobicContact CG2-SD 4.48Å; T401-M404 WeakPolarHBondContact O-CA 3.36Å; T401-M404 WeakPolarHBondContact O-CB 3.5Å; T401-M404 PolarHBondContact O-N 3.42Å; T401-M404 VanDerWaalsContact OG1-CG 3.31Å; T401-M404 WeakPolarHBondContact OG1-CG 3.46Å; T401-M404 PolarHBondContact OG1-N 3.21Å; T401-M404 PolarHBondContact OG1-SD 3.01Å; T401-F405 PolarHBondContact O-N 3.18Å
402	P	93.4	Very high	87.9	Confident	0 Å²	0	59 Å²	59	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-50.7	-40.5	176.6	-31.2	35.8	0	0	0	114	F391 Y396 M404 F405 L406 Q456 A459 I460 L463	F391-P402 HydrophobicContact CD2-CG 3.97Å; F391-P402 HydrophobicContact CE2-CG 3.95Å; Y396-P402 HydrophobicContact CD1-CG 4.03Å; Y396-P402 HydrophobicContact CE1-CG 3.52Å; Y396-P402 HydrophobicContact CE2-CG 4.18Å; P402-M404 VanDerWaalsContact C-N 3.32Å; P402-M404 PolarHBondContact O-N 3.27Å; P402-F405 WeakPolarHBondContact O-CB 3.35Å; P402-F405 PolarHBondContact O-N 3Å; P402-L406 WeakPolarHBondContact O-CB 3.49Å; P402-L406 PolarHBondContact O-N 3.21Å; P402-Q456 VanDerWaalsContact CD-OE1 3.28Å; P402-A459 HydrophobicContact CB-CB 4.19Å; P402-I460 HydrophobicContact CB-CG1 3.61Å; P402-I460 HydrophobicContact CG-CD1 4Å; P402-I460 HydrophobicContact CG-CG1 3.54Å; P402-L463 HydrophobicContact CB-CD1 4.39Å
403	K	94.2	Very high	88.1	Confident	62 Å²	62	60.6 Å²	60.6	27%	0.27	28%	0.278	S	S	.	.	H	α-helix	trans	-62.4	-36.8	177.1	-173.6	171.1	-170.2	-172.8	0	112.8	T401 L407 Y420 E455 Q456 A459	T401-K403 PolarHBondContact O-N 3.15Å; K403-L407 WeakPolarHBondContact O-CB 3.41Å; K403-L407 PolarHBondContact O-N 3.04Å; K403-L407 VanDerWaalsContact O-N 3.17Å; K403-Y420 HydrophobicContact CD-CE2 4.24Å; K403-Y420 HydrophobicContact CG-CE2 4.16Å; K403-E455 HydrophobicContact CD-CB 4.37Å; K403-E455 IonicContact NZ-OE2 3.23Å; K403-E455 PolarHBondContact NZ-OE2 3.36Å; K403-Q456 VanDerWaalsContact CB-OE1 3.26Å; K403-A459 HydrophobicContact CB-CB 4.41Å
404	M	91.5	Very high	88.3	Confident	81 Å²	81	65.3 Å²	65.3	40%	0.399	30%	0.301	S	S	.	.	H	α-helix	trans	-69.8	-42.5	174	-70.1	168	61.6	0	0	110.8	Q399 T401 P402 L407 E408	Q399-M404 WeakPolarHBondContact O-CE 3.41Å; T401-M404 HydrophobicContact CG2-SD 4.48Å; T401-M404 WeakPolarHBondContact O-CA 3.36Å; T401-M404 WeakPolarHBondContact O-CB 3.5Å; T401-M404 PolarHBondContact O-N 3.42Å; T401-M404 VanDerWaalsContact OG1-CG 3.31Å; T401-M404 WeakPolarHBondContact OG1-CG 3.46Å; T401-M404 PolarHBondContact OG1-N 3.21Å; T401-M404 PolarHBondContact OG1-SD 3.01Å; P402-M404 VanDerWaalsContact C-N 3.32Å; P402-M404 PolarHBondContact O-N 3.27Å; M404-L407 WeakPolarHBondContact O-CB 3.4Å; M404-L407 PolarHBondContact O-N 2.9Å; M404-E408 PolarHBondContact O-N 2.88Å
405	F	89.3	Confident	88.6	Confident	8 Å²	8	60.6 Å²	60.6	4%	0.035	29%	0.285	C	S	.	.	H	α-helix	trans	-59.2	-49.4	176.5	-116.3	-96.8	0	0	0	112	I400 T401 P402 L407 E408 W409 L463 P469 S478 L480 V481	I400-F405 HydrophobicContact CD1-CE2 4.27Å; I400-F405 HydrophobicContact CG2-CD2 3.36Å; I400-F405 HydrophobicContact CG2-CE2 3.42Å; I400-F405 VanDerWaalsContact CG2-CE2 3.42Å; T401-F405 PolarHBondContact O-N 3.18Å; P402-F405 WeakPolarHBondContact O-CB 3.35Å; P402-F405 PolarHBondContact O-N 3Å; F405-L407 VanDerWaalsContact C-N 3.27Å; F405-L407 PolarHBondContact O-N 3.4Å; F405-E408 PolarHBondContact O-N 3.27Å; F405-W409 WeakPolarHBondContact O-CB 3.48Å; F405-W409 PolarHBondContact O-N 3.42Å; F405-L463 HydrophobicContact CB-CD1 4.18Å; F405-P469 WeakPolarHBondContact CD1-O 3.42Å; F405-S478 WeakPolarHBondContact CE1-OG 3.48Å; F405-S478 VanDerWaalsContact CZ-OG 3.28Å; F405-S478 WeakPolarHBondContact CZ-OG 3.11Å; F405-L480 HydrophobicContact CD1-CD1 4.15Å; F405-L480 HydrophobicContact CE1-CB 4.07Å; F405-L480 HydrophobicContact CE1-CD1 3.9Å; F405-L480 HydrophobicContact CZ-CB 4.42Å; F405-V481 HydrophobicContact CD2-CG2 3.62Å; F405-V481 HydrophobicContact CE2-CB 4.23Å; F405-V481 HydrophobicContact CE2-CG2 3.57Å; F405-V481 HydrophobicContact CG-CG2 4.31Å; F405-V481 HydrophobicContact CZ-CG2 4.24Å
406	L	92.5	Very high	88.9	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-61.9	-35.9	178.3	-176.5	59.1	0	0	0	112.1	P402 W409 S410 P418 V435 V437 A459 C462 L463	P402-L406 WeakPolarHBondContact O-CB 3.49Å; P402-L406 PolarHBondContact O-N 3.21Å; L406-W409 HydrophobicContact CD1-CE3 4.04Å; L406-S410 VanDerWaalsContact O-CB 3.27Å; L406-S410 WeakPolarHBondContact O-CB 3.49Å; L406-S410 PolarHBondContact O-N 2.97Å; L406-S410 PolarHBondContact O-OG 2.76Å; L406-P418 HydrophobicContact CD2-CB 4.37Å; L406-P418 HydrophobicContact CD2-CG 4.38Å; L406-P418 HydrophobicContact CG-CB 4.49Å; L406-P418 HydrophobicContact CG-CG 3.98Å; L406-V435 HydrophobicContact CD2-CG1 4.44Å; L406-V435 HydrophobicContact CD2-CG2 4.09Å; L406-V437 HydrophobicContact CD1-CG2 4.38Å; L406-V437 HydrophobicContact CD2-CG2 4.15Å; L406-V437 HydrophobicContact CG-CG2 4.46Å; L406-A459 HydrophobicContact CB-CB 4.42Å; L406-A459 HydrophobicContact CD2-CB 3.88Å; L406-C462 HydrophobicContact CD1-CB 4.33Å; L406-C462 HydrophobicContact CD2-CB 3.87Å; L406-L463 HydrophobicContact CB-CD1 4.15Å; L406-L463 HydrophobicContact CB-CD2 4.15Å; L406-L463 HydrophobicContact CB-CG 4.17Å; L406-L463 HydrophobicContact CD1-CD2 3.75Å; L406-L463 HydrophobicContact CD1-CG 4.08Å
407	L	92.1	Very high	89.2	Confident	37 Å²	37	72.2 Å²	72.2	19%	0.194	34%	0.338	C	S	.	.	H	α-helix	trans	-64.7	-49.9	175.5	178.8	64	0	0	0	111.9	K403 M404 F405 S410 R411 Q417	K403-L407 WeakPolarHBondContact O-CB 3.41Å; K403-L407 PolarHBondContact O-N 3.04Å; K403-L407 VanDerWaalsContact O-N 3.17Å; M404-L407 WeakPolarHBondContact O-CB 3.4Å; M404-L407 PolarHBondContact O-N 2.9Å; F405-L407 VanDerWaalsContact C-N 3.27Å; F405-L407 PolarHBondContact O-N 3.4Å; L407-S410 PolarHBondContact O-N 3.42Å; L407-R411 WeakPolarHBondContact O-CG 3.37Å; L407-R411 PolarHBondContact O-N 3.39Å; L407-R411 VanDerWaalsContact O-N 3.09Å; L407-Q417 HydrophobicContact CD1-CG 3.72Å
408	E	89.7	Confident	89.7	Confident	67 Å²	67	71.3 Å²	71.3	31%	0.313	33%	0.332	S	S	.	.	H	α-helix	trans	-67.7	-39.4	-179.9	-63.6	-56.4	161.1	0	0	111.8	M404 F405 S410 R411 K412 V481	M404-E408 PolarHBondContact O-N 2.88Å; F405-E408 PolarHBondContact O-N 3.27Å; E408-S410 PolarHBondContact O-N 3.18Å; E408-R411 PolarHBondContact O-N 2.86Å; E408-R411 IonicContact OE1-CZ 3.51Å; E408-R411 IonicContact OE1-NH1 3.43Å; E408-R411 PolarHBondContact OE1-NH1 2.96Å; E408-R411 IonicContact OE2-CZ 3.25Å; E408-R411 IonicContact OE2-NH1 3.61Å; E408-R411 PolarHBondContact OE2-NH1 3.41Å; E408-K412 PolarHBondContact O-N 2.94Å; E408-V481 HydrophobicContact CG-CG2 4.36Å
409	W	90.3	Very high	90.5	Very high	30 Å²	30	71.7 Å²	71.7	11%	0.114	33%	0.325	C	S	.	.	H	α-helix	trans	-59.2	-46.9	172.4	178.4	83.1	0	0	0	111.6	F405 L406 R411 K412 E413 F415 V437 L466 V468	F405-W409 WeakPolarHBondContact O-CB 3.48Å; F405-W409 PolarHBondContact O-N 3.42Å; L406-W409 HydrophobicContact CD1-CE3 4.04Å; W409-R411 VanDerWaalsContact C-N 3.26Å; W409-R411 PolarHBondContact O-N 3.32Å; W409-K412 WeakPolarHBondContact O-CB 3.38Å; W409-K412 PolarHBondContact O-N 3.36Å; W409-K412 VanDerWaalsContact O-N 3.11Å; W409-E413 HydrophobicContact CD2-CG 4.09Å; W409-E413 HydrophobicContact CH2-CG 4.23Å; W409-E413 HydrophobicContact CZ2-CG 3.69Å; W409-E413 PolarHBondContact O-N 3.23Å; W409-F415 HydrophobicContact CH2-CD2 4.01Å; W409-F415 AromaticContact CH2-CE2 3.64Å; W409-F415 HydrophobicContact CH2-CE2 3.64Å; W409-F415 HydrophobicContact CZ2-CE2 4.44Å; W409-F415 AromaticContact CZ3-CD2 3.88Å; W409-F415 HydrophobicContact CZ3-CD2 3.88Å; W409-F415 HydrophobicContact CZ3-CE2 4.01Å; W409-V437 HydrophobicContact CZ3-CG1 4.18Å; W409-L466 HydrophobicContact CE3-CD1 4.28Å; W409-L466 HydrophobicContact CH2-CD1 3.47Å; W409-L466 VanDerWaalsContact CH2-CD1 3.47Å; W409-L466 HydrophobicContact CH2-CD2 4.23Å; W409-L466 HydrophobicContact CH2-CG 4.34Å; W409-L466 HydrophobicContact CZ2-CD1 4.13Å; W409-L466 HydrophobicContact CZ3-CD1 3.56Å; W409-V468 VanDerWaalsContact CD1-CG1 3.48Å; W409-V468 HydrophobicContact CD2-CG2 4.35Å; W409-V468 HydrophobicContact CG-CG1 3.94Å; W409-V468 HydrophobicContact CZ2-CG2 3.99Å
