A0A087YFH3_POEFO Loading...

ADP-ribosylation factor-like 13A

AlphaFold DB , UniProt , Accession A0A087YFH3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 442 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	48.3	Very low	45.1	Very low	207 Å²	207	142.3 Å²	142.3	100%	1.02	69%	0.693	S	S	*	*				0	81.7	0	-67.7	169.8	177.5	0	0	107.6
2	D	49.1	Very low	44.9	Very low	130 Å²	130	147 Å²	147	70%	0.695	70%	0.698	S	S	*	*			trans	-128.6	22.2	-150.9	-53.1	-74.5	0	0	0	114.5
3	I	46	Very low	44.7	Very low	125 Å²	125	152.8 Å²	152.8	64%	0.641	71%	0.709	S	S	*	*	S	Bend	trans	-112.6	-44	176.2	-60.6	178.2	0	0	0	110.1	L5 L6 L7	I3-L5 VanDerWaalsContact C-N 3.31Å; I3-L5 PolarHBondContact O-N 3.31Å; I3-L6 PolarHBondContact O-N 3.05Å; I3-L7 HydrophobicContact CG2-CD1 4.29Å; I3-L7 PolarHBondContact O-N 3.3Å
4	D	45.5	Very low	44.5	Very low	118 Å²	118	158.6 Å²	158.6	63%	0.631	72%	0.721	S	S	*	*	H	α-helix	trans	-64.5	-33.9	-177.5	-49.3	-77.1	0	0	0	112.7	L6 L7 Y8	D4-L6 PolarHBondContact O-N 3.04Å; D4-L7 PolarHBondContact O-N 3.38Å; D4-Y8 PolarHBondContact O-N 3.3Å
5	L	47.8	Very low	43.9	Very low	118 Å²	118	162.9 Å²	162.9	62%	0.618	73%	0.729	S	S	*	*	H	α-helix	trans	-68.9	-33.1	179.1	-159.4	70.2	0	0	0	112.6	I3 Q9	I3-L5 VanDerWaalsContact C-N 3.31Å; I3-L5 PolarHBondContact O-N 3.31Å; L5-Q9 PolarHBondContact O-N 3.36Å
6	L	45.5	Very low	43.7	Very low	119 Å²	119	159.2 Å²	159.2	62%	0.623	73%	0.726	S	S	*	*	H	α-helix	trans	-72.5	-39.5	174.8	-79.3	167	0	0	0	111.7	I3 D4 Y8 Q9 F10	I3-L6 PolarHBondContact O-N 3.05Å; D4-L6 PolarHBondContact O-N 3.04Å; L6-Y8 VanDerWaalsContact C-N 3.35Å; L6-Q9 PolarHBondContact O-N 3.34Å; L6-F10 PolarHBondContact O-N 3.49Å; L6-F10 VanDerWaalsContact O-N 3.17Å
7	L	45.5	Very low	43.3	Very low	112 Å²	112	159.2 Å²	159.2	59%	0.586	73%	0.733	S	S	*	*	H	α-helix	trans	-61.5	-42.4	173.7	-78.1	163.2	0	0	0	111.8	I3 D4 Q9 F10 Q11	I3-L7 HydrophobicContact CG2-CD1 4.29Å; I3-L7 PolarHBondContact O-N 3.3Å; D4-L7 PolarHBondContact O-N 3.38Å; L7-Q9 PolarHBondContact O-N 3.19Å; L7-F10 PolarHBondContact O-N 2.7Å; L7-Q11 PolarHBondContact O-N 3.35Å
8	Y	46.4	Very low	42.6	Very low	150 Å²	150	157.1 Å²	157.1	59%	0.588	74%	0.737	S	S	*	*	H	α-helix	trans	-67.5	-33.5	-179	-150.2	-94.8	0	0	0	113.3	D4 L6	D4-Y8 PolarHBondContact O-N 3.3Å; L6-Y8 VanDerWaalsContact C-N 3.35Å
9	Q	40.5	Very low	42.1	Very low	135 Å²	135	154.9 Å²	154.9	63%	0.631	74%	0.741	S	S	*	*	H	α-helix	trans	-75.2	-34	175.4	-70	-170.3	12.3	0	0	112.9	L5 L6 L7 Q11 R12	L5-Q9 PolarHBondContact O-N 3.36Å; L6-Q9 PolarHBondContact O-N 3.34Å; L7-Q9 PolarHBondContact O-N 3.19Å; Q9-Q11 PolarHBondContact O-N 2.85Å; Q9-R12 PolarHBondContact O-N 2.8Å
10	F	38.8	Very low	42.8	Very low	184 Å²	184	153.3 Å²	153.3	81%	0.807	74%	0.744	S	S	*	*	H	α-helix	trans	-67.6	-34.2	179.3	-126.5	-87.2	0	0	0	113	L6 L7 R12	L6-F10 PolarHBondContact O-N 3.49Å; L6-F10 VanDerWaalsContact O-N 3.17Å; L7-F10 PolarHBondContact O-N 2.7Å; F10-R12 VanDerWaalsContact C-N 3.25Å; F10-R12 PolarHBondContact O-N 3.47Å
11	Q	42.8	Very low	42.2	Very low	167 Å²	167	151.8 Å²	151.8	78%	0.78	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.8	-16.7	177.7	-84.7	-171.6	-24.5	0	0	114.9	L7 Q9	L7-Q11 PolarHBondContact O-N 3.35Å; Q9-Q11 PolarHBondContact O-N 2.85Å
12	R	42.8	Very low	41.6	Very low	199 Å²	199	147.3 Å²	147.3	75%	0.751	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.2	-1.5	-172.7	-84.8	-171.6	160.5	-140.2	-5.9	116.1	Q9 F10	Q9-R12 PolarHBondContact O-N 2.8Å; F10-R12 VanDerWaalsContact C-N 3.25Å; F10-R12 PolarHBondContact O-N 3.47Å
13	R	42	Very low	41.5	Very low	223 Å²	223	146.3 Å²	146.3	84%	0.842	74%	0.737	S	S	*	*	S	Bend	trans	-100.2	-2.4	-172.3	-150	167.4	-176.4	166.6	0.3	115.5
14	W	41.5	Very low	41.4	Very low	233 Å²	233	148.2 Å²	148.2	88%	0.883	74%	0.743	S	S	*	*	S	Bend	trans	-123.8	38	-175.6	-89	53.7	0	0	0	113.5
15	W	35.8	Very low	41.7	Very low	223 Å²	223	148.9 Å²	148.9	85%	0.845	75%	0.751	S	S	*	*			trans	-145.3	115.2	158.7	-158.1	-95	0	0	0	109.1
16	P	40.5	Very low	42	Very low	104 Å²	104	149.8 Å²	149.8	68%	0.675	76%	0.757	S	S	*	*				-141.5	162.2	114.6	38.7	-27.1	0	0	0	114.4
17	L	38	Very low	41.9	Very low	160 Å²	160	151 Å²	151	84%	0.838	76%	0.761	S	S	*	*			trans	59.8	92.2	155.5	-65.7	160.6	0	0	0	118.1
18	C	29.8	Very low	42.1	Very low	120 Å²	120	153.6 Å²	153.6	81%	0.811	77%	0.768	S	S	*	*				-163.3	132.9	128.4	-126.5	0	0	0	0	113.3
19	S	33.1	Very low	42.5	Very low	117 Å²	117	151.1 Å²	151.1	82%	0.818	77%	0.765	S	S	*	*			trans	-166.8	150.7	167.8	-81.7	0	0	0	0	109.5
20	P	56.6	Low	43.1	Very low	122 Å²	122	150.7 Å²	150.7	79%	0.792	77%	0.766	S	S	*	*			cis	-135.3	118	-23.1	33.8	-15.8	0	0	0	112.2
21	C	30.1	Very low	43.8	Very low	122 Å²	122	147.4 Å²	147.4	82%	0.824	76%	0.755	S	S	*	*			trans	-151.7	84.6	179.4	-146.2	0	0	0	0	117.2
22	S	36.6	Very low	44.6	Very low	112 Å²	112	142.4 Å²	142.4	78%	0.783	74%	0.738	S	S	*	*			trans	68.9	-176.8	153	88.2	0	0	0	0	116.4
23	P	46.8	Very low	45.3	Very low	110 Å²	110	137.9 Å²	137.9	71%	0.714	73%	0.729	S	S	*	*				-115.7	112.6	-123	34.2	-16.7	0	0	0	115.3
24	Q	43.5	Very low	46.2	Very low	165 Å²	165	130.4 Å²	130.4	77%	0.771	71%	0.71	S	S	*	*			trans	-124.7	70.6	164.8	-67.7	-163.5	4.9	0	0	112.1	N26	Q24-N26 PolarHBondContact O-N 3.26Å
25	V	51.8	Low	47.2	Very low	132 Å²	132	123.2 Å²	123.2	80%	0.8	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.7	78.2	171.4	-173.9	0	0	0	0	109.6
26	N	52.7	Low	48.4	Very low	136 Å²	136	115.1 Å²	115.1	73%	0.727	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-155.3	-37.8	166.8	-96.3	-34.2	0	0	0	113	Q24 F28 N29	Q24-N26 PolarHBondContact O-N 3.26Å; N26-F28 PolarHBondContact O-N 3.01Å; N26-N29 PolarHBondContact O-N 3.28Å
27	M	43.4	Very low	49.4	Very low	146 Å²	146	118.3 Å²	118.3	72%	0.719	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	-29.1	-169.9	-161.9	161	70.1	0	0	114.4	N29 L30	M27-N29 VanDerWaalsContact C-N 3.26Å; M27-N29 PolarHBondContact O-N 3.4Å; M27-L30 PolarHBondContact O-N 3.36Å
28	F	51.1	Low	50.7	Low	166 Å²	166	114.1 Å²	114.1	73%	0.728	65%	0.651	S	S	*	*	H	α-helix	trans	-65	-23.2	179.7	-76	-82.5	0	0	0	114.6	N26 L30 M31 S32	N26-F28 PolarHBondContact O-N 3.01Å; F28-L30 VanDerWaalsContact C-N 3.29Å; F28-L30 PolarHBondContact O-N 2.83Å; F28-M31 PolarHBondContact O-N 3.26Å; F28-S32 PolarHBondContact O-N 3.09Å; F28-S32 VanDerWaalsContact O-N 3.07Å; F28-S32 PolarHBondContact O-OG 3.08Å
29	N	53.8	Low	52.2	Low	98 Å²	98	110.9 Å²	110.9	52%	0.524	63%	0.633	S	S	.	*	H	α-helix	trans	-67.1	-27.9	179.2	-77.9	-32.6	0	0	0	113	N26 M27 S32 N33	N26-N29 PolarHBondContact O-N 3.28Å; M27-N29 VanDerWaalsContact C-N 3.26Å; M27-N29 PolarHBondContact O-N 3.4Å; N29-S32 PolarHBondContact O-OG 3.03Å; N29-N33 WeakPolarHBondContact O-CB 3.21Å; N29-N33 PolarHBondContact O-N 2.77Å; N29-N33 PolarHBondContact O-ND2 2.75Å
30	L	53.9	Low	53.4	Low	125 Å²	125	112.4 Å²	112.4	65%	0.654	63%	0.625	S	S	*	*	H	α-helix	trans	-73.5	-44.7	177.7	-169.9	62.9	0	0	0	110.5	M27 F28 N33 C34	M27-L30 PolarHBondContact O-N 3.36Å; F28-L30 VanDerWaalsContact C-N 3.29Å; F28-L30 PolarHBondContact O-N 2.83Å; L30-N33 PolarHBondContact O-N 2.72Å; L30-C34 PolarHBondContact O-N 2.94Å; L30-C34 PolarHBondContact O-SG 3.33Å; L30-C34 VanDerWaalsContact O-SG 3.36Å
31	M	54.2	Low	53.7	Low	115 Å²	115	111.8 Å²	111.8	57%	0.567	61%	0.614	S	S	*	*	H	α-helix	trans	-64.5	-41	177.2	-71.7	-174.9	72.3	0	0	112.7	F28 N33 C34 C35	F28-M31 PolarHBondContact O-N 3.26Å; M31-N33 VanDerWaalsContact C-N 3.33Å; M31-N33 PolarHBondContact O-N 2.91Å; M31-C34 PolarHBondContact O-N 3.34Å; M31-C35 WeakPolarHBondContact O-CB 3.39Å; M31-C35 PolarHBondContact O-N 2.91Å; M31-C35 PolarHBondContact O-SG 2.97Å
32	S	58	Low	55.3	Low	63 Å²	63	113.1 Å²	113.1	44%	0.441	61%	0.608	S	S	.	*	H	α-helix	trans	-65.7	-35.5	177.6	65.9	0	0	0	0	112.9	F28 N29 S36	F28-S32 PolarHBondContact O-N 3.09Å; F28-S32 VanDerWaalsContact O-N 3.07Å; F28-S32 PolarHBondContact O-OG 3.08Å; N29-S32 PolarHBondContact O-OG 3.03Å; S32-S36 WeakPolarHBondContact O-CB 3.25Å; S32-S36 PolarHBondContact O-N 2.66Å; S32-S36 PolarHBondContact O-OG 3.34Å
33	N	57.4	Low	56.8	Low	104 Å²	104	111.1 Å²	111.1	56%	0.556	59%	0.587	S	S	*	*	H	α-helix	trans	-69	-41.7	172.5	-77	-48.4	0	0	0	112	N29 L30 M31 S36 W37	N29-N33 WeakPolarHBondContact O-CB 3.21Å; N29-N33 PolarHBondContact O-N 2.77Å; N29-N33 PolarHBondContact O-ND2 2.75Å; L30-N33 PolarHBondContact O-N 2.72Å; M31-N33 VanDerWaalsContact C-N 3.33Å; M31-N33 PolarHBondContact O-N 2.91Å; N33-S36 PolarHBondContact O-OG 3.09Å; N33-W37 VanDerWaalsContact O-CB 3.26Å; N33-W37 WeakPolarHBondContact O-CB 3.15Å; N33-W37 PolarHBondContact O-N 2.73Å