410	S	90.8	Very high	91.2	Very high	1 Å²	1	69 Å²	69	1%	0.007	31%	0.311	C	S	.	.	H	α-helix	trans	-60.6	-36.8	178.7	-59.8	0	0	0	0	112.1	L406 L407 E408 K414 F415 P418	L406-S410 VanDerWaalsContact O-CB 3.27Å; L406-S410 WeakPolarHBondContact O-CB 3.49Å; L406-S410 PolarHBondContact O-N 2.97Å; L406-S410 PolarHBondContact O-OG 2.76Å; L407-S410 PolarHBondContact O-N 3.42Å; E408-S410 PolarHBondContact O-N 3.18Å; S410-K414 PolarHBondContact O-N 2.94Å; S410-K414 VanDerWaalsContact O-N 3.17Å; S410-F415 PolarHBondContact O-N 3.26Å; S410-P418 VanDerWaalsContact OG-CG 3.31Å; S410-P418 WeakPolarHBondContact OG-CG 3.13Å
411	R	90.9	Very high	91.8	Very high	142 Å²	142	73.3 Å²	73.3	54%	0.536	33%	0.33	S	S	.	.	H	α-helix	trans	-66.5	-44.1	174.5	-72.7	175.9	-177.5	156.9	1.1	112.2	L407 E408 W409 E413 K414	L407-R411 WeakPolarHBondContact O-CG 3.37Å; L407-R411 PolarHBondContact O-N 3.39Å; L407-R411 VanDerWaalsContact O-N 3.09Å; E408-R411 PolarHBondContact O-N 2.86Å; E408-R411 IonicContact OE1-CZ 3.51Å; E408-R411 IonicContact OE1-NH1 3.43Å; E408-R411 PolarHBondContact OE1-NH1 2.96Å; E408-R411 IonicContact OE2-CZ 3.25Å; E408-R411 IonicContact OE2-NH1 3.61Å; E408-R411 PolarHBondContact OE2-NH1 3.41Å; W409-R411 VanDerWaalsContact C-N 3.26Å; W409-R411 PolarHBondContact O-N 3.32Å; R411-E413 VanDerWaalsContact C-N 3.28Å; R411-E413 PolarHBondContact O-N 2.94Å; R411-K414 PolarHBondContact O-N 2.95Å
412	K	89.1	Confident	92	Very high	140 Å²	140	74.2 Å²	74.2	61%	0.609	34%	0.336	S	S	*	.	H	α-helix	trans	-59.9	-41.7	178.4	-174.1	179.5	176.8	-176.8	0	111.3	E408 W409 K414 L480	E408-K412 PolarHBondContact O-N 2.94Å; W409-K412 WeakPolarHBondContact O-CB 3.38Å; W409-K412 PolarHBondContact O-N 3.36Å; W409-K412 VanDerWaalsContact O-N 3.11Å; K412-K414 PolarHBondContact O-N 2.88Å; K412-L480 HydrophobicContact CD-CD2 3.54Å
413	E	89.1	Confident	91.9	Very high	92 Å²	92	76.9 Å²	76.9	43%	0.43	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	4.3	177.2	-61.1	-54.4	134.1	0	0	113.9	W409 R411 F415	W409-E413 HydrophobicContact CD2-CG 4.09Å; W409-E413 HydrophobicContact CH2-CG 4.23Å; W409-E413 HydrophobicContact CZ2-CG 3.69Å; W409-E413 PolarHBondContact O-N 3.23Å; R411-E413 VanDerWaalsContact C-N 3.28Å; R411-E413 PolarHBondContact O-N 2.94Å; E413-F415 HydrophobicContact CB-CD2 3.54Å; E413-F415 HydrophobicContact CB-CE2 3.5Å; E413-F415 VanDerWaalsContact CB-CE2 3.5Å; E413-F415 HydrophobicContact CB-CG 4.44Å; E413-F415 HydrophobicContact CB-CZ 4.37Å; E413-F415 HydrophobicContact CG-CE2 4.25Å; E413-F415 PolarHBondContact O-N 3.18Å
414	K	90.3	Very high	91.9	Very high	194 Å²	194	79.3 Å²	79.3	84%	0.843	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.3	28.9	-180	-54.6	178.8	-179.2	176.1	0	114.4	S410 R411 K412	S410-K414 PolarHBondContact O-N 2.94Å; S410-K414 VanDerWaalsContact O-N 3.17Å; R411-K414 PolarHBondContact O-N 2.95Å; K412-K414 PolarHBondContact O-N 2.88Å
415	F	89.1	Confident	91.7	Very high	88 Å²	88	79.2 Å²	79.2	39%	0.386	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-80.6	160.9	170.7	-65.4	-51.4	0	0	0	111.9	W409 S410 E413 A438	W409-F415 HydrophobicContact CH2-CD2 4.01Å; W409-F415 AromaticContact CH2-CE2 3.64Å; W409-F415 HydrophobicContact CH2-CE2 3.64Å; W409-F415 HydrophobicContact CZ2-CE2 4.44Å; W409-F415 AromaticContact CZ3-CD2 3.88Å; W409-F415 HydrophobicContact CZ3-CD2 3.88Å; W409-F415 HydrophobicContact CZ3-CE2 4.01Å; S410-F415 PolarHBondContact O-N 3.26Å; E413-F415 HydrophobicContact CB-CD2 3.54Å; E413-F415 HydrophobicContact CB-CE2 3.5Å; E413-F415 VanDerWaalsContact CB-CE2 3.5Å; E413-F415 HydrophobicContact CB-CG 4.44Å; E413-F415 HydrophobicContact CB-CZ 4.37Å; E413-F415 HydrophobicContact CG-CE2 4.25Å; E413-F415 PolarHBondContact O-N 3.18Å; F415-A438 HydrophobicContact CD1-CB 3.82Å; F415-A438 HydrophobicContact CE1-CB 3.82Å; F415-A438 HydrophobicContact CG-CB 4.24Å; F415-A438 HydrophobicContact CZ-CB 4.24Å
416	Q	89.8	Confident	91.1	Very high	154 Å²	154	84.3 Å²	84.3	72%	0.72	40%	0.402	S	S	*	.	P	Polyproline II helix	trans	-61.6	154.6	167	-67.8	-171	-3.5	0	0	110.7
417	Q	91.8	Very high	90.3	Very high	137 Å²	137	92.2 Å²	92.2	64%	0.64	44%	0.439	S	S	*	.	P	Polyproline II helix	trans	-57.8	133.6	178.9	-179.9	170	6.7	0	0	111.2	L407 Q419	L407-Q417 HydrophobicContact CD1-CG 3.72Å; Q417-Q419 PolarHBondContact O-N 3.3Å
418	P	95.2	Very high	89.7	Confident	9 Å²	9	94.4 Å²	94.4	6%	0.058	45%	0.451	C	S	.	.	P	Polyproline II helix	trans	-55.5	127	176.6	-27.3	34.7	0	0	0	112.3	L406 S410 Y420 V435 V437	L406-P418 HydrophobicContact CD2-CB 4.37Å; L406-P418 HydrophobicContact CD2-CG 4.38Å; L406-P418 HydrophobicContact CG-CB 4.49Å; L406-P418 HydrophobicContact CG-CG 3.98Å; S410-P418 VanDerWaalsContact OG-CG 3.31Å; S410-P418 WeakPolarHBondContact OG-CG 3.13Å; P418-Y420 HydrophobicContact CB-CE2 3.87Å; P418-V435 HydrophobicContact CB-CG2 3.81Å; P418-V437 HydrophobicContact CB-CG2 3.85Å; P418-V437 HydrophobicContact CG-CG2 4Å
419	Q	95.3	Very high	89.6	Confident	115 Å²	115	100.3 Å²	100.3	54%	0.537	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	137.8	179.4	-64.1	-175.9	-2.5	0	0	110.4	Q417 V435 T436	Q417-Q419 PolarHBondContact O-N 3.3Å; Q419-V435 CarbonylContact O-C 3.56Å; Q419-V435 VanDerWaalsContact O-CA 3.26Å; Q419-V435 WeakPolarHBondContact O-CA 3.31Å; Q419-T436 PolarHBondContact N-O 2.77Å; Q419-T436 PolarHBondContact O-N 2.72Å
420	Y	96.4	Very high	89.3	Confident	46 Å²	46	99.2 Å²	99.2	18%	0.18	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	125.3	-175.8	-66.2	-99.3	0	0	0	110.9	K403 P418 T434 V435 E455 A459	K403-Y420 HydrophobicContact CD-CE2 4.24Å; K403-Y420 HydrophobicContact CG-CE2 4.16Å; P418-Y420 HydrophobicContact CB-CE2 3.87Å; Y420-T434 WeakPolarHBondContact CA-O 3.36Å; Y420-V435 HydrophobicContact CD1-CB 3.82Å; Y420-V435 HydrophobicContact CD1-CG2 3.96Å; Y420-V435 HydrophobicContact CD2-CG2 4.23Å; Y420-V435 HydrophobicContact CE1-CB 3.58Å; Y420-V435 HydrophobicContact CE1-CG2 3.52Å; Y420-V435 HydrophobicContact CE2-CG2 3.81Å; Y420-V435 HydrophobicContact CG-CB 4.48Å; Y420-V435 HydrophobicContact CG-CG2 4.29Å; Y420-V435 VanDerWaalsContact CZ-CG2 3.42Å; Y420-E455 HydrophobicContact CD1-CB 3.84Å; Y420-E455 HydrophobicContact CD1-CG 3.89Å; Y420-E455 HydrophobicContact CE1-CB 4.14Å; Y420-E455 VanDerWaalsContact CE1-O 3.28Å; Y420-E455 WeakPolarHBondContact CE1-O 3.45Å; Y420-E455 HydrophobicContact CG-CG 4.23Å; Y420-A459 HydrophobicContact CE1-CB 4.36Å; Y420-A459 WeakPolarHBondContact OH-CB 3.26Å
421	E	95.4	Very high	89.4	Confident	114 Å²	114	101.1 Å²	101.1	53%	0.533	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	122.1	172.2	-70.4	173.9	-172.6	0	0	108.5	S433 T434	E421-S433 CarbonylContact O-C 3.56Å; E421-S433 WeakPolarHBondContact O-CA 3.46Å; E421-S433 PolarHBondContact O-OG 3.45Å; E421-T434 PolarHBondContact N-O 3.49Å; E421-T434 PolarHBondContact O-N 3.43Å
422	T	95.3	Very high	89.6	Confident	42 Å²	42	95.5 Å²	95.5	26%	0.258	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	124.9	-176.8	-51.8	0	0	0	0	110.8	F431 Q432 S433 K451	T422-F431 HydrophobicContact CG2-CB 3.97Å; T422-F431 HydrophobicContact CG2-CD1 4.08Å; T422-F431 HydrophobicContact CG2-CG 4.5Å; T422-Q432 CarbonylContact C-O 3.55Å; T422-Q432 WeakPolarHBondContact CA-O 3.45Å; T422-Q432 WeakPolarHBondContact CG2-O 3.39Å; T422-S433 PolarHBondContact OG1-OG 3.19Å; T422-K451 HydrophobicContact CG2-CG 4.08Å