34	C	61	Low	58.3	Low	65 Å²	65	110.7 Å²	110.7	44%	0.439	58%	0.584	S	S	.	*	H	α-helix	trans	-63.3	-46.5	173	-70.7	0	0	0	0	112.2	L30 M31 S36 W37 V38	L30-C34 PolarHBondContact O-N 2.94Å; L30-C34 PolarHBondContact O-SG 3.33Å; L30-C34 VanDerWaalsContact O-SG 3.36Å; M31-C34 PolarHBondContact O-N 3.34Å; C34-S36 PolarHBondContact O-N 3.42Å; C34-W37 PolarHBondContact O-N 3.26Å; C34-V38 WeakPolarHBondContact O-CG2 3.44Å; C34-V38 PolarHBondContact O-N 3.21Å
35	C	62.4	Low	60.4	Low	83 Å²	83	106.3 Å²	106.3	56%	0.561	57%	0.565	S	S	*	*	H	α-helix	trans	-63.9	-39.5	179	-70.1	0	0	0	0	112.5	M31 A39	M31-C35 WeakPolarHBondContact O-CB 3.39Å; M31-C35 PolarHBondContact O-N 2.91Å; M31-C35 PolarHBondContact O-SG 2.97Å; C35-A39 VanDerWaalsContact O-CB 3.27Å; C35-A39 WeakPolarHBondContact O-CB 3.5Å; C35-A39 PolarHBondContact O-N 3.44Å
36	S	61.2	Low	62.3	Low	52 Å²	52	102.3 Å²	102.3	36%	0.364	54%	0.536	S	S	.	.	H	α-helix	trans	-73.4	-26.5	175.4	59.1	0	0	0	0	113.4	S32 N33 C34 K40	S32-S36 WeakPolarHBondContact O-CB 3.25Å; S32-S36 PolarHBondContact O-N 2.66Å; S32-S36 PolarHBondContact O-OG 3.34Å; N33-S36 PolarHBondContact O-OG 3.09Å; C34-S36 PolarHBondContact O-N 3.42Å; S36-K40 WeakPolarHBondContact O-CB 3.29Å; S36-K40 VanDerWaalsContact O-CG 3.31Å; S36-K40 WeakPolarHBondContact O-CG 3.23Å; S36-K40 PolarHBondContact O-N 3.39Å
37	W	62.3	Low	64.4	Low	172 Å²	172	102.7 Å²	102.7	65%	0.652	53%	0.531	S	S	*	.	H	α-helix	trans	-71.2	-45.9	169.6	-177.6	80.8	0	0	0	111.9	N33 C34 K40 I41	N33-W37 VanDerWaalsContact O-CB 3.26Å; N33-W37 WeakPolarHBondContact O-CB 3.15Å; N33-W37 PolarHBondContact O-N 2.73Å; C34-W37 PolarHBondContact O-N 3.26Å; W37-K40 PolarHBondContact O-N 3.29Å; W37-I41 HydrophobicContact CD2-CD1 3.62Å; W37-I41 VanDerWaalsContact CE2-CD1 3.46Å; W37-I41 HydrophobicContact CE3-CD1 3.74Å; W37-I41 HydrophobicContact CG-CD1 4.37Å; W37-I41 HydrophobicContact CH2-CD1 3.61Å; W37-I41 HydrophobicContact CZ2-CD1 3.48Å; W37-I41 VanDerWaalsContact CZ2-CD1 3.48Å; W37-I41 HydrophobicContact CZ3-CD1 3.73Å; W37-I41 WeakPolarHBondContact O-CG1 3.32Å; W37-I41 PolarHBondContact O-N 2.74Å
38	V	64.6	Low	67	Low	71 Å²	71	95.8 Å²	95.8	43%	0.43	50%	0.497	S	S	.	.	H	α-helix	trans	-61.2	-45.1	173.3	173.4	0	0	0	0	111	C34 K40 I41 Q42	C34-V38 WeakPolarHBondContact O-CG2 3.44Å; C34-V38 PolarHBondContact O-N 3.21Å; V38-K40 VanDerWaalsContact C-N 3.32Å; V38-K40 PolarHBondContact O-N 2.96Å; V38-I41 CarbonylContact O-C 3.46Å; V38-I41 WeakPolarHBondContact O-CA 3.33Å; V38-I41 WeakPolarHBondContact O-CB 3.48Å; V38-I41 PolarHBondContact O-N 3.34Å; V38-Q42 WeakPolarHBondContact O-CB 3.47Å; V38-Q42 PolarHBondContact O-N 3.46Å
39	A	62.4	Low	69.2	Low	53 Å²	53	89.2 Å²	89.2	44%	0.438	47%	0.47	S	S	.	.	H	α-helix	trans	-58.7	-41.5	177	0	0	0	0	0	112.5	C35 I41 Q42 E43	C35-A39 VanDerWaalsContact O-CB 3.27Å; C35-A39 WeakPolarHBondContact O-CB 3.5Å; C35-A39 PolarHBondContact O-N 3.44Å; A39-I41 VanDerWaalsContact C-N 3.33Å; A39-I41 PolarHBondContact O-N 3.47Å; A39-Q42 CarbonylContact O-C 3.49Å; A39-Q42 PolarHBondContact O-N 3.09Å; A39-E43 PolarHBondContact O-N 2.93Å
40	K	58.3	Low	71.3	Confident	148 Å²	148	84.5 Å²	84.5	64%	0.643	45%	0.445	S	S	*	.	H	α-helix	trans	-66.4	-30.9	174.2	-77.8	172.2	178.1	173.9	0	113.6	S36 W37 V38 Q42	S36-K40 WeakPolarHBondContact O-CB 3.29Å; S36-K40 VanDerWaalsContact O-CG 3.31Å; S36-K40 WeakPolarHBondContact O-CG 3.23Å; S36-K40 PolarHBondContact O-N 3.39Å; W37-K40 PolarHBondContact O-N 3.29Å; V38-K40 VanDerWaalsContact C-N 3.32Å; V38-K40 PolarHBondContact O-N 2.96Å; K40-Q42 VanDerWaalsContact C-N 3.34Å
41	I	62.4	Low	73.4	Confident	109 Å²	109	78.6 Å²	78.6	56%	0.559	41%	0.414	S	S	*	.	H	α-helix	trans	-74.2	-29.2	173	-73.5	168.8	0	0	0	111.3	W37 V38 A39	W37-I41 HydrophobicContact CD2-CD1 3.62Å; W37-I41 VanDerWaalsContact CE2-CD1 3.46Å; W37-I41 HydrophobicContact CE3-CD1 3.74Å; W37-I41 HydrophobicContact CG-CD1 4.37Å; W37-I41 HydrophobicContact CH2-CD1 3.61Å; W37-I41 HydrophobicContact CZ2-CD1 3.48Å; W37-I41 VanDerWaalsContact CZ2-CD1 3.48Å; W37-I41 HydrophobicContact CZ3-CD1 3.73Å; W37-I41 WeakPolarHBondContact O-CG1 3.32Å; W37-I41 PolarHBondContact O-N 2.74Å; V38-I41 CarbonylContact O-C 3.46Å; V38-I41 WeakPolarHBondContact O-CA 3.33Å; V38-I41 WeakPolarHBondContact O-CB 3.48Å; V38-I41 PolarHBondContact O-N 3.34Å; A39-I41 VanDerWaalsContact C-N 3.33Å; A39-I41 PolarHBondContact O-N 3.47Å
42	Q	63.2	Low	75.5	Confident	151 Å²	151	73.1 Å²	73.1	71%	0.706	39%	0.388	S	S	*	.	S	Bend	trans	-95.1	1.3	-177	-153.7	168.8	22.1	0	0	113.7	V38 A39 K40	V38-Q42 WeakPolarHBondContact O-CB 3.47Å; V38-Q42 PolarHBondContact O-N 3.46Å; A39-Q42 CarbonylContact O-C 3.49Å; A39-Q42 PolarHBondContact O-N 3.09Å; K40-Q42 VanDerWaalsContact C-N 3.34Å
43	E	67.9	Low	77.4	Confident	70 Å²	70	70.1 Å²	70.1	33%	0.327	37%	0.367	S	S	.	.			trans	-59.6	122.4	173.3	-83.7	-170.9	-120.4	0	0	110.6	A39 R46 N91	A39-E43 PolarHBondContact O-N 2.93Å; E43-R46 IonicContact OE2-CZ 2.66Å; E43-R46 IonicContact OE2-NH1 3.19Å; E43-R46 PolarHBondContact OE2-NH1 2.93Å; E43-R46 IonicContact OE2-NH2 3.46Å; E43-R46 PolarHBondContact OE2-NH2 3.22Å; E43-N91 PolarHBondContact OE2-ND2 3.19Å
44	P	78.4	Confident	79.3	Confident	100 Å²	100	65.2 Å²	65.2	65%	0.649	34%	0.34	S	S	*	.			trans	-66.2	146.4	-177.2	27.2	-34.9	0	0	0	111.7	R46	P44-R46 PolarHBondContact O-N 3.27Å
45	L	87.8	Confident	81	Confident	74 Å²	74	62.6 Å²	62.6	39%	0.387	32%	0.322	S	S	.	.			trans	-61.4	102.5	-179.6	-176.8	68.7	0	0	0	110.9	N91 L93	L45-N91 WeakPolarHBondContact CA-O 3.25Å; L45-L93 HydrophobicContact CD1-CB 4.28Å; L45-L93 HydrophobicContact CD2-CB 4.14Å; L45-L93 HydrophobicContact CG-CB 4.11Å
46	R	92.9	Very high	82.5	Confident	48 Å²	48	60.8 Å²	60.8	18%	0.181	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	131.9	179.6	-66	-174.6	-175.9	100.3	15.8	109.7	E43 P44 N91 Y92 L93 Y221	E43-R46 IonicContact OE2-CZ 2.66Å; E43-R46 IonicContact OE2-NH1 3.19Å; E43-R46 PolarHBondContact OE2-NH1 2.93Å; E43-R46 IonicContact OE2-NH2 3.46Å; E43-R46 PolarHBondContact OE2-NH2 3.22Å; P44-R46 PolarHBondContact O-N 3.27Å; R46-N91 PolarHBondContact N-O 3.21Å; R46-N91 PolarHBondContact NH1-ND2 2.84Å; R46-Y92 HydrophobicContact CB-CD1 3.72Å; R46-Y92 HydrophobicContact CB-CE1 3.95Å; R46-Y92 HydrophobicContact CG-CE1 4.36Å; R46-Y92 PolarHBondContact NH1-OH 2.84Å; R46-Y92 CarbonylContact O-C 3.52Å; R46-Y92 VanDerWaalsContact O-CA 3.31Å; R46-Y92 WeakPolarHBondContact O-CA 3.4Å; R46-L93 PolarHBondContact O-N 2.73Å; R46-Y221 HydrophobicContact CB-CE1 4.14Å; R46-Y221 HydrophobicContact CB-CE2 4.1Å; R46-Y221 HydrophobicContact CG-CD1 4.3Å; R46-Y221 HydrophobicContact CG-CE1 3.82Å; R46-Y221 HydrophobicContact CG-CE2 4.49Å
47	K	95.9	Very high	84.1	Confident	143 Å²	143	66.3 Å²	66.3	62%	0.622	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97	126.2	176.5	-65	-172.6	-179.8	-177.2	0	108.7	L93 Y221	K47-L93 WeakPolarHBondContact CA-O 3.46Å; K47-L93 HydrophobicContact CG-CD2 4.42Å; K47-Y221 PolarHBondContact N-OH 3.04Å; K47-Y221 PolarHBondContact O-OH 3.31Å; K47-Y221 VanDerWaalsContact O-OH 3.08Å
48	V	97.4	Very high	85.7	Confident	1 Å²	1	58.2 Å²	58.2	1%	0.006	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	115.1	-174.5	-175.3	0	0	0	0	110.7	I50 Y92 L93 V94 T95 H117 L214 V217 Y221	V48-I50 HydrophobicContact CG1-CD1 3.54Å; V48-I50 HydrophobicContact CG1-CG1 3.92Å; V48-Y92 HydrophobicContact CG2-CD1 3.73Å; V48-Y92 HydrophobicContact CG2-CE1 4.47Å; V48-L93 PolarHBondContact N-O 3.17Å; V48-V94 CarbonylContact O-C 3.46Å; V48-V94 WeakPolarHBondContact O-CA 3.24Å; V48-T95 PolarHBondContact O-N 3.25Å; V48-H117 HydrophobicContact CG1-CB 3.98Å; V48-L214 HydrophobicContact CB-CD2 4.12Å; V48-L214 HydrophobicContact CG1-CD2 4Å; V48-L214 HydrophobicContact CG2-CD2 4.24Å; V48-V217 HydrophobicContact CG1-CG1 3.9Å; V48-V217 HydrophobicContact CG1-CG2 4.49Å; V48-V217 HydrophobicContact CG2-CG1 4.11Å; V48-Y221 HydrophobicContact CG2-CE2 4.04Å
49	T	98	Very high	87.1	Confident	28 Å²	28	55.4 Å²	55.4	17%	0.172	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	126.4	170.4	-46.5	0	0	0	0	109.5	T95 L97 E115 H117	T49-T95 WeakPolarHBondContact CA-O 3.19Å; T49-L97 HydrophobicContact CG2-CD1 3.64Å; T49-L97 HydrophobicContact CG2-CD2 4.3Å; T49-L97 HydrophobicContact CG2-CG 3.86Å; T49-E115 VanDerWaalsContact CB-O 3.26Å; T49-E115 WeakPolarHBondContact CB-O 3.28Å; T49-E115 HydrophobicContact CG2-CB 4.4Å; T49-H117 PolarHBondContact N-ND1 3.08Å; T49-H117 WeakPolarHBondContact O-CB 3.44Å; T49-H117 PolarHBondContact O-N 3.06Å