423	A	92.5	Very high	89.9	Confident	55 Å²	55	89 Å²	89	46%	0.455	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	146.9	171.2	0	0	0	0	0	110.4	F431 Q432	A423-F431 WeakPolarHBondContact O-CA 3.46Å; A423-Q432 PolarHBondContact N-O 3.42Å; A423-Q432 PolarHBondContact O-N 3.05Å
424	Q	93.9	Very high	90.2	Very high	114 Å²	114	84.9 Å²	84.9	53%	0.533	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	130.8	173.2	-172.1	178.8	15.4	0	0	109.8	R429 A430 F431	Q424-R429 PolarHBondContact NE2-O 3.48Å; Q424-A430 CarbonylContact C-O 3.56Å; Q424-A430 WeakPolarHBondContact CA-O 3.19Å; Q424-F431 HydrophobicContact CB-CD1 4Å; Q424-F431 HydrophobicContact CB-CE1 3.97Å; Q424-F431 HydrophobicContact CG-CD1 4.04Å; Q424-F431 HydrophobicContact CG-CE1 3.76Å; Q424-F431 HydrophobicContact CG-CZ 4.15Å
425	R	87.4	Confident	90.5	Very high	78 Å²	78	75.6 Å²	75.6	29%	0.294	37%	0.369	S	S	.	.			trans	-84.2	133	177.3	-175.8	163.8	64.1	-171.8	2.5	110.6	Q427 D428 R429 A430 W447	R425-Q427 HydrophobicContact CG-CB 4.45Å; R425-D428 IonicContact CZ-OD1 2.77Å; R425-D428 IonicContact CZ-OD2 3.9Å; R425-D428 IonicContact NE-OD1 3.83Å; R425-D428 PolarHBondContact NE-OD1 2.88Å; R425-D428 IonicContact NE-OD2 2.72Å; R425-D428 PolarHBondContact NE-OD2 2.87Å; R425-D428 IonicContact NH2-OD1 3.17Å; R425-D428 IonicContact NH2-OD2 3.83Å; R425-D428 PolarHBondContact NH2-OD2 2.75Å; R425-R429 WeakPolarHBondContact O-CA 3.5Å; R425-R429 PolarHBondContact O-N 3.04Å; R425-A430 PolarHBondContact N-O 3.34Å; R425-W447 HydrophobicContact CB-CE3 3.86Å; R425-W447 HydrophobicContact CB-CH2 4.01Å; R425-W447 HydrophobicContact CB-CZ3 3.55Å
426	S	76.8	Confident	90.9	Very high	116 Å²	116	72.7 Å²	72.7	81%	0.811	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-29.7	-173.8	51	0	0	0	0	114.4
427	Q	76.1	Confident	91	Very high	166 Å²	166	65.6 Å²	65.6	78%	0.776	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-44	-174.4	-67.3	151.1	-14	0	0	113	R425	R425-Q427 HydrophobicContact CG-CB 4.45Å
428	D	79.6	Confident	90.8	Very high	83 Å²	83	61.6 Å²	61.6	44%	0.444	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.4	6	-172.2	64.9	-15.3	0	0	0	113.3	R425 A430	R425-D428 IonicContact CZ-OD1 2.77Å; R425-D428 IonicContact CZ-OD2 3.9Å; R425-D428 IonicContact NE-OD1 3.83Å; R425-D428 PolarHBondContact NE-OD1 2.88Å; R425-D428 IonicContact NE-OD2 2.72Å; R425-D428 PolarHBondContact NE-OD2 2.87Å; R425-D428 IonicContact NH2-OD1 3.17Å; R425-D428 IonicContact NH2-OD2 3.83Å; R425-D428 PolarHBondContact NH2-OD2 2.75Å; D428-A430 PolarHBondContact O-N 3.08Å; D428-A430 VanDerWaalsContact O-N 3.11Å; D428-A430 WeakPolarHBondContact OD1-CB 3.45Å; D428-A430 PolarHBondContact OD1-N 3.44Å; D428-A430 WeakPolarHBondContact OD2-CB 3.45Å
429	R	85.8	Confident	90.4	Very high	191 Å²	191	68.7 Å²	68.7	72%	0.721	35%	0.353	S	S	*	.			trans	57.3	19.6	-176.6	-61.4	-178.3	178.2	-176.4	-0.7	113.7	Q424 R425 F431	Q424-R429 PolarHBondContact NE2-O 3.48Å; R425-R429 WeakPolarHBondContact O-CA 3.5Å; R425-R429 PolarHBondContact O-N 3.04Å; R429-F431 VanDerWaalsContact O-CE2 3.26Å; R429-F431 WeakPolarHBondContact O-CE2 3.41Å
430	A	85.6	Confident	90.3	Very high	6 Å²	6	69.3 Å²	69.3	5%	0.05	35%	0.354	C	S	.	.			trans	-73.8	156	177.4	0	0	0	0	0	111.8	Q424 R425 D428 W447 E448	Q424-A430 CarbonylContact C-O 3.56Å; Q424-A430 WeakPolarHBondContact CA-O 3.19Å; R425-A430 PolarHBondContact N-O 3.34Å; D428-A430 PolarHBondContact O-N 3.08Å; D428-A430 VanDerWaalsContact O-N 3.11Å; D428-A430 WeakPolarHBondContact OD1-CB 3.45Å; D428-A430 PolarHBondContact OD1-N 3.44Å; D428-A430 WeakPolarHBondContact OD2-CB 3.45Å; A430-W447 HydrophobicContact CB-CB 3.91Å; A430-W447 HydrophobicContact CB-CE3 4.28Å; A430-E448 CarbonylContact C-O 3.6Å; A430-E448 WeakPolarHBondContact CA-O 3.17Å
431	F	93	Very high	90.2	Very high	41 Å²	41	70.7 Å²	70.7	18%	0.18	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	141.2	-173.6	-60.6	-89	0	0	0	110.9	T422 A423 Q424 R429 E448 K449 K451 A454	T422-F431 HydrophobicContact CG2-CB 3.97Å; T422-F431 HydrophobicContact CG2-CD1 4.08Å; T422-F431 HydrophobicContact CG2-CG 4.5Å; A423-F431 WeakPolarHBondContact O-CA 3.46Å; Q424-F431 HydrophobicContact CB-CD1 4Å; Q424-F431 HydrophobicContact CB-CE1 3.97Å; Q424-F431 HydrophobicContact CG-CD1 4.04Å; Q424-F431 HydrophobicContact CG-CE1 3.76Å; Q424-F431 HydrophobicContact CG-CZ 4.15Å; R429-F431 VanDerWaalsContact O-CE2 3.26Å; R429-F431 WeakPolarHBondContact O-CE2 3.41Å; F431-E448 PolarHBondContact N-O 3.47Å; F431-E448 PolarHBondContact O-N 3.45Å; F431-K449 WeakPolarHBondContact CE2-O 3.43Å; F431-K451 HydrophobicContact CD1-CB 3.95Å; F431-K451 HydrophobicContact CE1-CB 4.22Å; F431-K451 HydrophobicContact CG-CB 4.18Å; F431-A454 HydrophobicContact CB-CB 3.93Å
432	Q	94.1	Very high	90.2	Very high	25 Å²	25	65.5 Å²	65.5	12%	0.117	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	129.9	170.2	-175.1	177.7	64.2	0	0	108.7	T422 A423 R443 S444 W447	T422-Q432 CarbonylContact C-O 3.55Å; T422-Q432 WeakPolarHBondContact CA-O 3.45Å; T422-Q432 WeakPolarHBondContact CG2-O 3.39Å; A423-Q432 PolarHBondContact N-O 3.42Å; A423-Q432 PolarHBondContact O-N 3.05Å; Q432-R443 HydrophobicContact CG-CG 3.99Å; Q432-S444 PolarHBondContact NE2-O 2.92Å; Q432-W447 HydrophobicContact CB-CD2 3.93Å; Q432-W447 HydrophobicContact CB-CE3 3.65Å; Q432-W447 HydrophobicContact CB-CH2 4Å; Q432-W447 HydrophobicContact CB-CZ2 4.26Å; Q432-W447 HydrophobicContact CB-CZ3 3.67Å
433	S	96	Very high	90.2	Very high	2 Å²	2	67.3 Å²	67.3	1%	0.014	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	145.9	-177.8	-153.7	0	0	0	0	111.2	E421 T422 A454 E455 S458	E421-S433 CarbonylContact O-C 3.56Å; E421-S433 WeakPolarHBondContact O-CA 3.46Å; E421-S433 PolarHBondContact O-OG 3.45Å; T422-S433 PolarHBondContact OG1-OG 3.19Å; S433-A454 VanDerWaalsContact CB-C 3.43Å; S433-A454 WeakPolarHBondContact CB-O 3.23Å; S433-E455 WeakPolarHBondContact OG-CG 3.37Å; S433-S458 WeakPolarHBondContact O-CB 3.4Å
434	T	95.8	Very high	90.1	Very high	6 Å²	6	64.9 Å²	64.9	4%	0.037	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	125.5	171.8	-50.4	0	0	0	0	107.8	V384 Y420 E421 K441 Y442 R443	V384-T434 HydrophobicContact CG1-CG2 4.19Å; Y420-T434 WeakPolarHBondContact CA-O 3.36Å; E421-T434 PolarHBondContact N-O 3.49Å; E421-T434 PolarHBondContact O-N 3.43Å; T434-K441 HydrophobicContact CG2-CB 3.88Å; T434-K441 HydrophobicContact CG2-CD 4.42Å; T434-K441 HydrophobicContact CG2-CG 4.42Å; T434-Y442 CarbonylContact C-O 3.58Å; T434-Y442 WeakPolarHBondContact CA-O 3.37Å; T434-R443 HydrophobicContact CG2-CB 4.35Å; T434-R443 PolarHBondContact OG1-NE 3.41Å; T434-R443 PolarHBondContact OG1-NH2 3.36Å
435	V	96.6	Very high	89.9	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	134.3	174.7	66.5	0	0	0	0	110.4	L406 P418 Q419 Y420 V437 K441 Y442 S458 C462	L406-V435 HydrophobicContact CD2-CG1 4.44Å; L406-V435 HydrophobicContact CD2-CG2 4.09Å; P418-V435 HydrophobicContact CB-CG2 3.81Å; Q419-V435 CarbonylContact O-C 3.56Å; Q419-V435 VanDerWaalsContact O-CA 3.26Å; Q419-V435 WeakPolarHBondContact O-CA 3.31Å; Y420-V435 HydrophobicContact CD1-CB 3.82Å; Y420-V435 HydrophobicContact CD1-CG2 3.96Å; Y420-V435 HydrophobicContact CD2-CG2 4.23Å; Y420-V435 HydrophobicContact CE1-CB 3.58Å; Y420-V435 HydrophobicContact CE1-CG2 3.52Å; Y420-V435 HydrophobicContact CE2-CG2 3.81Å; Y420-V435 HydrophobicContact CG-CB 4.48Å; Y420-V435 HydrophobicContact CG-CG2 4.29Å; Y420-V435 VanDerWaalsContact CZ-CG2 3.42Å; V435-V437 HydrophobicContact CG2-CG2 4Å; V435-K441 CarbonylContact O-C 3.51Å; V435-K441 WeakPolarHBondContact O-CA 3.25Å; V435-Y442 HydrophobicContact CG1-CD2 4.33Å; V435-Y442 PolarHBondContact N-O 2.95Å; V435-Y442 PolarHBondContact O-N 3.28Å; V435-S458 VanDerWaalsContact CG1-O 3.28Å; V435-S458 WeakPolarHBondContact CG1-O 3.41Å; V435-C462 HydrophobicContact CG1-CB 3.87Å
436	T	95.4	Very high	89.8	Confident	27 Å²	27	62 Å²	62	17%	0.166	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	122.3	174.3	-53.4	0	0	0	0	109.6	Q419 K440 K441	Q419-T436 PolarHBondContact N-O 2.77Å; Q419-T436 PolarHBondContact O-N 2.72Å; T436-K440 CarbonylContact C-O 3.58Å; T436-K440 VanDerWaalsContact CA-O 3.31Å; T436-K440 WeakPolarHBondContact CA-O 3.4Å; T436-K441 HydrophobicContact CG2-CG 4.34Å
437	V	92.9	Very high	90.4	Very high	5 Å²	5	60.7 Å²	60.7	3%	0.03	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	128.7	176.1	-175	0	0	0	0	108.8	L406 W409 P418 V435 N439 K440 Y442	L406-V437 HydrophobicContact CD1-CG2 4.38Å; L406-V437 HydrophobicContact CD2-CG2 4.15Å; L406-V437 HydrophobicContact CG-CG2 4.46Å; W409-V437 HydrophobicContact CZ3-CG1 4.18Å; P418-V437 HydrophobicContact CB-CG2 3.85Å; P418-V437 HydrophobicContact CG-CG2 4Å; V435-V437 HydrophobicContact CG2-CG2 4Å; V437-N439 VanDerWaalsContact C-N 3.28Å; V437-N439 PolarHBondContact O-N 3.16Å; V437-K440 PolarHBondContact N-O 3.21Å; V437-K440 PolarHBondContact O-N 3.49Å; V437-Y442 HydrophobicContact CB-CE2 4.4Å
438	A	88.1	Confident	91	Very high	52 Å²	52	53.2 Å²	53.2	43%	0.43	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.4	45.5	-178.6	0	0	0	0	0	113.5	F415 K440	F415-A438 HydrophobicContact CD1-CB 3.82Å; F415-A438 HydrophobicContact CE1-CB 3.82Å; F415-A438 HydrophobicContact CG-CB 4.24Å; F415-A438 HydrophobicContact CZ-CB 4.24Å; A438-K440 PolarHBondContact O-N 3.23Å; A438-K440 VanDerWaalsContact O-N 3.15Å
439	N	87.3	Confident	91.4	Very high	158 Å²	158	55 Å²	55	85%	0.845	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.5	11.7	-176.5	-59	-24.9	0	0	0	115.9	V437	V437-N439 VanDerWaalsContact C-N 3.28Å; V437-N439 PolarHBondContact O-N 3.16Å
440	K	91.7	Very high	91.6	Very high	129 Å²	129	48 Å²	48	56%	0.561	24%	0.243	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-107.2	141.7	172.5	-65.9	-176.9	178.3	-178	0	110.5	T436 V437 A438 Y442	T436-K440 CarbonylContact C-O 3.58Å; T436-K440 VanDerWaalsContact CA-O 3.31Å; T436-K440 WeakPolarHBondContact CA-O 3.4Å; V437-K440 PolarHBondContact N-O 3.21Å; V437-K440 PolarHBondContact O-N 3.49Å; A438-K440 PolarHBondContact O-N 3.23Å; A438-K440 VanDerWaalsContact O-N 3.15Å; K440-Y442 HydrophobicContact CB-CE2 3.7Å; K440-Y442 WeakPolarHBondContact CB-OH 3.38Å; K440-Y442 WeakPolarHBondContact CD-OH 3.37Å
441	K	95.2	Very high	92	Very high	74 Å²	74	53 Å²	53	32%	0.322	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	137.3	-179.3	-63.8	-175.6	179	-174.4	0	110.8	V384 T385 T434 V435 T436	V384-K441 HydrophobicContact CB-CB 4.3Å; V384-K441 HydrophobicContact CG1-CB 4.19Å; V384-K441 HydrophobicContact CG2-CB 3.91Å; V384-K441 HydrophobicContact CG2-CD 4.14Å; T385-K441 PolarHBondContact N-O 3Å; T434-K441 HydrophobicContact CG2-CB 3.88Å; T434-K441 HydrophobicContact CG2-CD 4.42Å; T434-K441 HydrophobicContact CG2-CG 4.42Å; V435-K441 CarbonylContact O-C 3.51Å; V435-K441 WeakPolarHBondContact O-CA 3.25Å; T436-K441 HydrophobicContact CG2-CG 4.34Å
442	Y	95.1	Very high	92	Very high	6 Å²	6	57.2 Å²	57.2	2%	0.024	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	137.3	-179.5	-52.6	-90.5	0	0	0	110.4	T385 T434 V435 V437 K440 C462 V465	T385-Y442 HydrophobicContact CG2-CD1 4.32Å; T385-Y442 CarbonylContact O-C 3.49Å; T385-Y442 VanDerWaalsContact O-CA 3.31Å; T385-Y442 WeakPolarHBondContact O-CA 3.48Å; T434-Y442 CarbonylContact C-O 3.58Å; T434-Y442 WeakPolarHBondContact CA-O 3.37Å; V435-Y442 HydrophobicContact CG1-CD2 4.33Å; V435-Y442 PolarHBondContact N-O 2.95Å; V435-Y442 PolarHBondContact O-N 3.28Å; V437-Y442 HydrophobicContact CB-CE2 4.4Å; K440-Y442 HydrophobicContact CB-CE2 3.7Å; K440-Y442 WeakPolarHBondContact CB-OH 3.38Å; K440-Y442 WeakPolarHBondContact CD-OH 3.37Å; Y442-C462 HydrophobicContact CD1-CB 4.35Å; Y442-C462 HydrophobicContact CD2-CB 3.76Å; Y442-C462 WeakPolarHBondContact CD2-SG 3.26Å; Y442-C462 HydrophobicContact CE2-CB 4.34Å; Y442-C462 WeakPolarHBondContact CE2-SG 3.47Å; Y442-C462 HydrophobicContact CG-CB 3.76Å; Y442-V465 HydrophobicContact CD1-CB 4.18Å; Y442-V465 HydrophobicContact CD1-CG1 4.39Å; Y442-V465 HydrophobicContact CD1-CG2 4.22Å; Y442-V465 HydrophobicContact CE1-CB 3.87Å; Y442-V465 HydrophobicContact CE1-CG1 3.72Å; Y442-V465 HydrophobicContact CE1-CG2 4.34Å
443	R	94.4	Very high	92	Very high	80 Å²	80	59.6 Å²	59.6	30%	0.302	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	144	-175.1	169.5	-171.8	-64.9	178.9	6.2	111.1	V384 T385 T386 M387 Q432 T434	V384-R443 HydrophobicContact CG1-CB 3.7Å; T385-R443 PolarHBondContact O-N 3.2Å; T386-R443 VanDerWaalsContact CA-O 3.28Å; T386-R443 WeakPolarHBondContact CA-O 3.45Å; T386-R443 HydrophobicContact CG2-CB 4.23Å; M387-R443 PolarHBondContact N-O 3.08Å; Q432-R443 HydrophobicContact CG-CG 3.99Å; T434-R443 HydrophobicContact CG2-CB 4.35Å; T434-R443 PolarHBondContact OG1-NE 3.41Å; T434-R443 PolarHBondContact OG1-NH2 3.36Å
444	S	92	Very high	91.9	Very high	4 Å²	4	59.6 Å²	59.6	3%	0.028	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	132.7	164.6	-178.6	0	0	0	0	111	M387 V389 Q432 L446	M387-S444 VanDerWaalsContact O-CA 3.24Å; M387-S444 WeakPolarHBondContact O-CA 3.36Å; M387-S444 PolarHBondContact O-OG 3.27Å; V389-S444 PolarHBondContact N-OG 2.78Å; V389-S444 VanDerWaalsContact N-OG 3.15Å; V389-S444 WeakPolarHBondContact O-CB 3.38Å; V389-S444 PolarHBondContact O-OG 3.14Å; Q432-S444 PolarHBondContact NE2-O 2.92Å; S444-L446 PolarHBondContact O-N 2.84Å; S444-L446 PolarHBondContact OG-N 3.06Å
445	S	88	Confident	92	Very high	56 Å²	56	60.6 Å²	60.6	39%	0.392	30%	0.296	S	S	.	.	S	Bend	trans	-69.8	-13.8	173.1	58.9	0	0	0	0	113.1	M387 A388	M387-S445 PolarHBondContact O-N 2.9Å; A388-S445 WeakPolarHBondContact CA-OG 3.44Å; A388-S445 VanDerWaalsContact CB-OG 3.27Å; A388-S445 WeakPolarHBondContact CB-OG 3.34Å; A388-S445 PolarHBondContact N-OG 3.44Å
446	L	86.6	Confident	91.9	Very high	74 Å²	74	61 Å²	61	39%	0.387	30%	0.298	S	S	.	.	S	Bend	trans	-85	143.4	176.2	-55.2	-179.2	0	0	0	111.2	A388 K390 S444	A388-L446 HydrophobicContact CB-CD1 4.43Å; A388-L446 HydrophobicContact CB-CD2 4.21Å; A388-L446 HydrophobicContact CB-CG 4.11Å; K390-L446 HydrophobicContact CB-CD1 4.17Å; S444-L446 PolarHBondContact O-N 2.84Å; S444-L446 PolarHBondContact OG-N 3.06Å
447	W	88.5	Confident	91.8	Very high	89 Å²	89	59.7 Å²	59.7	34%	0.337	29%	0.29	S	S	.	.			trans	-94.9	139	175.2	-68.4	76.9	0	0	0	110.3	R425 A430 Q432	R425-W447 HydrophobicContact CB-CE3 3.86Å; R425-W447 HydrophobicContact CB-CH2 4.01Å; R425-W447 HydrophobicContact CB-CZ3 3.55Å; A430-W447 HydrophobicContact CB-CB 3.91Å; A430-W447 HydrophobicContact CB-CE3 4.28Å; Q432-W447 HydrophobicContact CB-CD2 3.93Å; Q432-W447 HydrophobicContact CB-CE3 3.65Å; Q432-W447 HydrophobicContact CB-CH2 4Å; Q432-W447 HydrophobicContact CB-CZ2 4.26Å; Q432-W447 HydrophobicContact CB-CZ3 3.67Å