50	I	98.3	Very high	88.6	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	129.5	177	-59.2	-62	0	0	0	109.6	V48 V94 T95 L96 L97 G118 I120 L213 V217	V48-I50 HydrophobicContact CG1-CD1 3.54Å; V48-I50 HydrophobicContact CG1-CG1 3.92Å; I50-V94 HydrophobicContact CG1-CG1 3.95Å; I50-T95 PolarHBondContact N-O 3.43Å; I50-L96 HydrophobicContact CB-CD2 3.74Å; I50-L96 HydrophobicContact CG1-CD2 4.32Å; I50-L96 HydrophobicContact CG2-CD2 4.09Å; I50-L96 WeakPolarHBondContact O-CA 3.45Å; I50-L97 PolarHBondContact O-N 3.43Å; I50-G118 WeakPolarHBondContact CA-O 3.28Å; I50-I120 HydrophobicContact CG2-CB 4.49Å; I50-I120 HydrophobicContact CG2-CD1 3.72Å; I50-I120 HydrophobicContact CG2-CG1 3.59Å; I50-L213 HydrophobicContact CD1-CD2 3.94Å; I50-L213 HydrophobicContact CD1-CG 4.21Å; I50-L213 HydrophobicContact CG1-CD2 4.43Å; I50-L213 HydrophobicContact CG2-CD2 3.81Å; I50-V217 HydrophobicContact CD1-CG2 4.38Å
51	L	98	Very high	90.3	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	124.9	178.2	175.8	61.4	0	0	0	110.9	V53 L97 V99 L112 Y113 A116 G118 V119 I120	L51-V53 HydrophobicContact CD1-CG1 3.82Å; L51-V53 HydrophobicContact CD2-CG1 4.07Å; L51-V53 HydrophobicContact CG-CG1 3.71Å; L51-V53 HydrophobicContact CG-CG2 4.3Å; L51-L97 HydrophobicContact CD1-CB 4.07Å; L51-L97 HydrophobicContact CD1-CD1 4.49Å; L51-V99 HydrophobicContact CD1-CG2 3.62Å; L51-L112 HydrophobicContact CD1-CB 4.06Å; L51-L112 HydrophobicContact CD1-CD1 4.17Å; L51-L112 HydrophobicContact CD2-CB 4.41Å; L51-Y113 HydrophobicContact CD2-CD1 3.52Å; L51-Y113 HydrophobicContact CD2-CE1 3.81Å; L51-A116 HydrophobicContact CB-CB 3.7Å; L51-G118 PolarHBondContact N-O 3.26Å; L51-G118 VanDerWaalsContact N-O 3.1Å; L51-V119 WeakPolarHBondContact O-CA 3.48Å; L51-I120 PolarHBondContact O-N 2.95Å
52	V	98.1	Very high	91.7	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.006	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	109.2	-180	-168	0	0	0	0	109.9	K60 I64 L96 L97 I120 V122	V52-K60 HydrophobicContact CG1-CB 4.04Å; V52-K60 HydrophobicContact CG1-CD 4.36Å; V52-K60 HydrophobicContact CG1-CG 4.28Å; V52-I64 HydrophobicContact CB-CD1 3.97Å; V52-I64 HydrophobicContact CG1-CD1 4.04Å; V52-I64 HydrophobicContact CG1-CG1 4.4Å; V52-I64 HydrophobicContact CG2-CD1 3.86Å; V52-I64 HydrophobicContact CG2-CG1 4.24Å; V52-L96 HydrophobicContact CG2-CB 4.26Å; V52-L97 WeakPolarHBondContact CB-O 3.49Å; V52-L97 PolarHBondContact N-O 3.06Å; V52-I120 WeakPolarHBondContact CA-O 3.46Å; V52-I120 HydrophobicContact CG1-CB 4.24Å; V52-I120 HydrophobicContact CG1-CG2 4.19Å; V52-I120 HydrophobicContact CG2-CB 4.27Å; V52-I120 HydrophobicContact CG2-CD1 4.31Å; V52-V122 HydrophobicContact CG1-CG2 3.96Å
53	V	97.5	Very high	93.1	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	176.7	-170.4	-77.1	0	0	0	0	111.4	L51 K60 W109 V119 I120 F121 V122 L141	L51-V53 HydrophobicContact CD1-CG1 3.82Å; L51-V53 HydrophobicContact CD2-CG1 4.07Å; L51-V53 HydrophobicContact CG-CG1 3.71Å; L51-V53 HydrophobicContact CG-CG2 4.3Å; V53-K60 VanDerWaalsContact C-CD 3.4Å; V53-K60 WeakPolarHBondContact O-CD 3.24Å; V53-W109 HydrophobicContact CB-CD2 4.04Å; V53-W109 HydrophobicContact CB-CE3 3.93Å; V53-W109 HydrophobicContact CB-CH2 3.88Å; V53-W109 HydrophobicContact CB-CZ2 3.94Å; V53-W109 HydrophobicContact CB-CZ3 3.86Å; V53-W109 HydrophobicContact CG1-CD2 3.48Å; V53-W109 VanDerWaalsContact CG1-CD2 3.48Å; V53-W109 HydrophobicContact CG1-CE3 3.82Å; V53-W109 HydrophobicContact CG1-CG 3.84Å; V53-W109 HydrophobicContact CG1-CH2 4.36Å; V53-W109 HydrophobicContact CG1-CZ2 4.03Å; V53-W109 HydrophobicContact CG1-CZ3 4.25Å; V53-V119 HydrophobicContact CG2-CG1 3.61Å; V53-I120 PolarHBondContact N-O 3.34Å; V53-F121 HydrophobicContact CG2-CD2 4.29Å; V53-F121 WeakPolarHBondContact O-CA 3.42Å; V53-V122 PolarHBondContact O-N 3.45Å; V53-L141 HydrophobicContact CG2-CD2 3.81Å
54	G	97	Very high	94.3	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.178	C	C	.	.			trans	123.8	171.4	-166.3	0	0	0	0	0	111.7	K60 W109	G54-K60 PolarHBondContact O-NZ 3.01Å; G54-W109 WeakPolarHBondContact O-CZ2 3.35Å
55	L	96.7	Very high	94.9	Very high	10 Å²	10	32.3 Å²	32.3	5%	0.052	16%	0.158	C	C	.	.			trans	-60.6	165.1	-172.3	-53.5	-174.7	0	0	0	113.1	A58 K60 R130 E133 A134 V137	L55-A58 WeakPolarHBondContact O-CB 3.3Å; L55-K60 PolarHBondContact O-NZ 3.11Å; L55-R130 HydrophobicContact CD1-CB 3.85Å; L55-E133 HydrophobicContact CD1-CB 4.29Å; L55-E133 HydrophobicContact CD1-CG 4.34Å; L55-E133 HydrophobicContact CD2-CG 4Å; L55-A134 HydrophobicContact CD1-CB 3.92Å; L55-A134 HydrophobicContact CG-CB 4.23Å; L55-V137 HydrophobicContact CD2-CB 4.37Å; L55-V137 HydrophobicContact CD2-CG2 4.05Å
56	D	94.6	Very high	95	Very high	46 Å²	46	28.9 Å²	28.9	25%	0.246	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	152.3	166.1	63.2	-75.3	0	0	0	110.8	A58 G101 R106 R130	D56-A58 PolarHBondContact O-N 3.23Å; D56-G101 PolarHBondContact N-O 2.82Å; D56-R106 IonicContact OD1-NH2 3.2Å; D56-R130 PolarHBondContact O-NH1 2.96Å; D56-R130 PolarHBondContact O-NH2 3.22Å; D56-R130 IonicContact OD1-NH1 2.66Å; D56-R130 PolarHBondContact OD1-NH1 3.26Å; D56-R130 IonicContact OD2-NH1 3.57Å; D56-R130 PolarHBondContact OD2-NH1 3.18Å
57	K	94	Very high	94.8	Very high	167 Å²	167	27 Å²	27	73%	0.726	13%	0.134	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.1	-0.7	-176.2	-54.8	170.9	-174.8	173.4	0	115.4	G59 K158	K57-G59 PolarHBondContact O-N 2.95Å; K57-G59 VanDerWaalsContact O-N 3.15Å; K57-K158 WeakPolarHBondContact O-CE 3.31Å; K57-K158 PolarHBondContact O-NZ 2.88Å
58	A	95.7	Very high	94.5	Very high	2 Å²	2	22.6 Å²	22.6	2%	0.017	12%	0.117	C	C	.	.	S	Bend	trans	-63.6	-17.8	177.3	0	0	0	0	0	114.4	L55 D56 V122 N157	L55-A58 WeakPolarHBondContact O-CB 3.3Å; D56-A58 PolarHBondContact O-N 3.23Å; A58-V122 HydrophobicContact CB-CB 4.48Å; A58-V122 HydrophobicContact CB-CG1 4.31Å; A58-V122 WeakPolarHBondContact CB-O 3.48Å; A58-V122 WeakPolarHBondContact O-CG1 3.41Å; A58-N157 PolarHBondContact O-ND2 3.26Å
59	G	94	Very high	93.9	Very high	13 Å²	13	30.4 Å²	30.4	13%	0.134	15%	0.146	C	C	.	.			trans	99.4	22	174	0	0	0	0	0	115.4	K57 T61 S62 S63	K57-G59 PolarHBondContact O-N 2.95Å; K57-G59 VanDerWaalsContact O-N 3.15Å; G59-T61 PolarHBondContact O-N 2.66Å; G59-S62 CarbonylContact O-C 3.42Å; G59-S62 WeakPolarHBondContact O-CA 3.48Å; G59-S62 VanDerWaalsContact O-CB 3.29Å; G59-S62 WeakPolarHBondContact O-CB 3.39Å; G59-S62 PolarHBondContact O-N 2.68Å; G59-S62 VanDerWaalsContact O-N 3.07Å; G59-S63 PolarHBondContact O-N 3.23Å; G59-S63 PolarHBondContact O-OG 3.29Å
60	K	95.1	Very high	93.1	Very high	13 Å²	13	31.7 Å²	31.7	6%	0.057	15%	0.154	C	C	.	.	H	α-helix	trans	-49.2	-58	180	-60.6	-167.9	-62.8	-81.7	0	113.5	V52 V53 G54 L55 S62 S63 I64 D98 V99 V122	V52-K60 HydrophobicContact CG1-CB 4.04Å; V52-K60 HydrophobicContact CG1-CD 4.36Å; V52-K60 HydrophobicContact CG1-CG 4.28Å; V53-K60 VanDerWaalsContact C-CD 3.4Å; V53-K60 WeakPolarHBondContact O-CD 3.24Å; G54-K60 PolarHBondContact O-NZ 3.01Å; L55-K60 PolarHBondContact O-NZ 3.11Å; K60-S62 VanDerWaalsContact C-N 3.25Å; K60-S62 PolarHBondContact O-N 2.96Å; K60-S63 WeakPolarHBondContact O-CB 3.38Å; K60-S63 PolarHBondContact O-N 3Å; K60-S63 VanDerWaalsContact O-N 3.12Å; K60-I64 WeakPolarHBondContact O-CG1 3.14Å; K60-I64 PolarHBondContact O-N 3.31Å; K60-D98 WeakPolarHBondContact CB-OD1 3.09Å; K60-V99 WeakPolarHBondContact CE-O 3.47Å; K60-V99 PolarHBondContact NZ-O 3.41Å; K60-V122 HydrophobicContact CB-CG2 4.42Å; K60-V122 HydrophobicContact CG-CB 3.83Å; K60-V122 HydrophobicContact CG-CG2 3.8Å
61	T	93.5	Very high	92	Very high	31 Å²	31	36.1 Å²	36.1	19%	0.19	18%	0.183	C	C	.	.	H	α-helix	trans	-58.8	-36.1	177	-37.7	0	0	0	0	112.3	G59 I64 R65 A76 T79 D98	G59-T61 PolarHBondContact O-N 2.66Å; T61-I64 PolarHBondContact O-N 3.34Å; T61-R65 WeakPolarHBondContact O-CB 3.46Å; T61-R65 VanDerWaalsContact O-CG 3.31Å; T61-R65 WeakPolarHBondContact O-CG 3.43Å; T61-R65 PolarHBondContact O-N 2.93Å; T61-A76 HydrophobicContact CG2-CB 4.05Å; T61-T79 PolarHBondContact OG1-OG1 2.76Å; T61-T79 VanDerWaalsContact OG1-OG1 3.08Å; T61-D98 VanDerWaalsContact CB-OD2 3.29Å; T61-D98 WeakPolarHBondContact CB-OD2 3.49Å; T61-D98 WeakPolarHBondContact CG2-OD2 3.44Å; T61-D98 PolarHBondContact OG1-OD2 2.89Å
62	S	92.1	Very high	90.6	Very high	40 Å²	40	40.1 Å²	40.1	28%	0.28	21%	0.209	S	C	.	.	H	α-helix	trans	-66.2	-45.6	175.2	-43.3	0	0	0	0	111.4	G59 K60 I64 R65 G66 L198	G59-S62 CarbonylContact O-C 3.42Å; G59-S62 WeakPolarHBondContact O-CA 3.48Å; G59-S62 VanDerWaalsContact O-CB 3.29Å; G59-S62 WeakPolarHBondContact O-CB 3.39Å; G59-S62 PolarHBondContact O-N 2.68Å; G59-S62 VanDerWaalsContact O-N 3.07Å; K60-S62 VanDerWaalsContact C-N 3.25Å; K60-S62 PolarHBondContact O-N 2.96Å; S62-I64 VanDerWaalsContact C-N 3.3Å; S62-I64 PolarHBondContact O-N 2.91Å; S62-R65 PolarHBondContact O-N 3.45Å; S62-G66 PolarHBondContact O-N 3.09Å; S62-L198 WeakPolarHBondContact O-CD1 3.37Å