448	E	90	Very high	92	Very high	10 Å²	10	59.4 Å²	59.4	5%	0.047	29%	0.289	C	S	.	.	B	Isolated β-bridge	trans	-116.1	148.8	-172.7	-73.5	-75.8	-167.3	0	0	112.1	K390 F391 A430 F431 S450 F453 A454	K390-E448 WeakPolarHBondContact CG-OE1 3.41Å; F391-E448 PolarHBondContact N-OE1 3.27Å; A430-E448 CarbonylContact C-O 3.6Å; A430-E448 WeakPolarHBondContact CA-O 3.17Å; F431-E448 PolarHBondContact N-O 3.47Å; F431-E448 PolarHBondContact O-N 3.45Å; E448-S450 PolarHBondContact O-N 3.48Å; E448-F453 HydrophobicContact CB-CB 4.23Å; E448-F453 HydrophobicContact CG-CB 4.28Å; E448-A454 HydrophobicContact CB-CB 4Å; E448-A454 HydrophobicContact CG-CB 4.43Å
449	K	86.6	Confident	92.3	Very high	120 Å²	120	57 Å²	57	52%	0.522	27%	0.268	S	S	.	.	S	Bend	trans	-73.3	-15.4	-179	-64	170.5	-166.8	158.4	0	113.6	P103 E105 F431	P103-K449 WeakPolarHBondContact O-CE 3.42Å; P103-K449 PolarHBondContact O-NZ 2.96Å; E105-K449 IonicContact OE1-NZ 2.93Å; F431-K449 WeakPolarHBondContact CE2-O 3.43Å
450	S	91.7	Very high	92.6	Very high	44 Å²	44	49.4 Å²	49.4	31%	0.308	23%	0.228	S	C	.	.	S	Bend	trans	-129.7	133.2	-177.2	175.1	0	0	0	0	110.3	E448 K452 F453 A454	E448-S450 PolarHBondContact O-N 3.48Å; S450-K452 PolarHBondContact O-N 3.02Å; S450-K452 PolarHBondContact OG-N 3.38Å; S450-F453 PolarHBondContact O-N 3.25Å; S450-A454 PolarHBondContact O-N 2.99Å
451	K	93.4	Very high	92.6	Very high	110 Å²	110	43.3 Å²	43.3	48%	0.478	20%	0.201	S	C	.	.	H	α-helix	trans	-49.9	-41.1	169.1	172.7	170.4	-179	-178.9	0	111.6	T422 F431 F453 A454 E455	T422-K451 HydrophobicContact CG2-CG 4.08Å; F431-K451 HydrophobicContact CD1-CB 3.95Å; F431-K451 HydrophobicContact CE1-CB 4.22Å; F431-K451 HydrophobicContact CG-CB 4.18Å; K451-F453 VanDerWaalsContact C-N 3.33Å; K451-F453 PolarHBondContact O-N 3.46Å; K451-A454 PolarHBondContact O-N 3.04Å; K451-E455 WeakPolarHBondContact CE-OE1 3.41Å; K451-E455 WeakPolarHBondContact O-CG 3.37Å; K451-E455 PolarHBondContact O-N 3.5Å; K451-E455 VanDerWaalsContact O-N 3.07Å
452	K	93.4	Very high	92.5	Very high	130 Å²	130	39.8 Å²	39.8	57%	0.565	19%	0.186	S	C	*	.	H	α-helix	trans	-61.5	-42.4	178.8	-174.3	179.1	178.5	180	0	111.2	S450 Q456	S450-K452 PolarHBondContact O-N 3.02Å; S450-K452 PolarHBondContact OG-N 3.38Å; K452-Q456 VanDerWaalsContact O-CG 3.31Å; K452-Q456 WeakPolarHBondContact O-CG 3.37Å; K452-Q456 PolarHBondContact O-N 3.14Å
453	F	93.4	Very high	92.3	Very high	75 Å²	75	39.5 Å²	39.5	33%	0.329	19%	0.185	S	C	.	.	H	α-helix	trans	-73.8	-37.9	-178.8	-73.3	9.5	0	0	0	111.4	F391 E448 S450 K451 E455 Q456 A457	F391-F453 HydrophobicContact CD1-CB 4.43Å; F391-F453 AromaticContact CD1-CD1 3.8Å; F391-F453 HydrophobicContact CD1-CD1 3.8Å; F391-F453 HydrophobicContact CD1-CD2 4.49Å; F391-F453 HydrophobicContact CD1-CE1 4.14Å; F391-F453 HydrophobicContact CD1-CG 4Å; F391-F453 HydrophobicContact CE1-CD1 4.05Å; F391-F453 HydrophobicContact CE1-CE1 4Å; E448-F453 HydrophobicContact CB-CB 4.23Å; E448-F453 HydrophobicContact CG-CB 4.28Å; S450-F453 PolarHBondContact O-N 3.25Å; K451-F453 VanDerWaalsContact C-N 3.33Å; K451-F453 PolarHBondContact O-N 3.46Å; F453-E455 VanDerWaalsContact C-N 3.3Å; F453-E455 PolarHBondContact O-N 3.04Å; F453-Q456 PolarHBondContact O-N 3.43Å; F453-Q456 VanDerWaalsContact O-N 3.12Å; F453-A457 WeakPolarHBondContact O-CB 3.47Å; F453-A457 PolarHBondContact O-N 3.35Å
454	A	94.2	Very high	92.2	Very high	3 Å²	3	39.4 Å²	39.4	3%	0.025	19%	0.185	C	C	.	.	H	α-helix	trans	-56.1	-44.6	173.1	0	0	0	0	0	111.9	F431 S433 E448 S450 K451 A457 S458	F431-A454 HydrophobicContact CB-CB 3.93Å; S433-A454 VanDerWaalsContact CB-C 3.43Å; S433-A454 WeakPolarHBondContact CB-O 3.23Å; E448-A454 HydrophobicContact CB-CB 4Å; E448-A454 HydrophobicContact CG-CB 4.43Å; S450-A454 PolarHBondContact O-N 2.99Å; K451-A454 PolarHBondContact O-N 3.04Å; A454-A457 PolarHBondContact O-N 3.43Å; A454-S458 PolarHBondContact O-N 3.25Å; A454-S458 PolarHBondContact O-OG 3.25Å
455	E	96.6	Very high	92	Very high	26 Å²	26	41.7 Å²	41.7	12%	0.121	20%	0.198	C	C	.	.	H	α-helix	trans	-65.8	-37.8	176.7	-70.2	174.1	177.9	0	0	112.5	K403 Y420 S433 K451 F453 S458 A459	K403-E455 HydrophobicContact CD-CB 4.37Å; K403-E455 IonicContact NZ-OE2 3.23Å; K403-E455 PolarHBondContact NZ-OE2 3.36Å; Y420-E455 HydrophobicContact CD1-CB 3.84Å; Y420-E455 HydrophobicContact CD1-CG 3.89Å; Y420-E455 HydrophobicContact CE1-CB 4.14Å; Y420-E455 VanDerWaalsContact CE1-O 3.28Å; Y420-E455 WeakPolarHBondContact CE1-O 3.45Å; Y420-E455 HydrophobicContact CG-CG 4.23Å; S433-E455 WeakPolarHBondContact OG-CG 3.37Å; K451-E455 WeakPolarHBondContact CE-OE1 3.41Å; K451-E455 WeakPolarHBondContact O-CG 3.37Å; K451-E455 PolarHBondContact O-N 3.5Å; K451-E455 VanDerWaalsContact O-N 3.07Å; F453-E455 VanDerWaalsContact C-N 3.3Å; F453-E455 PolarHBondContact O-N 3.04Å; E455-S458 PolarHBondContact O-OG 2.92Å; E455-A459 WeakPolarHBondContact O-CB 3.32Å; E455-A459 PolarHBondContact O-N 3.38Å; E455-A459 VanDerWaalsContact O-N 3.08Å
456	Q	96.1	Very high	91.9	Very high	8 Å²	8	42 Å²	42	4%	0.037	20%	0.195	C	C	.	.	H	α-helix	trans	-65.6	-44	174.4	-62.1	-62.4	-23.6	0	0	111	F391 P402 K403 K452 F453 S458 A459 I460	F391-Q456 HydrophobicContact CB-CB 3.69Å; F391-Q456 HydrophobicContact CD1-CB 3.83Å; F391-Q456 HydrophobicContact CD1-CG 3.98Å; F391-Q456 HydrophobicContact CD2-CB 3.58Å; F391-Q456 HydrophobicContact CD2-CG 4.16Å; F391-Q456 HydrophobicContact CE1-CB 4.37Å; F391-Q456 HydrophobicContact CE1-CG 4.08Å; F391-Q456 HydrophobicContact CE2-CB 4.15Å; F391-Q456 HydrophobicContact CE2-CG 4.25Å; F391-Q456 HydrophobicContact CG-CB 3.39Å; F391-Q456 HydrophobicContact CG-CG 4.02Å; F391-Q456 HydrophobicContact CZ-CG 4.21Å; P402-Q456 VanDerWaalsContact CD-OE1 3.28Å; K403-Q456 VanDerWaalsContact CB-OE1 3.26Å; K452-Q456 VanDerWaalsContact O-CG 3.31Å; K452-Q456 WeakPolarHBondContact O-CG 3.37Å; K452-Q456 PolarHBondContact O-N 3.14Å; F453-Q456 PolarHBondContact O-N 3.43Å; F453-Q456 VanDerWaalsContact O-N 3.12Å; Q456-S458 PolarHBondContact O-N 2.78Å; Q456-A459 WeakPolarHBondContact O-CB 3.38Å; Q456-A459 PolarHBondContact O-N 3.07Å; Q456-A459 VanDerWaalsContact O-N 3.14Å; Q456-I460 WeakPolarHBondContact O-CG1 3.36Å; Q456-I460 PolarHBondContact O-N 3.45Å
457	A	93.5	Very high	91.9	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-59.1	-45.8	178	0	0	0	0	0	111.7	F453 A454 A459 I460 V461	F453-A457 WeakPolarHBondContact O-CB 3.47Å; F453-A457 PolarHBondContact O-N 3.35Å; A454-A457 PolarHBondContact O-N 3.43Å; A457-A459 VanDerWaalsContact C-N 3.32Å; A457-A459 PolarHBondContact O-N 2.88Å; A457-I460 WeakPolarHBondContact O-CB 3.25Å; A457-I460 PolarHBondContact O-N 3.21Å; A457-V461 WeakPolarHBondContact O-CG2 3.14Å; A457-V461 PolarHBondContact O-N 2.94Å; A457-V461 VanDerWaalsContact O-N 3.09Å
458	S	95.3	Very high	91.7	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-64.7	-34.9	175.4	58.9	0	0	0	0	113	S433 V435 A454 E455 Q456 I460 V461 C462	S433-S458 WeakPolarHBondContact O-CB 3.4Å; V435-S458 VanDerWaalsContact CG1-O 3.28Å; V435-S458 WeakPolarHBondContact CG1-O 3.41Å; A454-S458 PolarHBondContact O-N 3.25Å; A454-S458 PolarHBondContact O-OG 3.25Å; E455-S458 PolarHBondContact O-OG 2.92Å; Q456-S458 PolarHBondContact O-N 2.78Å; S458-I460 VanDerWaalsContact C-N 3.34Å; S458-V461 PolarHBondContact O-N 3.36Å; S458-C462 PolarHBondContact O-N 2.81Å; S458-C462 VanDerWaalsContact O-N 3.11Å
459	A	95.1	Very high	91.5	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-64.2	-39.8	174.1	0	0	0	0	0	111.7	P402 K403 L406 Y420 E455 Q456 A457 C462 L463	P402-A459 HydrophobicContact CB-CB 4.19Å; K403-A459 HydrophobicContact CB-CB 4.41Å; L406-A459 HydrophobicContact CB-CB 4.42Å; L406-A459 HydrophobicContact CD2-CB 3.88Å; Y420-A459 HydrophobicContact CE1-CB 4.36Å; Y420-A459 WeakPolarHBondContact OH-CB 3.26Å; E455-A459 WeakPolarHBondContact O-CB 3.32Å; E455-A459 PolarHBondContact O-N 3.38Å; E455-A459 VanDerWaalsContact O-N 3.08Å; Q456-A459 WeakPolarHBondContact O-CB 3.38Å; Q456-A459 PolarHBondContact O-N 3.07Å; Q456-A459 VanDerWaalsContact O-N 3.14Å; A457-A459 VanDerWaalsContact C-N 3.32Å; A457-A459 PolarHBondContact O-N 2.88Å; A459-C462 WeakPolarHBondContact O-CB 3.43Å; A459-C462 PolarHBondContact O-N 3.47Å; A459-L463 WeakPolarHBondContact O-CG 3.37Å; A459-L463 PolarHBondContact O-N 2.75Å