63	S	92.8	Very high	89.2	Confident	1 Å²	1	42.7 Å²	42.7	1%	0.007	24%	0.235	C	C	.	.	H	α-helix	trans	-58	-44.2	175.8	-63.8	0	0	0	0	111	G59 K60 G66 M67	G59-S63 PolarHBondContact O-N 3.23Å; G59-S63 PolarHBondContact O-OG 3.29Å; K60-S63 WeakPolarHBondContact O-CB 3.38Å; K60-S63 PolarHBondContact O-N 3Å; K60-S63 VanDerWaalsContact O-N 3.12Å; S63-G66 PolarHBondContact O-N 3.48Å; S63-M67 WeakPolarHBondContact O-CG 3.36Å; S63-M67 PolarHBondContact O-N 2.92Å
64	I	93.4	Very high	87.8	Confident	1 Å²	1	49 Å²	49	1%	0.005	27%	0.273	C	S	.	.	H	α-helix	trans	-63.5	-48.5	176.7	-66.9	169.7	0	0	0	111.2	V52 K60 T61 S62 G66 M67 L68 N85 L96 D98	V52-I64 HydrophobicContact CB-CD1 3.97Å; V52-I64 HydrophobicContact CG1-CD1 4.04Å; V52-I64 HydrophobicContact CG1-CG1 4.4Å; V52-I64 HydrophobicContact CG2-CD1 3.86Å; V52-I64 HydrophobicContact CG2-CG1 4.24Å; K60-I64 WeakPolarHBondContact O-CG1 3.14Å; K60-I64 PolarHBondContact O-N 3.31Å; T61-I64 PolarHBondContact O-N 3.34Å; S62-I64 VanDerWaalsContact C-N 3.3Å; S62-I64 PolarHBondContact O-N 2.91Å; I64-G66 VanDerWaalsContact C-N 3.26Å; I64-G66 PolarHBondContact O-N 3.36Å; I64-M67 WeakPolarHBondContact O-CB 3.49Å; I64-M67 PolarHBondContact O-N 3.34Å; I64-M67 VanDerWaalsContact O-N 3.17Å; I64-L68 HydrophobicContact CG2-CD1 3.61Å; I64-L68 HydrophobicContact CG2-CG 4.27Å; I64-L68 WeakPolarHBondContact O-CB 3.42Å; I64-L68 VanDerWaalsContact O-CG 3.28Å; I64-L68 WeakPolarHBondContact O-CG 3.23Å; I64-L68 PolarHBondContact O-N 2.88Å; I64-N85 HydrophobicContact CG2-CB 4.07Å; I64-L96 HydrophobicContact CB-CD1 4.48Å; I64-L96 HydrophobicContact CG1-CD1 3.98Å; I64-L96 HydrophobicContact CG2-CD1 4.19Å; I64-D98 HydrophobicContact CD1-CB 3.46Å; I64-D98 VanDerWaalsContact CD1-CB 3.46Å
65	R	90.8	Very high	86.4	Confident	59 Å²	59	56 Å²	56	22%	0.223	31%	0.311	C	S	.	.	H	α-helix	trans	-58.3	-37	176.2	-74.7	173.1	76.7	174.7	-0.8	112	T61 S62 L68 R69 V70 V74 L198	T61-R65 WeakPolarHBondContact O-CB 3.46Å; T61-R65 VanDerWaalsContact O-CG 3.31Å; T61-R65 WeakPolarHBondContact O-CG 3.43Å; T61-R65 PolarHBondContact O-N 2.93Å; S62-R65 PolarHBondContact O-N 3.45Å; R65-L68 PolarHBondContact O-N 3.46Å; R65-R69 PolarHBondContact O-N 2.81Å; R65-R69 VanDerWaalsContact O-N 3.15Å; R65-V70 HydrophobicContact CB-CB 4.07Å; R65-V70 HydrophobicContact CG-CB 4.2Å; R65-V70 HydrophobicContact CG-CG1 4.39Å; R65-V70 HydrophobicContact CG-CG2 4.38Å; R65-V70 PolarHBondContact O-N 2.95Å; R65-V74 PolarHBondContact NH1-O 2.93Å; R65-L198 HydrophobicContact CB-CD1 4.3Å; R65-L198 HydrophobicContact CB-CD2 4.45Å
66	G	88.7	Confident	85.3	Confident	3 Å²	3	57.6 Å²	57.6	3%	0.031	33%	0.326	C	S	.	.	H	α-helix	trans	-67.5	-40.1	175.1	0	0	0	0	0	114.1	S62 S63 I64 R204	S62-G66 PolarHBondContact O-N 3.09Å; S63-G66 PolarHBondContact O-N 3.48Å; I64-G66 VanDerWaalsContact C-N 3.26Å; I64-G66 PolarHBondContact O-N 3.36Å; G66-R204 PolarHBondContact O-NH1 2.86Å; G66-R204 VanDerWaalsContact O-NH1 3.08Å
67	M	90.4	Very high	84.5	Confident	9 Å²	9	58 Å²	58	4%	0.044	34%	0.34	C	S	.	.	H	α-helix	trans	-62.3	-46.2	170.4	-65.2	174.9	-174	0	0	111.4	S63 I64 R69 L87 L96 I120 L155 T206 L210	S63-M67 WeakPolarHBondContact O-CG 3.36Å; S63-M67 PolarHBondContact O-N 2.92Å; I64-M67 WeakPolarHBondContact O-CB 3.49Å; I64-M67 PolarHBondContact O-N 3.34Å; I64-M67 VanDerWaalsContact O-N 3.17Å; M67-R69 VanDerWaalsContact C-N 3.25Å; M67-R69 PolarHBondContact O-N 2.89Å; M67-L87 HydrophobicContact CB-CD2 4.19Å; M67-L96 HydrophobicContact SD-CD1 3.59Å; M67-L96 VanDerWaalsContact SD-CD1 3.59Å; M67-I120 HydrophobicContact CE-CD1 3.94Å; M67-L155 HydrophobicContact CE-CD1 4.35Å; M67-T206 HydrophobicContact CE-CG2 3.46Å; M67-T206 VanDerWaalsContact CE-CG2 3.46Å; M67-T206 HydrophobicContact CG-CG2 4.05Å; M67-L210 HydrophobicContact CE-CB 4.11Å; M67-L210 HydrophobicContact SD-CB 4.35Å; M67-L210 HydrophobicContact SD-CD2 3.77Å
68	L	89.1	Confident	83.9	Confident	49 Å²	49	55.3 Å²	55.3	26%	0.257	34%	0.34	S	S	.	.	H	α-helix	trans	-69.5	-12.8	-176.7	-73.4	168.4	0	0	0	115	I64 R65 V70 N85 L87	I64-L68 HydrophobicContact CG2-CD1 3.61Å; I64-L68 HydrophobicContact CG2-CG 4.27Å; I64-L68 WeakPolarHBondContact O-CB 3.42Å; I64-L68 VanDerWaalsContact O-CG 3.28Å; I64-L68 WeakPolarHBondContact O-CG 3.23Å; I64-L68 PolarHBondContact O-N 2.88Å; R65-L68 PolarHBondContact O-N 3.46Å; L68-V70 HydrophobicContact CB-CG2 3.82Å; L68-V70 HydrophobicContact CD1-CG2 4.28Å; L68-V70 PolarHBondContact O-N 2.76Å; L68-N85 HydrophobicContact CD1-CB 4.17Å; L68-L87 HydrophobicContact CD2-CB 3.7Å; L68-L87 HydrophobicContact CD2-CD2 3.87Å; L68-L87 HydrophobicContact CD2-CG 4.43Å; L68-L87 HydrophobicContact CG-CD2 4.24Å
69	R	83.7	Confident	83.3	Confident	166 Å²	166	56.6 Å²	56.6	63%	0.626	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.8	25.3	-170.6	-51	170.8	177.5	176.7	-0.5	113.6	R65 M67 P71	R65-R69 PolarHBondContact O-N 2.81Å; R65-R69 VanDerWaalsContact O-N 3.15Å; M67-R69 VanDerWaalsContact C-N 3.25Å; M67-R69 PolarHBondContact O-N 2.89Å; R69-P71 WeakPolarHBondContact O-CD 3.39Å
70	V	82.8	Confident	82.5	Confident	54 Å²	54	64 Å²	64	33%	0.327	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-64.7	125.7	171	177.7	0	0	0	0	108.1	R65 L68	R65-V70 HydrophobicContact CB-CB 4.07Å; R65-V70 HydrophobicContact CG-CB 4.2Å; R65-V70 HydrophobicContact CG-CG1 4.39Å; R65-V70 HydrophobicContact CG-CG2 4.38Å; R65-V70 PolarHBondContact O-N 2.95Å; L68-V70 HydrophobicContact CB-CG2 3.82Å; L68-V70 HydrophobicContact CD1-CG2 4.28Å; L68-V70 PolarHBondContact O-N 2.76Å
71	P	73.5	Confident	81.9	Confident	94 Å²	94	65.7 Å²	65.7	61%	0.61	40%	0.399	S	S	*	.	P	Polyproline II helix	trans	-57.4	157	179.1	-26.9	35.5	0	0	0	113.2	R69 G73	R69-P71 WeakPolarHBondContact O-CD 3.39Å; P71-G73 PolarHBondContact O-N 2.97Å
72	P	69.5	Low	81.8	Confident	84 Å²	84	66.6 Å²	66.6	55%	0.545	41%	0.406	S	S	.	.	S	Bend	trans	-50.4	135.9	162.2	-23.4	33.5	0	0	0	110.6	L198	P72-L198 HydrophobicContact CG-CB 4.41Å; P72-L198 WeakPolarHBondContact CG-O 3.41Å
73	G	68.6	Low	81.8	Confident	54 Å²	54	68.6 Å²	68.6	56%	0.557	41%	0.413	S	S	*	.			trans	-166.2	-159.6	-179.8	0	0	0	0	0	108.7	P71 D75	P71-G73 PolarHBondContact O-N 2.97Å; G73-D75 PolarHBondContact O-N 3.29Å
74	V	68.1	Low	81.9	Confident	132 Å²	132	74.2 Å²	74.2	80%	0.8	44%	0.437	S	S	*	.	S	Bend	trans	-52.6	134.3	-179.7	-173.7	0	0	0	0	111.3	R65	R65-V74 PolarHBondContact NH1-O 2.93Å
75	D	68.1	Low	82	Confident	148 Å²	148	76 Å²	76	79%	0.791	45%	0.447	S	S	*	.			trans	-54.6	143.2	-179.7	-91.8	-45.8	0	0	0	111.8	G73 G77	G73-D75 PolarHBondContact O-N 3.29Å; D75-G77 PolarHBondContact O-N 2.8Å; D75-G77 VanDerWaalsContact O-N 3.12Å
76	A	73.8	Confident	82.3	Confident	44 Å²	44	79.1 Å²	79.1	36%	0.364	46%	0.464	S	S	.	.			trans	-73.7	106.5	178.2	0	0	0	0	0	110.1	T61	T61-A76 HydrophobicContact CG2-CB 4.05Å
77	G	77.7	Confident	82.5	Confident	53 Å²	53	80 Å²	80	55%	0.546	47%	0.468	S	S	.	.			trans	-62.3	174.9	167.3	0	0	0	0	0	112.7	D75 T79	D75-G77 PolarHBondContact O-N 2.8Å; D75-G77 VanDerWaalsContact O-N 3.12Å; G77-T79 PolarHBondContact O-N 3.46Å
78	P	80.8	Confident	82.7	Confident	112 Å²	112	88 Å²	88	73%	0.727	50%	0.498	S	S	*	.			trans	-57.6	124.7	-179.5	-24.2	34.7	0	0	0	112.7	H80	P78-H80 PolarHBondContact O-CD2 3.03Å; P78-H80 PolarHBondContact O-N 3.45Å
79	T	82	Confident	82.9	Confident	28 Å²	28	86.1 Å²	86.1	17%	0.172	49%	0.488	C	S	.	.			trans	-68.3	114.1	176.2	-43.7	0	0	0	0	110.6	T61 G77 I83 D98 G100	T61-T79 PolarHBondContact OG1-OG1 2.76Å; T61-T79 VanDerWaalsContact OG1-OG1 3.08Å; G77-T79 PolarHBondContact O-N 3.46Å; T79-I83 HydrophobicContact CG2-CD1 3.87Å; T79-I83 HydrophobicContact CG2-CG1 4.06Å; T79-D98 PolarHBondContact OG1-OD2 3.28Å; T79-G100 WeakPolarHBondContact O-CA 3.39Å
80	H	78.8	Confident	83.2	Confident	169 Å²	169	82.8 Å²	82.8	78%	0.782	48%	0.48	S	S	*	.			trans	-94.2	127.2	170.7	-67.6	-92.1	0	0	0	109.7	P78	P78-H80 PolarHBondContact O-CD2 3.03Å; P78-H80 PolarHBondContact O-N 3.45Å
81	G	82.7	Confident	83.5	Confident	48 Å²	48	81.9 Å²	81.9	50%	0.495	47%	0.473	S	S	.	.	S	Bend	trans	76.1	-143.7	-177.4	0	0	0	0	0	113.8	G100	G81-G100 PolarHBondContact O-N 3.22Å; G81-G100 VanDerWaalsContact O-N 3.12Å
82	C	90.3	Very high	84.5	Confident	50 Å²	50	77.9 Å²	77.9	34%	0.338	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	128.1	179.1	178.5	0	0	0	0	110.1	D98 V99 L112	C82-D98 CarbonylContact C-O 3.59Å; C82-D98 VanDerWaalsContact CA-O 3.25Å; C82-D98 WeakPolarHBondContact CA-O 3.29Å; C82-V99 HydrophobicContact CB-CG2 4.39Å; C82-L112 HydrophobicContact CB-CD1 4.06Å
83	I	92.9	Very high	85.8	Confident	82 Å²	82	76 Å²	76	42%	0.421	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	119.9	175.6	-53.6	178.8	0	0	0	108.5	T79 N85 D98	T79-I83 HydrophobicContact CG2-CD1 3.87Å; T79-I83 HydrophobicContact CG2-CG1 4.06Å; I83-N85 PolarHBondContact O-ND2 2.92Å; I83-D98 HydrophobicContact CB-CB 4.39Å; I83-D98 PolarHBondContact N-O 2.72Å; I83-D98 PolarHBondContact O-N 3.05Å
84	K	95.1	Very high	87.2	Confident	120 Å²	120	73.4 Å²	73.4	52%	0.522	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	128.2	174.2	-53.5	-153.1	172.7	-163.4	0	109.3	T95 L97 E115	K84-T95 HydrophobicContact CB-CG2 4.38Å; K84-L97 HydrophobicContact CB-CD2 4.25Å; K84-L97 HydrophobicContact CD-CD2 3.6Å; K84-L97 HydrophobicContact CG-CD2 3.59Å; K84-E115 IonicContact NZ-OE2 3.52Å; K84-E115 PolarHBondContact NZ-OE2 2.74Å
85	N	95.3	Very high	88.6	Confident	38 Å²	38	68.1 Å²	68.1	20%	0.203	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	127.8	178.8	-64	-102	0	0	0	108.6	I64 L68 I83 T95 L96	I64-N85 HydrophobicContact CG2-CB 4.07Å; L68-N85 HydrophobicContact CD1-CB 4.17Å; I83-N85 PolarHBondContact O-ND2 2.92Å; N85-T95 CarbonylContact O-C 3.5Å; N85-T95 WeakPolarHBondContact O-CA 3.14Å; N85-L96 HydrophobicContact CB-CB 4.39Å; N85-L96 PolarHBondContact N-O 3.31Å; N85-L96 PolarHBondContact O-N 2.82Å
86	E	95.8	Very high	90	Very high	125 Å²	125	61 Å²	61	58%	0.584	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.5	137.2	-180	-59	-158.9	151.7	0	0	111.9	V94 T95	E86-V94 WeakPolarHBondContact CA-O 3.42Å; E86-T95 HydrophobicContact CG-CG2 4.23Å; E86-T95 PolarHBondContact OE1-OG1 3.27Å
87	L	94.4	Very high	91.1	Very high	21 Å²	21	59 Å²	59	11%	0.11	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	145.7	176.7	74.5	97.6	0	0	0	111.7	M67 L68 V89 V94 L96 L210	M67-L87 HydrophobicContact CB-CD2 4.19Å; L68-L87 HydrophobicContact CD2-CB 3.7Å; L68-L87 HydrophobicContact CD2-CD2 3.87Å; L68-L87 HydrophobicContact CD2-CG 4.43Å; L68-L87 HydrophobicContact CG-CD2 4.24Å; L87-V89 HydrophobicContact CD1-CG2 3.27Å; L87-V94 HydrophobicContact CG-CB 4.41Å; L87-V94 PolarHBondContact N-O 2.91Å; L87-V94 WeakPolarHBondContact O-CA 3.37Å; L87-V94 WeakPolarHBondContact O-CB 3.24Å; L87-V94 PolarHBondContact O-N 3.24Å; L87-L96 HydrophobicContact CD2-CD1 3.58Å; L87-L96 HydrophobicContact CD2-CG 4Å; L87-L210 HydrophobicContact CD1-CD2 4.12Å
88	R	93.9	Very high	92	Very high	178 Å²	178	56.5 Å²	56.5	67%	0.672	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.6	124.6	177.6	-170.9	173	179	153	-1.8	110.6	Y92	R88-Y92 WeakPolarHBondContact CA-O 3.29Å
89	V	92.6	Very high	92.6	Very high	9 Å²	9	51.2 Å²	51.2	6%	0.055	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	119.2	169.6	-170	0	0	0	0	107.3	L87 N91 Y92 V94 L207 L210 R211 L214	L87-V89 HydrophobicContact CD1-CG2 3.27Å; V89-N91 PolarHBondContact O-N 2.79Å; V89-N91 VanDerWaalsContact O-N 3.17Å; V89-Y92 PolarHBondContact N-O 2.79Å; V89-Y92 WeakPolarHBondContact O-CA 3.46Å; V89-Y92 WeakPolarHBondContact O-CB 3.33Å; V89-Y92 WeakPolarHBondContact O-CD2 3.07Å; V89-Y92 PolarHBondContact O-N 2.76Å; V89-V94 HydrophobicContact CB-CG2 4.5Å; V89-V94 HydrophobicContact CG2-CG2 4.15Å; V89-L207 HydrophobicContact CG2-CD1 4.32Å; V89-L210 HydrophobicContact CG2-CD2 3.91Å; V89-R211 HydrophobicContact CG1-CG 3.96Å; V89-L214 HydrophobicContact CB-CD1 3.65Å; V89-L214 HydrophobicContact CG1-CD1 3.9Å; V89-L214 HydrophobicContact CG2-CD1 3.9Å
90	E	89.7	Confident	93.1	Very high	96 Å²	96	50 Å²	50	45%	0.449	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.3	-121.8	175.5	-66.6	151.8	-150.9	0	0	111.1	Y92 R211	E90-Y92 HydrophobicContact CB-CD2 4.48Å; E90-R211 VanDerWaalsContact OE1-CD 3.28Å; E90-R211 WeakPolarHBondContact OE1-CD 3.13Å; E90-R211 IonicContact OE1-CZ 3.17Å; E90-R211 IonicContact OE1-NE 2.75Å; E90-R211 IonicContact OE1-NH1 3.3Å; E90-R211 PolarHBondContact OE1-NH1 2.77Å
91	N	90.6	Very high	93.6	Very high	34 Å²	34	42.2 Å²	42.2	18%	0.182	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.6	22.7	173.9	63.4	-24.9	0	0	0	114.4	E43 L45 R46 V89	E43-N91 PolarHBondContact OE2-ND2 3.19Å; L45-N91 WeakPolarHBondContact CA-O 3.25Å; R46-N91 PolarHBondContact N-O 3.21Å; R46-N91 PolarHBondContact NH1-ND2 2.84Å; V89-N91 PolarHBondContact O-N 2.79Å; V89-N91 VanDerWaalsContact O-N 3.17Å
92	Y	94.6	Very high	94.1	Very high	10 Å²	10	42 Å²	42	4%	0.039	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	131.4	176.1	-54.1	-88.5	0	0	0	112	R46 V48 R88 V89 E90 L214 C218	R46-Y92 HydrophobicContact CB-CD1 3.72Å; R46-Y92 HydrophobicContact CB-CE1 3.95Å; R46-Y92 HydrophobicContact CG-CE1 4.36Å; R46-Y92 PolarHBondContact NH1-OH 2.84Å; R46-Y92 CarbonylContact O-C 3.52Å; R46-Y92 VanDerWaalsContact O-CA 3.31Å; R46-Y92 WeakPolarHBondContact O-CA 3.4Å; V48-Y92 HydrophobicContact CG2-CD1 3.73Å; V48-Y92 HydrophobicContact CG2-CE1 4.47Å; R88-Y92 WeakPolarHBondContact CA-O 3.29Å; V89-Y92 PolarHBondContact N-O 2.79Å; V89-Y92 WeakPolarHBondContact O-CA 3.46Å; V89-Y92 WeakPolarHBondContact O-CB 3.33Å; V89-Y92 WeakPolarHBondContact O-CD2 3.07Å; V89-Y92 PolarHBondContact O-N 2.76Å; E90-Y92 HydrophobicContact CB-CD2 4.48Å; Y92-L214 HydrophobicContact CD1-CD2 4.25Å; Y92-L214 HydrophobicContact CD2-CB 4.16Å; Y92-L214 HydrophobicContact CD2-CD1 4.11Å; Y92-L214 HydrophobicContact CE2-CB 4.25Å; Y92-L214 HydrophobicContact CG-CB 4.34Å; Y92-L214 HydrophobicContact CG-CD1 4.21Å; Y92-L214 HydrophobicContact CG-CD2 4.14Å; Y92-L214 HydrophobicContact CG-CG 4.46Å; Y92-C218 WeakPolarHBondContact OH-CB 3.41Å; Y92-C218 PolarHBondContact OH-SG 2.84Å
93	L	96.3	Very high	94.1	Very high	44 Å²	44	43.1 Å²	43.1	23%	0.23	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	112.4	159.1	177.4	62.1	0	0	0	107.7	L45 R46 K47 V48	L45-L93 HydrophobicContact CD1-CB 4.28Å; L45-L93 HydrophobicContact CD2-CB 4.14Å; L45-L93 HydrophobicContact CG-CB 4.11Å; R46-L93 PolarHBondContact O-N 2.73Å; K47-L93 WeakPolarHBondContact CA-O 3.46Å; K47-L93 HydrophobicContact CG-CD2 4.42Å; V48-L93 PolarHBondContact N-O 3.17Å
94	V	97.8	Very high	93.9	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	120	-169.4	-169.4	0	0	0	0	110.2	V48 I50 E86 L87 V89 L96 L210 L214	V48-V94 CarbonylContact O-C 3.46Å; V48-V94 WeakPolarHBondContact O-CA 3.24Å; I50-V94 HydrophobicContact CG1-CG1 3.95Å; E86-V94 WeakPolarHBondContact CA-O 3.42Å; L87-V94 HydrophobicContact CG-CB 4.41Å; L87-V94 PolarHBondContact N-O 2.91Å; L87-V94 WeakPolarHBondContact O-CA 3.37Å; L87-V94 WeakPolarHBondContact O-CB 3.24Å; L87-V94 PolarHBondContact O-N 3.24Å; V89-V94 HydrophobicContact CB-CG2 4.5Å; V89-V94 HydrophobicContact CG2-CG2 4.15Å; V94-L96 HydrophobicContact CG1-CD2 3.69Å; V94-L96 HydrophobicContact CG1-CG 4.42Å; V94-L210 HydrophobicContact CG1-CD1 4.45Å; V94-L214 HydrophobicContact CG1-CD2 4.3Å; V94-L214 HydrophobicContact CG2-CD1 3.86Å; V94-L214 HydrophobicContact CG2-CD2 3.68Å; V94-L214 HydrophobicContact CG2-CG 4.41Å
95	T	97.9	Very high	93.5	Very high	21 Å²	21	43.6 Å²	43.6	13%	0.129	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	104.7	174	-52.2	0	0	0	0	108.8	V48 T49 I50 K84 N85 E86 L97	V48-T95 PolarHBondContact O-N 3.25Å; T49-T95 WeakPolarHBondContact CA-O 3.19Å; I50-T95 PolarHBondContact N-O 3.43Å; K84-T95 HydrophobicContact CB-CG2 4.38Å; N85-T95 CarbonylContact O-C 3.5Å; N85-T95 WeakPolarHBondContact O-CA 3.14Å; E86-T95 HydrophobicContact CG-CG2 4.23Å; E86-T95 PolarHBondContact OE1-OG1 3.27Å; T95-L97 HydrophobicContact CG2-CD2 4.22Å
96	L	97.9	Very high	93.4	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	125.5	174.2	-56.3	-171.8	0	0	0	110.3	I50 V52 I64 M67 N85 L87 V94 L210	I50-L96 HydrophobicContact CB-CD2 3.74Å; I50-L96 HydrophobicContact CG1-CD2 4.32Å; I50-L96 HydrophobicContact CG2-CD2 4.09Å; I50-L96 WeakPolarHBondContact O-CA 3.45Å; V52-L96 HydrophobicContact CG2-CB 4.26Å; I64-L96 HydrophobicContact CB-CD1 4.48Å; I64-L96 HydrophobicContact CG1-CD1 3.98Å; I64-L96 HydrophobicContact CG2-CD1 4.19Å; M67-L96 HydrophobicContact SD-CD1 3.59Å; M67-L96 VanDerWaalsContact SD-CD1 3.59Å; N85-L96 HydrophobicContact CB-CB 4.39Å; N85-L96 PolarHBondContact N-O 3.31Å; N85-L96 PolarHBondContact O-N 2.82Å; L87-L96 HydrophobicContact CD2-CD1 3.58Å; L87-L96 HydrophobicContact CD2-CG 4Å; V94-L96 HydrophobicContact CG1-CD2 3.69Å; V94-L96 HydrophobicContact CG1-CG 4.42Å; L96-L210 HydrophobicContact CD2-CD1 4.48Å