460	I	93.1	Very high	91.5	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-61.2	-46.3	174.7	-63.7	163.3	0	0	0	110.9	V389 F391 Y396 P402 Q456 A457 S458 C462 L463 R464 E470	V389-I460 HydrophobicContact CG1-CB 3.9Å; V389-I460 HydrophobicContact CG1-CD1 4.03Å; V389-I460 HydrophobicContact CG1-CG2 3.56Å; F391-I460 HydrophobicContact CB-CD1 4.14Å; F391-I460 HydrophobicContact CD2-CD1 4.09Å; Y396-I460 WeakPolarHBondContact OH-CD1 3.34Å; P402-I460 HydrophobicContact CB-CG1 3.61Å; P402-I460 HydrophobicContact CG-CD1 4Å; P402-I460 HydrophobicContact CG-CG1 3.54Å; Q456-I460 WeakPolarHBondContact O-CG1 3.36Å; Q456-I460 PolarHBondContact O-N 3.45Å; A457-I460 WeakPolarHBondContact O-CB 3.25Å; A457-I460 PolarHBondContact O-N 3.21Å; S458-I460 VanDerWaalsContact C-N 3.34Å; I460-C462 VanDerWaalsContact C-N 3.28Å; I460-C462 PolarHBondContact O-N 3.49Å; I460-L463 PolarHBondContact O-N 3.12Å; I460-R464 HydrophobicContact CG2-CG 4.05Å; I460-R464 WeakPolarHBondContact O-CG 3.06Å; I460-R464 PolarHBondContact O-N 2.79Å; I460-E470 WeakPolarHBondContact CG2-OE2 3.46Å
461	V	92.1	Very high	91	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-55.8	-46.8	177.2	177.5	0	0	0	0	110.5	M387 V389 A457 S458 L463 R464 V465	M387-V461 HydrophobicContact CB-CG1 3.98Å; M387-V461 HydrophobicContact CB-CG2 4.02Å; M387-V461 HydrophobicContact CG-CG1 4.03Å; M387-V461 HydrophobicContact SD-CG1 3.99Å; V389-V461 HydrophobicContact CB-CG2 3.99Å; V389-V461 HydrophobicContact CG2-CG2 3.86Å; A457-V461 WeakPolarHBondContact O-CG2 3.14Å; A457-V461 PolarHBondContact O-N 2.94Å; A457-V461 VanDerWaalsContact O-N 3.09Å; S458-V461 PolarHBondContact O-N 3.36Å; V461-L463 PolarHBondContact O-N 2.93Å; V461-R464 PolarHBondContact O-N 3.47Å; V461-V465 HydrophobicContact CG1-CG2 4.34Å; V461-V465 WeakPolarHBondContact O-CG2 3.35Å; V461-V465 PolarHBondContact O-N 3.16Å
462	C	93.5	Very high	90.5	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-58	-49.9	176.6	-172.9	0	0	0	0	112.2	L406 V435 Y442 S458 A459 I460 R464 V465 L466	L406-C462 HydrophobicContact CD1-CB 4.33Å; L406-C462 HydrophobicContact CD2-CB 3.87Å; V435-C462 HydrophobicContact CG1-CB 3.87Å; Y442-C462 HydrophobicContact CD1-CB 4.35Å; Y442-C462 HydrophobicContact CD2-CB 3.76Å; Y442-C462 WeakPolarHBondContact CD2-SG 3.26Å; Y442-C462 HydrophobicContact CE2-CB 4.34Å; Y442-C462 WeakPolarHBondContact CE2-SG 3.47Å; Y442-C462 HydrophobicContact CG-CB 3.76Å; S458-C462 PolarHBondContact O-N 2.81Å; S458-C462 VanDerWaalsContact O-N 3.11Å; A459-C462 WeakPolarHBondContact O-CB 3.43Å; A459-C462 PolarHBondContact O-N 3.47Å; I460-C462 VanDerWaalsContact C-N 3.28Å; I460-C462 PolarHBondContact O-N 3.49Å; C462-R464 PolarHBondContact O-N 2.8Å; C462-V465 PolarHBondContact O-N 3.21Å; C462-L466 WeakPolarHBondContact O-CB 3.41Å; C462-L466 WeakPolarHBondContact O-CD1 3.16Å; C462-L466 WeakPolarHBondContact O-CG 3.42Å; C462-L466 PolarHBondContact O-N 3.48Å; C462-L466 VanDerWaalsContact SG-CD1 3.56Å
463	L	91.7	Very high	89.7	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-62.7	-43.9	-178	-70.5	167.5	0	0	0	112.1	P402 F405 L406 A459 I460 V461 L466 G467 V468 E470	P402-L463 HydrophobicContact CB-CD1 4.39Å; F405-L463 HydrophobicContact CB-CD1 4.18Å; L406-L463 HydrophobicContact CB-CD1 4.15Å; L406-L463 HydrophobicContact CB-CD2 4.15Å; L406-L463 HydrophobicContact CB-CG 4.17Å; L406-L463 HydrophobicContact CD1-CD2 3.75Å; L406-L463 HydrophobicContact CD1-CG 4.08Å; A459-L463 WeakPolarHBondContact O-CG 3.37Å; A459-L463 PolarHBondContact O-N 2.75Å; I460-L463 PolarHBondContact O-N 3.12Å; V461-L463 PolarHBondContact O-N 2.93Å; L463-L466 CarbonylContact O-C 3.53Å; L463-L466 PolarHBondContact O-N 2.89Å; L463-G467 PolarHBondContact O-N 3.25Å; L463-V468 HydrophobicContact CD2-CB 3.97Å; L463-V468 HydrophobicContact CD2-CG1 3.83Å; L463-V468 PolarHBondContact O-N 3.19Å; L463-E470 HydrophobicContact CB-CB 4.45Å; L463-E470 HydrophobicContact CD1-CB 4.14Å
464	R	90.4	Very high	88.5	Confident	79 Å²	79	31.4 Å²	31.4	30%	0.298	20%	0.196	S	C	.	.	H	α-helix	trans	-63.1	-43.7	177.4	-71.2	-177.4	-174.4	-174	2	112.7	M387 I460 V461 C462 L466 G467 E470	M387-R464 HydrophobicContact CE-CB 4.03Å; M387-R464 HydrophobicContact SD-CB 4.31Å; I460-R464 HydrophobicContact CG2-CG 4.05Å; I460-R464 WeakPolarHBondContact O-CG 3.06Å; I460-R464 PolarHBondContact O-N 2.79Å; V461-R464 PolarHBondContact O-N 3.47Å; C462-R464 PolarHBondContact O-N 2.8Å; R464-L466 VanDerWaalsContact C-N 3.26Å; R464-L466 PolarHBondContact O-N 2.89Å; R464-G467 PolarHBondContact O-N 3.32Å; R464-G467 VanDerWaalsContact O-N 3.11Å; R464-E470 IonicContact CZ-OE2 3.56Å; R464-E470 VanDerWaalsContact CZ-OE2 3.3Å; R464-E470 IonicContact NE-OE2 2.74Å; R464-E470 PolarHBondContact NE-OE2 2.66Å; R464-E470 IonicContact NH2-OE1 3.46Å; R464-E470 PolarHBondContact NH2-OE1 3.38Å; R464-E470 IonicContact NH2-OE2 2.74Å; R464-E470 PolarHBondContact NH2-OE2 3.11Å
465	V	88.1	Confident	87.4	Confident	51 Å²	51	35 Å²	35	31%	0.309	21%	0.212	S	C	.	.	H	α-helix	trans	-65.2	-34.2	178.1	175.7	0	0	0	0	111.4	P378 T385 M387 Y442 V461 C462 G467	P378-V465 HydrophobicContact CB-CG2 3.85Å; P378-V465 HydrophobicContact CG-CG2 4.23Å; T385-V465 HydrophobicContact CG2-CG1 4.34Å; T385-V465 HydrophobicContact CG2-CG2 3.77Å; M387-V465 HydrophobicContact SD-CG2 3.56Å; M387-V465 VanDerWaalsContact SD-CG2 3.56Å; Y442-V465 HydrophobicContact CD1-CB 4.18Å; Y442-V465 HydrophobicContact CD1-CG1 4.39Å; Y442-V465 HydrophobicContact CD1-CG2 4.22Å; Y442-V465 HydrophobicContact CE1-CB 3.87Å; Y442-V465 HydrophobicContact CE1-CG1 3.72Å; Y442-V465 HydrophobicContact CE1-CG2 4.34Å; V461-V465 HydrophobicContact CG1-CG2 4.34Å; V461-V465 WeakPolarHBondContact O-CG2 3.35Å; V461-V465 PolarHBondContact O-N 3.16Å; C462-V465 PolarHBondContact O-N 3.21Å; V465-G467 VanDerWaalsContact C-N 3.26Å; V465-G467 PolarHBondContact O-N 2.72Å
466	L	87.6	Confident	85.4	Confident	62 Å²	62	42.5 Å²	42.5	33%	0.325	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79	-7.5	176.3	-65.8	168	0	0	0	113.3	W409 C462 L463 R464 V468	W409-L466 HydrophobicContact CE3-CD1 4.28Å; W409-L466 HydrophobicContact CH2-CD1 3.47Å; W409-L466 VanDerWaalsContact CH2-CD1 3.47Å; W409-L466 HydrophobicContact CH2-CD2 4.23Å; W409-L466 HydrophobicContact CH2-CG 4.34Å; W409-L466 HydrophobicContact CZ2-CD1 4.13Å; W409-L466 HydrophobicContact CZ3-CD1 3.56Å; C462-L466 WeakPolarHBondContact O-CB 3.41Å; C462-L466 WeakPolarHBondContact O-CD1 3.16Å; C462-L466 WeakPolarHBondContact O-CG 3.42Å; C462-L466 PolarHBondContact O-N 3.48Å; C462-L466 VanDerWaalsContact SG-CD1 3.56Å; L463-L466 CarbonylContact O-C 3.53Å; L463-L466 PolarHBondContact O-N 2.89Å; R464-L466 VanDerWaalsContact C-N 3.26Å; R464-L466 PolarHBondContact O-N 2.89Å; L466-V468 VanDerWaalsContact C-N 3.28Å; L466-V468 HydrophobicContact CB-CG2 3.79Å; L466-V468 PolarHBondContact O-N 3.11Å
467	G	85	Confident	83.6	Confident	68 Å²	68	48.4 Å²	48.4	70%	0.701	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.9	27.1	-175.5	0	0	0	0	0	113.4	L463 R464 V465	L463-G467 PolarHBondContact O-N 3.25Å; R464-G467 PolarHBondContact O-N 3.32Å; R464-G467 VanDerWaalsContact O-N 3.11Å; V465-G467 VanDerWaalsContact C-N 3.26Å; V465-G467 PolarHBondContact O-N 2.72Å