97	L	97	Very high	93	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	102	174.2	-52.5	179.1	0	0	0	109.2	T49 I50 L51 V52 K84 T95 L112	T49-L97 HydrophobicContact CG2-CD1 3.64Å; T49-L97 HydrophobicContact CG2-CD2 4.3Å; T49-L97 HydrophobicContact CG2-CG 3.86Å; I50-L97 PolarHBondContact O-N 3.43Å; L51-L97 HydrophobicContact CD1-CB 4.07Å; L51-L97 HydrophobicContact CD1-CD1 4.49Å; V52-L97 WeakPolarHBondContact CB-O 3.49Å; V52-L97 PolarHBondContact N-O 3.06Å; K84-L97 HydrophobicContact CB-CD2 4.25Å; K84-L97 HydrophobicContact CD-CD2 3.6Å; K84-L97 HydrophobicContact CG-CD2 3.59Å; T95-L97 HydrophobicContact CG2-CD2 4.22Å; L97-L112 HydrophobicContact CD1-CB 4.27Å; L97-L112 HydrophobicContact CD1-CD2 4.3Å
98	D	95.4	Very high	92.8	Very high	1 Å²	1	40 Å²	40	1%	0.005	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	128.1	171.8	-167.8	24.8	0	0	0	109.7	K60 T61 I64 T79 C82 I83	K60-D98 WeakPolarHBondContact CB-OD1 3.09Å; T61-D98 VanDerWaalsContact CB-OD2 3.29Å; T61-D98 WeakPolarHBondContact CB-OD2 3.49Å; T61-D98 WeakPolarHBondContact CG2-OD2 3.44Å; T61-D98 PolarHBondContact OG1-OD2 2.89Å; I64-D98 HydrophobicContact CD1-CB 3.46Å; I64-D98 VanDerWaalsContact CD1-CB 3.46Å; T79-D98 PolarHBondContact OG1-OD2 3.28Å; C82-D98 CarbonylContact C-O 3.59Å; C82-D98 VanDerWaalsContact CA-O 3.25Å; C82-D98 WeakPolarHBondContact CA-O 3.29Å; I83-D98 HydrophobicContact CB-CB 4.39Å; I83-D98 PolarHBondContact N-O 2.72Å; I83-D98 PolarHBondContact O-N 3.05Å
99	V	93.4	Very high	92.7	Very high	2 Å²	2	31.7 Å²	31.7	1%	0.012	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	144.4	-174.3	-160.4	0	0	0	0	111.5	L51 K60 C82 G101 L112	L51-V99 HydrophobicContact CD1-CG2 3.62Å; K60-V99 WeakPolarHBondContact CE-O 3.47Å; K60-V99 PolarHBondContact NZ-O 3.41Å; C82-V99 HydrophobicContact CB-CG2 4.39Å; V99-G101 PolarHBondContact O-N 3.48Å; V99-L112 HydrophobicContact CG1-CD1 4.4Å; V99-L112 HydrophobicContact CG2-CD1 3.62Å
100	G	91.8	Very high	92.7	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.01	20%	0.198	C	C	.	.			trans	-48.1	136.6	173	0	0	0	0	0	113	T79 G81 S105 W109	T79-G100 WeakPolarHBondContact O-CA 3.39Å; G81-G100 PolarHBondContact O-N 3.22Å; G81-G100 VanDerWaalsContact O-N 3.12Å; G100-S105 WeakPolarHBondContact CA-OG 3.44Å; G100-S105 PolarHBondContact O-OG 2.97Å; G100-W109 PolarHBondContact O-NE1 3.28Å
101	G	91.3	Very high	92.7	Very high	6 Å²	6	34.3 Å²	34.3	6%	0.062	20%	0.197	C	C	.	.			trans	-110.8	0.1	-175.6	0	0	0	0	0	116.1	D56 V99 S105 R106	D56-G101 PolarHBondContact N-O 2.82Å; V99-G101 PolarHBondContact O-N 3.48Å; G101-S105 PolarHBondContact N-OG 3.01Å; G101-R106 PolarHBondContact O-NE 3.34Å; G101-R106 PolarHBondContact O-NH2 3.42Å; G101-R106 VanDerWaalsContact O-NH2 3.11Å
102	S	92.2	Very high	92.9	Very high	44 Å²	44	33.5 Å²	33.5	31%	0.308	19%	0.193	S	C	.	.	S	Bend	trans	-66.4	155.8	175.4	65.2	0	0	0	0	110.3	E104 S105 R106	S102-E104 PolarHBondContact O-N 3.17Å; S102-E104 VanDerWaalsContact O-N 3.08Å; S102-S105 PolarHBondContact N-OG 3.43Å; S102-S105 PolarHBondContact O-N 3.45Å; S102-S105 PolarHBondContact O-OG 2.93Å; S102-S105 PolarHBondContact OG-N 3.27Å; S102-S105 PolarHBondContact OG-OG 3.2Å; S102-R106 WeakPolarHBondContact O-CG 3.49Å; S102-R106 PolarHBondContact O-N 2.99Å; S102-R106 VanDerWaalsContact O-N 3.09Å
103	A	90.7	Very high	93	Very high	74 Å²	74	33.6 Å²	33.6	61%	0.612	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.1	-37.1	179.5	0	0	0	0	0	113
104	E	88.3	Confident	92.9	Very high	184 Å²	184	31.5 Å²	31.5	86%	0.86	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-40.1	176.8	-59.9	173	171.7	0	0	113.3	S102	S102-E104 PolarHBondContact O-N 3.17Å; S102-E104 VanDerWaalsContact O-N 3.08Å
105	S	87.8	Confident	92.7	Very high	28 Å²	28	34.2 Å²	34.2	20%	0.196	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-83.5	-21.3	-174.9	50.9	0	0	0	0	114	G100 G101 S102 G107 A108	G100-S105 WeakPolarHBondContact CA-OG 3.44Å; G100-S105 PolarHBondContact O-OG 2.97Å; G101-S105 PolarHBondContact N-OG 3.01Å; S102-S105 PolarHBondContact N-OG 3.43Å; S102-S105 PolarHBondContact O-N 3.45Å; S102-S105 PolarHBondContact O-OG 2.93Å; S102-S105 PolarHBondContact OG-N 3.27Å; S102-S105 PolarHBondContact OG-OG 3.2Å; S105-G107 PolarHBondContact O-N 2.96Å; S105-A108 WeakPolarHBondContact O-CB 3.12Å; S105-A108 PolarHBondContact O-N 3.03Å
106	R	91.5	Very high	92.7	Very high	38 Å²	38	33.2 Å²	33.2	14%	0.143	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-54.4	-25.5	174	-70.7	168.3	-151.6	167.5	9.6	113.7	D56 G101 S102 A108 W109 E133	D56-R106 IonicContact OD1-NH2 3.2Å; G101-R106 PolarHBondContact O-NE 3.34Å; G101-R106 PolarHBondContact O-NH2 3.42Å; G101-R106 VanDerWaalsContact O-NH2 3.11Å; S102-R106 WeakPolarHBondContact O-CG 3.49Å; S102-R106 PolarHBondContact O-N 2.99Å; S102-R106 VanDerWaalsContact O-N 3.09Å; R106-A108 PolarHBondContact O-N 3.28Å; R106-W109 HydrophobicContact CB-CD2 4.42Å; R106-W109 HydrophobicContact CG-CD2 4.41Å; R106-W109 HydrophobicContact CG-CH2 3.91Å; R106-W109 HydrophobicContact CG-CZ2 3.65Å; R106-W109 HydrophobicContact CG-CZ3 4.4Å; R106-W109 WeakPolarHBondContact O-CB 3.18Å; R106-W109 PolarHBondContact O-N 2.88Å; R106-E133 IonicContact CZ-OE1 2.74Å; R106-E133 IonicContact NH1-OE1 2.68Å; R106-E133 PolarHBondContact NH1-OE1 3.48Å; R106-E133 IonicContact NH2-OE1 2.74Å; R106-E133 PolarHBondContact NH2-OE1 3.34Å
107	G	88.9	Confident	92.7	Very high	35 Å²	35	34 Å²	34	36%	0.361	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	-60.4	-26.3	175	0	0	0	0	0	114.6	S105	S105-G107 PolarHBondContact O-N 2.96Å
108	A	88.6	Confident	92.7	Very high	35 Å²	35	34 Å²	34	29%	0.289	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	-77.4	-20.6	178.5	0	0	0	0	0	113.4	S105 R106 R110 E111	S105-A108 WeakPolarHBondContact O-CB 3.12Å; S105-A108 PolarHBondContact O-N 3.03Å; R106-A108 PolarHBondContact O-N 3.28Å; A108-R110 PolarHBondContact O-N 3.36Å; A108-R110 VanDerWaalsContact O-N 3.11Å; A108-E111 PolarHBondContact O-N 3.45Å; A108-E111 VanDerWaalsContact O-N 3.17Å
109	W	93.7	Very high	92.9	Very high	3 Å²	3	34 Å²	34	1%	0.011	19%	0.193	C	C	.	.	H	α-helix	trans	-58.6	-30.9	-177.6	-61	3.6	0	0	0	112.3	V53 G54 G100 R106 E111 L112 Y113 V137	V53-W109 HydrophobicContact CB-CD2 4.04Å; V53-W109 HydrophobicContact CB-CE3 3.93Å; V53-W109 HydrophobicContact CB-CH2 3.88Å; V53-W109 HydrophobicContact CB-CZ2 3.94Å; V53-W109 HydrophobicContact CB-CZ3 3.86Å; V53-W109 HydrophobicContact CG1-CD2 3.48Å; V53-W109 VanDerWaalsContact CG1-CD2 3.48Å; V53-W109 HydrophobicContact CG1-CE3 3.82Å; V53-W109 HydrophobicContact CG1-CG 3.84Å; V53-W109 HydrophobicContact CG1-CH2 4.36Å; V53-W109 HydrophobicContact CG1-CZ2 4.03Å; V53-W109 HydrophobicContact CG1-CZ3 4.25Å; G54-W109 WeakPolarHBondContact O-CZ2 3.35Å; G100-W109 PolarHBondContact O-NE1 3.28Å; R106-W109 HydrophobicContact CB-CD2 4.42Å; R106-W109 HydrophobicContact CG-CD2 4.41Å; R106-W109 HydrophobicContact CG-CH2 3.91Å; R106-W109 HydrophobicContact CG-CZ2 3.65Å; R106-W109 HydrophobicContact CG-CZ3 4.4Å; R106-W109 WeakPolarHBondContact O-CB 3.18Å; R106-W109 PolarHBondContact O-N 2.88Å; W109-E111 PolarHBondContact O-N 3.46Å; W109-L112 PolarHBondContact O-N 3.01Å; W109-Y113 HydrophobicContact CB-CE1 3.68Å; W109-Y113 WeakPolarHBondContact CB-OH 3.31Å; W109-Y113 WeakPolarHBondContact O-CD1 3.45Å; W109-Y113 WeakPolarHBondContact O-CE1 3.19Å; W109-Y113 PolarHBondContact O-N 3.34Å; W109-V137 HydrophobicContact CH2-CG1 3.82Å; W109-V137 HydrophobicContact CZ3-CG1 3.58Å
110	R	91.4	Very high	93.1	Very high	67 Å²	67	34 Å²	34	25%	0.253	19%	0.192	S	C	.	.	H	α-helix	trans	-58.1	-32.2	-179.9	-68.5	-178.2	175.7	-74.1	-22.5	113.9	A108 L112 Y113 Q144 L236 E240	A108-R110 PolarHBondContact O-N 3.36Å; A108-R110 VanDerWaalsContact O-N 3.11Å; R110-L112 VanDerWaalsContact C-N 3.33Å; R110-Y113 HydrophobicContact CB-CD2 4.47Å; R110-Y113 HydrophobicContact CB-CE2 4.29Å; R110-Y113 HydrophobicContact CG-CD2 4.4Å; R110-Y113 HydrophobicContact CG-CE2 3.8Å; R110-Q144 VanDerWaalsContact NH1-CD 3.29Å; R110-L236 HydrophobicContact CB-CD1 4.38Å; R110-E240 WeakPolarHBondContact CD-OE1 3.33Å; R110-E240 IonicContact CZ-OE1 3.61Å; R110-E240 IonicContact NE-OE1 2.73Å; R110-E240 IonicContact NH1-OE1 3.15Å; R110-E240 PolarHBondContact NH1-OE1 3.44Å
111	E	90.8	Very high	93.4	Very high	93 Å²	93	33.9 Å²	33.9	44%	0.435	19%	0.192	S	C	.	.	H	α-helix	trans	-70.7	-31.8	178.5	-70.3	154.7	-157.4	0	0	111.5	A108 W109 L236 K244	A108-E111 PolarHBondContact O-N 3.45Å; A108-E111 VanDerWaalsContact O-N 3.17Å; W109-E111 PolarHBondContact O-N 3.46Å; E111-L236 HydrophobicContact CB-CD1 4.45Å; E111-L236 HydrophobicContact CG-CD1 3.55Å; E111-K244 IonicContact OE1-NZ 3.62Å; E111-K244 PolarHBondContact OE1-NZ 3.19Å
112	L	94.4	Very high	93.8	Very high	18 Å²	18	33.7 Å²	33.7	9%	0.094	19%	0.189	C	C	.	.	H	α-helix	trans	-94.9	-13	-171.8	-56.9	173.9	0	0	0	113.8	L51 C82 L97 V99 W109 R110 G114 E115 A116	L51-L112 HydrophobicContact CD1-CB 4.06Å; L51-L112 HydrophobicContact CD1-CD1 4.17Å; L51-L112 HydrophobicContact CD2-CB 4.41Å; C82-L112 HydrophobicContact CB-CD1 4.06Å; L97-L112 HydrophobicContact CD1-CB 4.27Å; L97-L112 HydrophobicContact CD1-CD2 4.3Å; V99-L112 HydrophobicContact CG1-CD1 4.4Å; V99-L112 HydrophobicContact CG2-CD1 3.62Å; W109-L112 PolarHBondContact O-N 3.01Å; R110-L112 VanDerWaalsContact C-N 3.33Å; L112-G114 PolarHBondContact O-N 3.35Å; L112-E115 PolarHBondContact O-N 3.39Å; L112-A116 PolarHBondContact O-N 2.74Å
113	Y	95.3	Very high	94	Very high	12 Å²	12	31.7 Å²	31.7	5%	0.047	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-29.2	176.6	-63	-24.9	0	0	0	113.2	L51 W109 R110 L141 Q144 R146 V147 K150	L51-Y113 HydrophobicContact CD2-CD1 3.52Å; L51-Y113 HydrophobicContact CD2-CE1 3.81Å; W109-Y113 HydrophobicContact CB-CE1 3.68Å; W109-Y113 WeakPolarHBondContact CB-OH 3.31Å; W109-Y113 WeakPolarHBondContact O-CD1 3.45Å; W109-Y113 WeakPolarHBondContact O-CE1 3.19Å; W109-Y113 PolarHBondContact O-N 3.34Å; R110-Y113 HydrophobicContact CB-CD2 4.47Å; R110-Y113 HydrophobicContact CB-CE2 4.29Å; R110-Y113 HydrophobicContact CG-CD2 4.4Å; R110-Y113 HydrophobicContact CG-CE2 3.8Å; Y113-L141 HydrophobicContact CD1-CD1 4.08Å; Y113-L141 HydrophobicContact CE1-CD1 3.27Å; Y113-Q144 HydrophobicContact CD2-CB 4.15Å; Y113-Q144 HydrophobicContact CD2-CG 4.09Å; Y113-Q144 HydrophobicContact CE2-CB 4.27Å; Y113-Q144 HydrophobicContact CE2-CG 3.7Å; Y113-R146 VanDerWaalsContact O-O 3.06Å; Y113-V147 HydrophobicContact CD1-CG2 3.68Å; Y113-V147 HydrophobicContact CD2-CG2 3.99Å; Y113-V147 HydrophobicContact CE1-CG2 4.28Å; Y113-V147 HydrophobicContact CG-CG2 3.53Å; Y113-K150 PolarHBondContact O-NZ 3.29Å
114	G	94	Very high	94.3	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-43.7	176.5	0	0	0	0	0	113.4	L112 A116	L112-G114 PolarHBondContact O-N 3.35Å; G114-A116 VanDerWaalsContact C-N 3.33Å; G114-A116 PolarHBondContact O-N 3.35Å
115	E	95.3	Very high	94.8	Very high	56 Å²	56	20 Å²	20	26%	0.262	11%	0.109	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-29.5	179.7	-66.6	-178.6	-145.5	0	0	113.2	T49 K84 L112 H117 V228	T49-E115 VanDerWaalsContact CB-O 3.26Å; T49-E115 WeakPolarHBondContact CB-O 3.28Å; T49-E115 HydrophobicContact CG2-CB 4.4Å; K84-E115 IonicContact NZ-OE2 3.52Å; K84-E115 PolarHBondContact NZ-OE2 2.74Å; L112-E115 PolarHBondContact O-N 3.39Å; E115-H117 PolarHBondContact O-ND1 3.49Å; E115-V228 WeakPolarHBondContact O-CG1 3.49Å
116	A	97	Very high	95.2	Very high	1 Å²	1	19.8 Å²	19.8	1%	0.008	11%	0.107	C	C	.	.			trans	-72.5	132.3	-174.3	0	0	0	0	0	112.8	L51 L112 G114 K150 V228	L51-A116 HydrophobicContact CB-CB 3.7Å; L112-A116 PolarHBondContact O-N 2.74Å; G114-A116 VanDerWaalsContact C-N 3.33Å; G114-A116 PolarHBondContact O-N 3.35Å; A116-K150 VanDerWaalsContact O-CD 3.24Å; A116-K150 WeakPolarHBondContact O-CD 3.3Å; A116-K150 VanDerWaalsContact O-CE 3.29Å; A116-K150 WeakPolarHBondContact O-CE 3.48Å; A116-K150 PolarHBondContact O-NZ 2.86Å; A116-V228 WeakPolarHBondContact O-CG2 3.41Å
117	H	97.9	Very high	95.4	Very high	15 Å²	15	19.7 Å²	19.7	7%	0.069	11%	0.109	C	C	.	.	S	Bend	trans	-87.8	-36.8	170.1	-62.3	58.7	0	0	0	110.9	V48 T49 E115 V217 L224 C225	V48-H117 HydrophobicContact CG1-CB 3.98Å; T49-H117 PolarHBondContact N-ND1 3.08Å; T49-H117 WeakPolarHBondContact O-CB 3.44Å; T49-H117 PolarHBondContact O-N 3.06Å; E115-H117 PolarHBondContact O-ND1 3.49Å; H117-V217 HydrophobicContact CB-CG1 4.29Å; H117-V217 HydrophobicContact CB-CG2 4.5Å; H117-L224 HydrophobicContact CB-CD2 4.25Å; H117-L224 HydrophobicContact CB-CG 4.35Å; H117-C225 PolarHBondContact NE2-SG 3.27Å; H117-C225 VanDerWaalsContact NE2-SG 3.36Å
118	G	97.7	Very high	95.7	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	169.2	174.7	0	0	0	0	0	111.2	I50 L51 P151	I50-G118 WeakPolarHBondContact CA-O 3.28Å; L51-G118 PolarHBondContact N-O 3.26Å; L51-G118 VanDerWaalsContact N-O 3.1Å; G118-P151 WeakPolarHBondContact CA-O 3.46Å
119	V	98.3	Very high	96	Very high	2 Å²	2	31 Å²	31	1%	0.012	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	140.5	-173.4	-178.5	0	0	0	0	111.1	L51 V53 L141 V147 P151 I152 L153	L51-V119 WeakPolarHBondContact O-CA 3.48Å; V53-V119 HydrophobicContact CG2-CG1 3.61Å; V119-L141 HydrophobicContact CG1-CD2 4.21Å; V119-V147 HydrophobicContact CG2-CG1 4.16Å; V119-P151 PolarHBondContact N-O 3.4Å; V119-I152 HydrophobicContact CB-CG1 4.26Å; V119-I152 HydrophobicContact CG1-CD1 4.36Å; V119-I152 HydrophobicContact CG1-CG1 4.38Å; V119-I152 CarbonylContact O-C 3.55Å; V119-I152 WeakPolarHBondContact O-CA 3.39Å; V119-L153 PolarHBondContact O-N 3.49Å
120	I	98.6	Very high	96.1	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.005	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	118.4	166.6	-61.3	178.7	0	0	0	107.9	I50 L51 V52 V53 M67 V122 L153 L155 L210 L213	I50-I120 HydrophobicContact CG2-CB 4.49Å; I50-I120 HydrophobicContact CG2-CD1 3.72Å; I50-I120 HydrophobicContact CG2-CG1 3.59Å; L51-I120 PolarHBondContact O-N 2.95Å; V52-I120 WeakPolarHBondContact CA-O 3.46Å; V52-I120 HydrophobicContact CG1-CB 4.24Å; V52-I120 HydrophobicContact CG1-CG2 4.19Å; V52-I120 HydrophobicContact CG2-CB 4.27Å; V52-I120 HydrophobicContact CG2-CD1 4.31Å; V53-I120 PolarHBondContact N-O 3.34Å; M67-I120 HydrophobicContact CE-CD1 3.94Å; I120-V122 HydrophobicContact CG2-CG2 3.93Å; I120-L153 CarbonylContact C-O 3.57Å; I120-L153 WeakPolarHBondContact CA-O 3.19Å; I120-L153 HydrophobicContact CD1-CD2 4.2Å; I120-L153 HydrophobicContact CG1-CB 4.24Å; I120-L153 HydrophobicContact CG1-CD2 4.06Å; I120-L153 HydrophobicContact CG2-CD2 4.43Å; I120-L155 HydrophobicContact CG2-CD1 3.63Å; I120-L155 HydrophobicContact CG2-CG 3.77Å; I120-L210 HydrophobicContact CD1-CD1 4.29Å; I120-L213 HydrophobicContact CD1-CD2 4.14Å; I120-L213 HydrophobicContact CG1-CD2 3.54Å
121	F	98.4	Very high	96.3	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	111.2	175.2	-166.7	-100.8	0	0	0	109.7	V53 V123 A134 V137 L138 L141 I152 L153 V154 L155	V53-F121 HydrophobicContact CG2-CD2 4.29Å; V53-F121 WeakPolarHBondContact O-CA 3.42Å; F121-V123 HydrophobicContact CD1-CG2 3.58Å; F121-V123 HydrophobicContact CE1-CG2 3.67Å; F121-A134 WeakPolarHBondContact CZ-O 3.33Å; F121-V137 HydrophobicContact CE2-CG1 4.15Å; F121-V137 HydrophobicContact CZ-CG1 4.34Å; F121-L138 HydrophobicContact CB-CD1 4.35Å; F121-L138 HydrophobicContact CD1-CB 4.41Å; F121-L138 HydrophobicContact CD1-CD1 4.05Å; F121-L138 HydrophobicContact CD1-CD2 4.12Å; F121-L138 HydrophobicContact CD1-CG 4.43Å; F121-L138 HydrophobicContact CD2-CD1 4.01Å; F121-L138 HydrophobicContact CE1-CB 3.85Å; F121-L138 HydrophobicContact CE1-CD1 4.34Å; F121-L138 HydrophobicContact CE1-CD2 4.16Å; F121-L138 HydrophobicContact CE1-CG 4.34Å; F121-L138 HydrophobicContact CE2-CB 4.17Å; F121-L138 HydrophobicContact CE2-CD1 4.3Å; F121-L138 HydrophobicContact CG-CD1 3.88Å; F121-L138 HydrophobicContact CZ-CB 3.72Å; F121-L138 HydrophobicContact CZ-CD1 4.46Å; F121-L141 HydrophobicContact CD2-CD2 3.68Å; F121-L141 HydrophobicContact CE2-CD2 4.11Å; F121-I152 HydrophobicContact CB-CD1 4.11Å; F121-I152 HydrophobicContact CB-CG1 4.46Å; F121-L153 PolarHBondContact N-O 2.97Å; F121-V154 WeakPolarHBondContact O-CA 3.23Å; F121-L155 PolarHBondContact O-N 2.89Å
122	V	98.1	Very high	96.6	Very high	1 Å²	1	32.7 Å²	32.7	1%	0.006	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	124.6	-176.3	-168	0	0	0	0	110.3	V52 V53 A58 K60 I120 L155 N157	V52-V122 HydrophobicContact CG1-CG2 3.96Å; V53-V122 PolarHBondContact O-N 3.45Å; A58-V122 HydrophobicContact CB-CB 4.48Å; A58-V122 HydrophobicContact CB-CG1 4.31Å; A58-V122 WeakPolarHBondContact CB-O 3.48Å; A58-V122 WeakPolarHBondContact O-CG1 3.41Å; K60-V122 HydrophobicContact CB-CG2 4.42Å; K60-V122 HydrophobicContact CG-CB 3.83Å; K60-V122 HydrophobicContact CG-CG2 3.8Å; I120-V122 HydrophobicContact CG2-CG2 3.93Å; V122-L155 HydrophobicContact CB-CB 4.5Å; V122-L155 HydrophobicContact CG1-CB 4.25Å; V122-L155 HydrophobicContact CG2-CB 4.28Å; V122-L155 HydrophobicContact CG2-CD1 4.11Å; V122-N157 HydrophobicContact CG1-CB 3.94Å
123	V	97.9	Very high	96.7	Very high	3 Å²	3	34.9 Å²	34.9	2%	0.018	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	135.3	-176.6	-180	0	0	0	0	108.9	F121 S125 M131 V154 L155 N157 L170 L174	F121-V123 HydrophobicContact CD1-CG2 3.58Å; F121-V123 HydrophobicContact CE1-CG2 3.67Å; V123-S125 PolarHBondContact O-N 2.89Å; V123-M131 HydrophobicContact CG1-CE 3.46Å; V123-M131 VanDerWaalsContact CG1-CE 3.46Å; V123-M131 HydrophobicContact CG1-SD 3.77Å; V123-V154 HydrophobicContact CG2-CG1 3.97Å; V123-L155 PolarHBondContact N-O 3.16Å; V123-N157 WeakPolarHBondContact O-CA 3.46Å; V123-N157 VanDerWaalsContact O-CB 3.25Å; V123-N157 WeakPolarHBondContact O-CB 3.26Å; V123-N157 PolarHBondContact O-N 3.1Å; V123-L170 HydrophobicContact CG1-CD2 3.99Å; V123-L174 HydrophobicContact CG2-CD1 4.13Å