468	V	85.9	Confident	81.9	Confident	23 Å²	23	50.4 Å²	50.4	14%	0.139	29%	0.293	C	S	.	.			trans	-103.3	141.2	-177.3	-178.4	0	0	0	0	109.4	W409 L463 L466	W409-V468 VanDerWaalsContact CD1-CG1 3.48Å; W409-V468 HydrophobicContact CD2-CG2 4.35Å; W409-V468 HydrophobicContact CG-CG1 3.94Å; W409-V468 HydrophobicContact CZ2-CG2 3.99Å; L463-V468 HydrophobicContact CD2-CB 3.97Å; L463-V468 HydrophobicContact CD2-CG1 3.83Å; L463-V468 PolarHBondContact O-N 3.19Å; L466-V468 VanDerWaalsContact C-N 3.28Å; L466-V468 HydrophobicContact CB-CG2 3.79Å; L466-V468 PolarHBondContact O-N 3.11Å
469	P	84	Confident	80	Confident	52 Å²	52	53 Å²	53	34%	0.338	32%	0.32	S	S	.	.			trans	-53.8	141.7	174.7	-26.6	34.7	0	0	0	113	F405	F405-P469 WeakPolarHBondContact CD1-O 3.42Å
470	E	86.5	Confident	78.3	Confident	7 Å²	7	54.4 Å²	54.4	3%	0.033	33%	0.327	C	S	.	.			trans	-95.8	-2	-179.4	61.6	178.1	-127.4	0	0	113.8	Y396 I460 L463 R464 R472 E475	Y396-E470 HydrophobicContact CE1-CB 4.49Å; Y396-E470 HydrophobicContact CE1-CG 4.15Å; Y396-E470 PolarHBondContact OH-OE1 2.93Å; I460-E470 WeakPolarHBondContact CG2-OE2 3.46Å; L463-E470 HydrophobicContact CB-CB 4.45Å; L463-E470 HydrophobicContact CD1-CB 4.14Å; R464-E470 IonicContact CZ-OE2 3.56Å; R464-E470 VanDerWaalsContact CZ-OE2 3.3Å; R464-E470 IonicContact NE-OE2 2.74Å; R464-E470 PolarHBondContact NE-OE2 2.66Å; R464-E470 IonicContact NH2-OE1 3.46Å; R464-E470 PolarHBondContact NH2-OE1 3.38Å; R464-E470 IonicContact NH2-OE2 2.74Å; R464-E470 PolarHBondContact NH2-OE2 3.11Å; E470-R472 HydrophobicContact CG-CB 4.07Å; E470-R472 IonicContact OE1-CZ 3.3Å; E470-R472 VanDerWaalsContact OE1-CZ 3.24Å; E470-R472 IonicContact OE1-NE 3.24Å; E470-R472 PolarHBondContact OE1-NE 3.35Å; E470-R472 IonicContact OE1-NH2 3.93Å; E470-R472 PolarHBondContact OE1-NH2 2.85Å; E470-E475 PolarHBondContact N-OE2 2.88Å
471	G	81.2	Confident	76.6	Confident	6 Å²	6	55.8 Å²	55.8	6%	0.062	34%	0.335	C	S	.	.			trans	80.4	26.7	-179.5	0	0	0	0	0	112.9	Y396 P397 E475	Y396-G471 WeakPolarHBondContact CD1-O 3.41Å; P397-G471 VanDerWaalsContact CD-O 3.31Å; P397-G471 WeakPolarHBondContact CD-O 3.41Å; G471-E475 PolarHBondContact N-OE2 3.48Å
472	R	84.4	Confident	74.4	Confident	85 Å²	85	61.2 Å²	61.2	32%	0.321	37%	0.372	S	S	.	.			trans	-70.8	149.7	-180	-172.9	-179.6	-75.9	-128	-18.4	110.4	D395 Y396 E470 G474 E475	D395-R472 HydrophobicContact CB-CG 4.38Å; D395-R472 WeakPolarHBondContact O-CG 3.35Å; D395-R472 IonicContact OD2-CZ 3.64Å; D395-R472 IonicContact OD2-NH1 2.81Å; D395-R472 IonicContact OD2-NH2 3.52Å; Y396-R472 HydrophobicContact CE1-CB 4.17Å; E470-R472 HydrophobicContact CG-CB 4.07Å; E470-R472 IonicContact OE1-CZ 3.3Å; E470-R472 VanDerWaalsContact OE1-CZ 3.24Å; E470-R472 IonicContact OE1-NE 3.24Å; E470-R472 PolarHBondContact OE1-NE 3.35Å; E470-R472 IonicContact OE1-NH2 3.93Å; E470-R472 PolarHBondContact OE1-NH2 2.85Å; R472-G474 PolarHBondContact O-N 2.98Å; R472-E475 HydrophobicContact CB-CG 4.11Å; R472-E475 PolarHBondContact N-OE2 2.78Å; R472-E475 PolarHBondContact O-N 3.43Å; R472-E475 VanDerWaalsContact O-N 3.16Å
473	I	75.4	Confident	72	Confident	108 Å²	108	69 Å²	69	55%	0.554	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	120.8	173.7	-62.1	170.4	0	0	0	108.5	R394 D395 P397	R394-I473 WeakPolarHBondContact O-CD1 3.32Å; D395-I473 WeakPolarHBondContact O-CG1 3.32Å; D395-I473 PolarHBondContact O-N 3.33Å; P397-I473 HydrophobicContact CG-CG1 4.08Å
474	G	68.1	Low	69.4	Low	82 Å²	82	80.8 Å²	80.8	85%	0.845	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	101.6	-7.2	-179.1	0	0	0	0	0	115.3	R472	R472-G474 PolarHBondContact O-N 2.98Å
475	E	71.1	Confident	66.7	Low	77 Å²	77	86 Å²	86	36%	0.36	48%	0.475	S	S	.	.	S	Bend	trans	-73.8	140.6	166.3	-70.6	-179.7	160.2	0	0	110.3	E470 G471 R472	E470-E475 PolarHBondContact N-OE2 2.88Å; G471-E475 PolarHBondContact N-OE2 3.48Å; R472-E475 HydrophobicContact CB-CG 4.11Å; R472-E475 PolarHBondContact N-OE2 2.78Å; R472-E475 PolarHBondContact O-N 3.43Å; R472-E475 VanDerWaalsContact O-N 3.16Å
476	E	56.3	Low	64	Low	185 Å²	185	95.5 Å²	95.5	86%	0.864	51%	0.505	S	S	*	.			trans	-55.5	141.1	174.8	-67.8	-173.1	171.3	0	0	110.6	S478	E476-S478 PolarHBondContact O-N 3.18Å
477	D	57	Low	61.2	Low	132 Å²	132	100.9 Å²	100.9	71%	0.706	53%	0.529	S	S	*	.			trans	-64.5	96.7	-174.9	-162.9	-7.8	0	0	0	110.3	G479	D477-G479 PolarHBondContact O-N 2.72Å; D477-G479 PolarHBondContact OD1-N 3.02Å
478	S	58.4	Low	58.7	Low	42 Å²	42	101.3 Å²	101.3	29%	0.294	53%	0.533	S	S	.	.			trans	-60.6	-9.2	179.4	63.9	0	0	0	0	114.4	F405 E476 L480	F405-S478 WeakPolarHBondContact CE1-OG 3.48Å; F405-S478 VanDerWaalsContact CZ-OG 3.28Å; F405-S478 WeakPolarHBondContact CZ-OG 3.11Å; E476-S478 PolarHBondContact O-N 3.18Å; S478-L480 PolarHBondContact O-N 2.99Å; S478-L480 VanDerWaalsContact O-N 3.14Å; S478-L480 PolarHBondContact OG-N 3.27Å
479	G	56.2	Low	55.9	Low	55 Å²	55	109.7 Å²	109.7	57%	0.567	57%	0.568	S	S	*	*	S	Bend	trans	67.6	6.9	-176.4	0	0	0	0	0	114.3	D477	D477-G479 PolarHBondContact O-N 2.72Å; D477-G479 PolarHBondContact OD1-N 3.02Å
480	L	58.3	Low	53.3	Low	29 Å²	29	113 Å²	113	15%	0.152	59%	0.589	C	S	.	*			trans	-77.5	-23.1	-175	-72.7	168.8	0	0	0	113.7	F405 K412 S478	F405-L480 HydrophobicContact CD1-CD1 4.15Å; F405-L480 HydrophobicContact CE1-CB 4.07Å; F405-L480 HydrophobicContact CE1-CD1 3.9Å; F405-L480 HydrophobicContact CZ-CB 4.42Å; K412-L480 HydrophobicContact CD-CD2 3.54Å; S478-L480 PolarHBondContact O-N 2.99Å; S478-L480 VanDerWaalsContact O-N 3.14Å; S478-L480 PolarHBondContact OG-N 3.27Å
481	V	57	Low	50.6	Low	28 Å²	28	120.6 Å²	120.6	17%	0.17	63%	0.63	C	S	.	*	S	Bend	trans	-127.7	94.4	-178.5	-174.5	0	0	0	0	109.7	I400 F405 E408 K483	I400-V481 HydrophobicContact CG1-CG1 4.47Å; F405-V481 HydrophobicContact CD2-CG2 3.62Å; F405-V481 HydrophobicContact CE2-CB 4.23Å; F405-V481 HydrophobicContact CE2-CG2 3.57Å; F405-V481 HydrophobicContact CG-CG2 4.31Å; F405-V481 HydrophobicContact CZ-CG2 4.24Å; E408-V481 HydrophobicContact CG-CG2 4.36Å; V481-K483 PolarHBondContact O-N 2.97Å
482	C	46.8	Very low	47.9	Very low	115 Å²	115	125.9 Å²	125.9	78%	0.777	67%	0.666	S	S	*	*			trans	-59.6	123.5	174.8	-79.6	0	0	0	0	111	R484	C482-R484 PolarHBondContact O-N 2.95Å
483	K	43	Very low	45.1	Very low	162 Å²	162	127.5 Å²	127.5	70%	0.704	69%	0.689	S	S	*	*			trans	-56	105.3	164.3	-68.9	175.5	-177.9	168	0	107.6	V481 K485	V481-K483 PolarHBondContact O-N 2.97Å; K483-K485 PolarHBondContact O-N 3.46Å
484	R	37.2	Very low	42.6	Very low	248 Å²	248	127.5 Å²	127.5	94%	0.936	70%	0.699	S	S	*	*			trans	-61.9	100.9	169.7	-77.1	-172	-131.4	176.5	2.7	108.1	C482 R486	C482-R484 PolarHBondContact O-N 2.95Å; R484-R486 PolarHBondContact O-N 3.43Å
485	K	32.2	Very low	40.6	Very low	189 Å²	189	131.8 Å²	131.8	82%	0.822	70%	0.697	S	S	*	*			trans	-65.5	109.4	166.8	-136.3	179.6	-176.7	-177.3	0	106	K483 E487	K483-K485 PolarHBondContact O-N 3.46Å; K485-E487 VanDerWaalsContact C-N 3.33Å; K485-E487 PolarHBondContact O-N 3.48Å
486	R	32.2	Very low	38.4	Very low	250 Å²	250	136.9 Å²	136.9	94%	0.943	72%	0.721	S	S	*	*			trans	-70.5	97.6	167.5	-128.4	179.4	-178.3	175.7	-1.1	105.6	R484 G488	R484-R486 PolarHBondContact O-N 3.43Å; R486-G488 PolarHBondContact O-N 3.09Å; R486-G488 VanDerWaalsContact O-N 3.16Å
487	E	29.7	Very low	36.9	Very low	175 Å²	175	131.9 Å²	131.9	82%	0.818	72%	0.718	S	S	*	*			trans	-66.4	110.4	169.9	-71.5	-175.4	162.2	0	0	108	K485	K485-E487 VanDerWaalsContact C-N 3.33Å; K485-E487 PolarHBondContact O-N 3.48Å
488	G	32.2	Very low	35.4	Very low	77 Å²	77	136.3 Å²	136.3	79%	0.794	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-69.8	124.9	165.4	0	0	0	0	0	108.6	R486	R486-G488 PolarHBondContact O-N 3.09Å; R486-G488 VanDerWaalsContact O-N 3.16Å
489	K	26.6	Very low	33.9	Very low	200 Å²	200	140.3 Å²	140.3	87%	0.87	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-91.3	146.6	162.7	-91.8	-174.2	175.1	-179.5	0	110
490	P	30.5	Very low	32.6	Very low	120 Å²	120	145.7 Å²	145.7	78%	0.779	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-86.1	158.9	-163.8	5.8	14.5	0	0	0	112.3
491	N	28	Very low	31	Very low	167 Å²	167	151.9 Å²	151.9	89%	0.893	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-48.1	137.7	168.8	-89.9	-11.7	0	0	0	113.3
492	S	26.1	Very low	29.5	Very low	118 Å²	118	158.8 Å²	158.8	83%	0.825	82%	0.822	S	S	*	*			trans	-143.3	129.8	145.6	59.9	0	0	0	0	110
493	C	23.9	Very low	28.5	Very low	119 Å²	119	159.3 Å²	159.3	80%	0.804	81%	0.813	S	S	*	*			trans	-69.6	164.1	-175.9	-80.6	0	0	0	0	115.6
494	S	24.3	Very low	27.7	Very low	108 Å²	108	158.4 Å²	158.4	76%	0.755	82%	0.82	S	S	*	*			trans	83.7	119.8	140.8	48.1	0	0	0	0	122.3
495	E	25.2	Very low	27.1	Very low	172 Å²	172	152.2 Å²	152.2	80%	0.804	81%	0.806	S	S	*	*			trans	98.1	121.8	132.7	-77.4	-173.4	174	0	0	122.4
496	E	25.1	Very low	26.8	Very low	184 Å²	184	150.7 Å²	150.7	86%	0.86	81%	0.805	S	S	*	*			trans	52	126.4	141.4	-60.8	-163	150	0	0	122
497	G	25.1	Very low	26.5	Very low	79 Å²	79	146.6 Å²	146.6	81%	0.814	80%	0.801	S	S	*	*			trans	174.7	73.7	168.2	0	0	0	0	0	114.3
498	R	26.1	Very low	26.3	Very low	225 Å²	225	147 Å²	147	85%	0.849	80%	0.803	S	S	*	*			trans	-52.6	137.4	165	-114.7	173.6	173.2	171	0.1	111.2
499	S	27	Very low	26	Very low	126 Å²	126	153.1 Å²	153.1	88%	0.881	81%	0.811	S	S	*	*			trans	-154.5	113.8	143.5	-85.5	0	0	0	0	112.6
500	K	27.7	Very low	26	Very low	169 Å²	169	147.8 Å²	147.8	74%	0.735	80%	0.804	S	S	*	*			trans	-61.2	166.3	156.5	-69.4	173.8	176.5	175.5	0	108.8
501	K	25.6	Very low	25.7	Very low	159 Å²	159	151.5 Å²	151.5	69%	0.691	81%	0.811	S	S	*	*			cis	-173.7	153.9	2.8	-119.9	178.7	177.2	-166.6	0	103.5
502	L	25.5	Very low	25.9	Very low	173 Å²	173	147.9 Å²	147.9	91%	0.906	80%	0.804	S	S	*	*			trans	-159.4	108	135.8	-107.7	146.5	0	0	0	108.8
503	H	25.7	Very low	26.5	Very low	126 Å²	126	148.3 Å²	148.3	58%	0.583	80%	0.804	S	S	*	*			trans	-81.4	151.2	164.2	-93.3	14.2	0	0	0	109	D505	H503-D505 IonicContact CD2-OD1 2.77Å; H503-D505 IonicContact CD2-OD2 3.16Å; H503-D505 PolarHBondContact CD2-OD2 3.42Å
504	V	25.3	Very low	26.6	Very low	143 Å²	143	146.2 Å²	146.2	87%	0.867	80%	0.803	S	S	*	*			trans	-133.8	115.1	137.4	-178.8	0	0	0	0	107
505	D	25.8	Very low	28.5	Very low	118 Å²	118	147 Å²	147	63%	0.631	81%	0.805	S	S	*	*			trans	-84.2	151.9	173.1	-67.6	-54.3	0	0	0	110.9	H503	H503-D505 IonicContact CD2-OD1 2.77Å; H503-D505 IonicContact CD2-OD2 3.16Å; H503-D505 PolarHBondContact CD2-OD2 3.42Å
506	I	25.6	Very low	28.6	Very low	157 Å²	157	145 Å²	145	81%	0.805	81%	0.805	S	S	*	*			trans	-140.4	102	143	-61.6	-172.8	0	0	0	109.9
507	L	25	Very low	28.8	Very low	163 Å²	163	141.9 Å²	141.9	85%	0.853	80%	0.798	S	S	*	*			trans	53.5	116.6	136.9	-61.2	166.9	0	0	0	122.4
508	Q	26.7	Very low	29	Very low	185 Å²	185	145.5 Å²	145.5	86%	0.864	79%	0.794	S	S	*	*			trans	-81.1	159	148.9	-80.5	174	-42.4	0	0	110.7
509	E	24.9	Very low	29.2	Very low	204 Å²	204	141.6 Å²	141.6	95%	0.953	79%	0.787	S	S	*	*			trans	-142.4	146	138.1	-115.5	174.1	-161.6	0	0	110.5
510	A	27.3	Very low	29.4	Very low	88 Å²	88	142.2 Å²	142.2	73%	0.727	78%	0.78	S	S	*	*			trans	-106.4	163.4	-166.5	0	0	0	0	0	111.4
511	E	24.9	Very low	29.5	Very low	199 Å²	199	137.3 Å²	137.3	93%	0.93	78%	0.778	S	S	*	*				174.1	140.5	126.6	-96.2	177.3	176.4	0	0	111.7
512	A	30.8	Very low	29.9	Very low	90 Å²	90	136.8 Å²	136.8	74%	0.744	78%	0.783	S	S	*	*			trans	-105	161.6	163.6	0	0	0	0	0	107.4
513	P	38.9	Very low	30.1	Very low	128 Å²	128	136.8 Å²	136.8	83%	0.831	78%	0.778	S	S	*	*				-158.3	160.5	74.2	38	-16.2	0	0	0	118
514	G	25.3	Very low	30.3	Very low	75 Å²	75	138.5 Å²	138.5	77%	0.773	79%	0.786	S	S	*	*			trans	84.5	159.1	130.8	0	0	0	0	0	121.6
515	P	64.6	Low	30.7	Very low	124 Å²	124	139.1 Å²	139.1	81%	0.805	79%	0.785	S	S	*	*			trans	-120.9	170.2	-142.1	38.1	-22.5	0	0	0	115.4
516	T	27.6	Very low	32.2	Very low	131 Å²	131	138.8 Å²	138.8	80%	0.804	79%	0.789	S	S	*	*			trans	-164.2	120.7	160	18.8	0	0	0	0	108.3
517	V	30.4	Very low	32.5	Very low	118 Å²	118	135.2 Å²	135.2	72%	0.715	78%	0.783	S	S	*	*				68.9	127.4	79.7	171.3	0	0	0	0	109.3
518	E	27.7	Very low	32.9	Very low	155 Å²	155	134.1 Å²	134.1	72%	0.724	78%	0.783	S	S	*	*			cis	-170.1	142.2	19.8	-113.8	168.1	-174.4	0	0	106.5
519	M	30.1	Very low	33.8	Very low	143 Å²	143	130.7 Å²	130.7	70%	0.704	78%	0.777	S	S	*	*				78.5	142.8	85.4	-81	-174	41.8	0	0	118.9
520	N	31.4	Very low	35.4	Very low	138 Å²	138	126.3 Å²	126.3	74%	0.738	77%	0.766	S	S	*	*			trans	88.9	136.1	150.7	-65.1	-20.5	0	0	0	118.3
521	G	29.8	Very low	35.7	Very low	67 Å²	67	132.1 Å²	132.1	69%	0.691	78%	0.775	S	S	*	*			cis	175.1	147.6	4.5	0	0	0	0	0	106.3
522	D	33.9	Very low	36.2	Very low	147 Å²	147	131.9 Å²	131.9	79%	0.786	77%	0.774	S	S	*	*				107.1	132.9	53	-153.2	20.6	0	0	0	109.4
523	E	29.7	Very low	36.3	Very low	174 Å²	174	132.5 Å²	132.5	81%	0.813	78%	0.78	S	S	*	*			trans	163.9	98.7	154	-95.9	-176.5	176.2	0	0	109.1
524	Q	31.4	Very low	36	Very low	161 Å²	161	134.9 Å²	134.9	75%	0.752	78%	0.78	S	S	*	*				88.2	98.1	80.8	-80.5	-174.6	26.4	0	0	115.6
525	N	33.5	Very low	36.4	Very low	157 Å²	157	137 Å²	137	84%	0.84	78%	0.778	S	S	*	*				38.4	173.3	122.5	-107.9	-4.8	0	0	0	122.5
526	P	56.1	Low	34.8	Very low	110 Å²	110	137.1 Å²	137.1	71%	0.714	78%	0.781	S	S	*	*			cis	-139.1	-177.3	-19.2	30.8	-8.3	0	0	0	114.9
527	A	31.6	Very low	35.3	Very low	82 Å²	82	142.2 Å²	142.2	68%	0.678	79%	0.786	S	S	*	*				137.8	112	126	0	0	0	0	0	119.5
528	T	34.5	Very low	35.6	Very low	140 Å²	140	145.6 Å²	145.6	86%	0.859	79%	0.794	S	S	*	*			trans	73.8	153.8	135.5	35.2	0	0	0	0	124.9
529	P	46.4	Very low	36.2	Very low	113 Å²	113	142.2 Å²	142.2	73%	0.734	79%	0.792	S	S	*	*			trans	-123	-141.1	-154	44.1	-24.8	0	0	0	112.2
530	P	58.5	Low	36.8	Very low	113 Å²	113	143.9 Å²	143.9	73%	0.734	80%	0.803	S	S	*	*				-117.5	-172.8	-51.4	34.5	-16.7	0	0	0	111.6
531	K	33	Very low	37.3	Very low	210 Å²	210	146.4 Å²	146.4	91%	0.913	83%	0.832	S	S	*	*			trans	-169.3	126.9	142.4	-109.2	168.6	-171.3	-176.3	0	115.7
532	Q	34.7	Very low	37.7	Very low	193 Å²	193	150.4 Å²	150.4	90%	0.902	84%	0.839	S	S	*	*			trans	-75.5	158.8	156.5	-70.8	172	-35.9	0	0	110.3
533	A	32.4	Very low	37.9	Very low	104 Å²	104	150.6 Å²	150.6	86%	0.86	84%	0.841	S	S	*	*			trans	-148.1	122.1	152.6	0	0	0	0	0	111
534	E	32.7	Very low	38.4	Very low	178 Å²	178	149.3 Å²	149.3	83%	0.832	84%	0.843	S	S	*	*			trans	-75.8	155.3	166.3	-90.9	177.1	141.5	0	0	112.3
535	T	34.5	Very low	38.8	Very low	120 Å²	120	148.6 Å²	148.6	74%	0.736	85%	0.848	S	S	*	*			trans	26.8	133.5	144.6	62.5	0	0	0	0	121.5
536	S	31	Very low	39.1	Very low	125 Å²	125	148.1 Å²	148.1	87%	0.874	85%	0.849	S	S	*	*				-179.9	148.8	113.3	28.1	0	0	0	0	113.7
537	R	38.5	Very low	38	Very low	238 Å²	238	150.6 Å²	150.6	90%	0.898	86%	0.858	S	S	*	*			trans	-82.8	177	174.6	-84.1	175.1	161.3	173.8	-5.6	111.4
538	E	36.3	Very low	38.5	Very low	190 Å²	190	155.5 Å²	155.5	89%	0.888	87%	0.871	S	S	*	*			trans	101	117.8	163.3	-62.6	-175.2	160.1	0	0	113.8
539	A	40.2	Very low	38.8	Very low	84 Å²	84	156.7 Å²	156.7	69%	0.694	87%	0.872	S	S	*	*			cis	106.9	138.9	42.1	0	0	0	0	0	111.3
540	L	43	Very low	38.1	Very low	178 Å²	178	160.3 Å²	160.3	93%	0.932	88%	0.883	S	S	*	*			trans	78.8	119.2	172.1	-56.8	157	0	0	0	113.4
541	S	42.8	Very low	36.3	Very low	191 Å²	191	164.6 Å²	164.6	100%	1.336	90%	0.897	S	S	*	*				-159.1	0	51.4	62.3	0	0	0	0	112.7

Retrieved 541 of 541 residues in 165.3 ms (Link to these results)

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