124	D	97.1	Very high	96.8	Very high	13 Å²	13	34.5 Å²	34.5	7%	0.07	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	95.8	169.5	-173.4	-20.5	0	0	0	109.3	S126 D127 M131 K158	D124-S126 PolarHBondContact O-N 3.46Å; D124-S126 WeakPolarHBondContact OD1-CB 3.36Å; D124-S126 PolarHBondContact OD1-N 3.3Å; D124-S126 PolarHBondContact OD1-OG 3.36Å; D124-D127 HydrophobicContact CB-CB 3.89Å; D124-D127 PolarHBondContact O-N 3.37Å; D124-M131 WeakPolarHBondContact O-CE 3.45Å; D124-K158 WeakPolarHBondContact OD1-CD 3.43Å; D124-K158 WeakPolarHBondContact OD2-CD 3.49Å; D124-K158 WeakPolarHBondContact OD2-CE 3.2Å; D124-K158 IonicContact OD2-NZ 2.9Å; D124-K158 PolarHBondContact OD2-NZ 2.94Å
125	S	97.2	Very high	97	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-23.8	-179.9	-70.5	0	0	0	0	113.5	V123 N157 Q159 A164 L165	V123-S125 PolarHBondContact O-N 2.89Å; S125-N157 VanDerWaalsContact CB-O 3.26Å; S125-N157 WeakPolarHBondContact CB-O 3.33Å; S125-N157 PolarHBondContact N-O 3.14Å; S125-N157 PolarHBondContact OG-O 3.49Å; S125-Q159 VanDerWaalsContact CB-NE2 3.29Å; S125-Q159 PolarHBondContact OG-NE2 3.03Å; S125-A164 WeakPolarHBondContact O-CA 3.43Å; S125-L165 WeakPolarHBondContact CB-O 3.39Å; S125-L165 WeakPolarHBondContact O-CB 3.23Å; S125-L165 WeakPolarHBondContact O-CG 3.41Å; S125-L165 PolarHBondContact O-N 3.15Å; S125-L165 PolarHBondContact OG-O 2.93Å
126	S	96.4	Very high	97.1	Very high	23 Å²	23	38.8 Å²	38.8	16%	0.161	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-15.5	179	71.9	0	0	0	0	114.3	D124 R128 K161	D124-S126 PolarHBondContact O-N 3.46Å; D124-S126 WeakPolarHBondContact OD1-CB 3.36Å; D124-S126 PolarHBondContact OD1-N 3.3Å; D124-S126 PolarHBondContact OD1-OG 3.36Å; S126-R128 PolarHBondContact O-N 2.8Å; S126-K161 WeakPolarHBondContact OG-CD 3.42Å; S126-K161 PolarHBondContact OG-NZ 3.35Å
127	D	95.9	Very high	97.1	Very high	35 Å²	35	40 Å²	40	19%	0.187	18%	0.183	C	C	.	.			trans	-93.9	69.4	-174.5	-164.5	-28.6	0	0	0	110.8	D124 Q129 R130 M131	D124-D127 HydrophobicContact CB-CB 3.89Å; D124-D127 PolarHBondContact O-N 3.37Å; D127-Q129 PolarHBondContact O-N 2.91Å; D127-Q129 VanDerWaalsContact O-N 3.16Å; D127-R130 PolarHBondContact O-N 3.39Å; D127-R130 WeakPolarHBondContact OD1-CB 3.39Å; D127-R130 PolarHBondContact OD1-N 3.33Å; D127-R130 IonicContact OD1-NE 3.8Å; D127-R130 IonicContact OD2-CZ 2.68Å; D127-R130 IonicContact OD2-NE 2.86Å; D127-R130 PolarHBondContact OD2-NE 2.82Å; D127-R130 IonicContact OD2-NH2 3.62Å; D127-R130 PolarHBondContact OD2-NH2 3.16Å; D127-M131 PolarHBondContact O-N 3.04Å
128	R	94.6	Very high	97.1	Very high	124 Å²	124	39.2 Å²	39.2	47%	0.468	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-26.1	-179.1	-60.7	-165	174.6	-126.7	-6.8	112.5	S126 N163 L165 E169	S126-R128 PolarHBondContact O-N 2.8Å; R128-N163 PolarHBondContact NE-O 3.14Å; R128-L165 HydrophobicContact CG-CD1 3.86Å; R128-L165 HydrophobicContact CG-CG 4.02Å; R128-L165 VanDerWaalsContact NH1-CD2 3.31Å; R128-E169 IonicContact CZ-OE1 3.27Å; R128-E169 VanDerWaalsContact CZ-OE1 3.3Å; R128-E169 IonicContact NH1-OE1 3.42Å; R128-E169 PolarHBondContact NH1-OE1 3.34Å; R128-E169 IonicContact NH2-OE1 3.15Å; R128-E169 PolarHBondContact NH2-OE1 3.25Å; R128-E169 IonicContact NH2-OE2 3.45Å; R128-E169 PolarHBondContact NH2-OE2 3.46Å
129	Q	95.4	Very high	97	Very high	184 Å²	184	39.8 Å²	39.8	86%	0.86	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-45.4	178.6	-68.8	-176.9	-11.5	0	0	112.7	D127 M131	D127-Q129 PolarHBondContact O-N 2.91Å; D127-Q129 VanDerWaalsContact O-N 3.16Å; Q129-M131 VanDerWaalsContact C-N 3.3Å; Q129-M131 PolarHBondContact O-N 3.44Å
130	R	95.6	Very high	96.9	Very high	50 Å²	50	43.6 Å²	43.6	19%	0.189	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	5.4	179.7	-66.5	-169.1	-63.2	146.1	8.3	114.6	L55 D56 D127 K132 E133 A134	L55-R130 HydrophobicContact CD1-CB 3.85Å; D56-R130 PolarHBondContact O-NH1 2.96Å; D56-R130 PolarHBondContact O-NH2 3.22Å; D56-R130 IonicContact OD1-NH1 2.66Å; D56-R130 PolarHBondContact OD1-NH1 3.26Å; D56-R130 IonicContact OD2-NH1 3.57Å; D56-R130 PolarHBondContact OD2-NH1 3.18Å; D127-R130 PolarHBondContact O-N 3.39Å; D127-R130 WeakPolarHBondContact OD1-CB 3.39Å; D127-R130 PolarHBondContact OD1-N 3.33Å; D127-R130 IonicContact OD1-NE 3.8Å; D127-R130 IonicContact OD2-CZ 2.68Å; D127-R130 IonicContact OD2-NE 2.86Å; D127-R130 PolarHBondContact OD2-NE 2.82Å; D127-R130 IonicContact OD2-NH2 3.62Å; D127-R130 PolarHBondContact OD2-NH2 3.16Å; R130-K132 VanDerWaalsContact C-N 3.29Å; R130-K132 PolarHBondContact O-N 3.18Å; R130-E133 WeakPolarHBondContact CD-OE2 3.47Å; R130-E133 WeakPolarHBondContact O-CB 3.17Å; R130-E133 PolarHBondContact O-N 2.95Å; R130-E133 VanDerWaalsContact O-N 3.09Å; R130-A134 PolarHBondContact O-N 3.44Å
131	M	95.9	Very high	96.8	Very high	6 Å²	6	43.6 Å²	43.6	3%	0.03	20%	0.204	C	C	.	.	H	α-helix	trans	-59.3	-36.1	177	-76.2	-60.5	161.5	0	0	114	V123 D124 D127 Q129 A134 R135 L165 L170 I173 L174	V123-M131 HydrophobicContact CG1-CE 3.46Å; V123-M131 VanDerWaalsContact CG1-CE 3.46Å; V123-M131 HydrophobicContact CG1-SD 3.77Å; D124-M131 WeakPolarHBondContact O-CE 3.45Å; D127-M131 PolarHBondContact O-N 3.04Å; Q129-M131 VanDerWaalsContact C-N 3.3Å; Q129-M131 PolarHBondContact O-N 3.44Å; M131-A134 PolarHBondContact O-N 3.04Å; M131-R135 WeakPolarHBondContact O-CB 3.47Å; M131-R135 PolarHBondContact O-N 2.82Å; M131-L165 HydrophobicContact CE-CD1 3.37Å; M131-L165 HydrophobicContact CG-CD1 3.61Å; M131-L165 HydrophobicContact SD-CD1 3.92Å; M131-L170 HydrophobicContact CE-CD2 3.82Å; M131-L170 HydrophobicContact SD-CD2 3.77Å; M131-I173 HydrophobicContact CB-CG2 3.67Å; M131-I173 HydrophobicContact CG-CG2 4.21Å; M131-L174 HydrophobicContact SD-CD2 4.13Å
132	K	96.6	Very high	96.7	Very high	142 Å²	142	43.9 Å²	43.9	62%	0.617	21%	0.205	S	C	*	.	H	α-helix	trans	-62.3	-43.9	174.1	-173.5	-178.1	176.3	-176.2	0	111.5	R130 R135 D136	R130-K132 VanDerWaalsContact C-N 3.29Å; R130-K132 PolarHBondContact O-N 3.18Å; K132-R135 PolarHBondContact O-N 3.22Å; K132-D136 WeakPolarHBondContact O-CB 3.22Å; K132-D136 PolarHBondContact O-N 3.24Å
133	E	97.3	Very high	96.6	Very high	64 Å²	64	50 Å²	50	30%	0.299	23%	0.232	S	C	.	.	H	α-helix	trans	-63.5	-43.1	174.9	-171	-167.5	-179.8	0	0	111.3	L55 R106 R130 R135 D136 V137	L55-E133 HydrophobicContact CD1-CB 4.29Å; L55-E133 HydrophobicContact CD1-CG 4.34Å; L55-E133 HydrophobicContact CD2-CG 4Å; R106-E133 IonicContact CZ-OE1 2.74Å; R106-E133 IonicContact NH1-OE1 2.68Å; R106-E133 PolarHBondContact NH1-OE1 3.48Å; R106-E133 IonicContact NH2-OE1 2.74Å; R106-E133 PolarHBondContact NH2-OE1 3.34Å; R130-E133 WeakPolarHBondContact CD-OE2 3.47Å; R130-E133 WeakPolarHBondContact O-CB 3.17Å; R130-E133 PolarHBondContact O-N 2.95Å; R130-E133 VanDerWaalsContact O-N 3.09Å; E133-R135 PolarHBondContact O-N 3.1Å; E133-D136 PolarHBondContact O-N 2.91Å; E133-V137 HydrophobicContact CG-CG2 4.47Å; E133-V137 WeakPolarHBondContact O-CB 3.41Å; E133-V137 VanDerWaalsContact O-CG2 3.23Å; E133-V137 WeakPolarHBondContact O-CG2 3.45Å; E133-V137 PolarHBondContact O-N 2.84Å
134	A	97.6	Very high	96.5	Very high	4 Å²	4	51.5 Å²	51.5	3%	0.033	24%	0.239	C	C	.	.	H	α-helix	trans	-61.4	-44.3	177.5	0	0	0	0	0	111.9	L55 F121 R130 M131 L138 L174	L55-A134 HydrophobicContact CD1-CB 3.92Å; L55-A134 HydrophobicContact CG-CB 4.23Å; F121-A134 WeakPolarHBondContact CZ-O 3.33Å; R130-A134 PolarHBondContact O-N 3.44Å; M131-A134 PolarHBondContact O-N 3.04Å; A134-L138 VanDerWaalsContact O-CB 3.26Å; A134-L138 WeakPolarHBondContact O-CB 3.38Å; A134-L138 PolarHBondContact O-N 3.05Å; A134-L174 HydrophobicContact CB-CD2 4.14Å
135	R	97.5	Very high	96.3	Very high	80 Å²	80	55.8 Å²	55.8	30%	0.302	27%	0.268	S	S	.	.	H	α-helix	trans	-59.5	-50.5	173.8	-179	-164.5	71.2	-173.4	1.8	111.7	M131 K132 E133 V137 L138 A139 I173 L174	M131-R135 WeakPolarHBondContact O-CB 3.47Å; M131-R135 PolarHBondContact O-N 2.82Å; K132-R135 PolarHBondContact O-N 3.22Å; E133-R135 PolarHBondContact O-N 3.1Å; R135-V137 VanDerWaalsContact C-N 3.33Å; R135-V137 PolarHBondContact O-N 2.86Å; R135-L138 PolarHBondContact O-N 3.42Å; R135-L138 VanDerWaalsContact O-N 3.17Å; R135-A139 WeakPolarHBondContact O-CB 3.37Å; R135-A139 PolarHBondContact O-N 2.99Å; R135-I173 WeakPolarHBondContact CD-O 3.27Å; R135-L174 HydrophobicContact CB-CD2 3.87Å
136	D	97.3	Very high	96.2	Very high	67 Å²	67	57.2 Å²	57.2	36%	0.358	27%	0.273	S	S	.	.	H	α-helix	trans	-67.4	-37.5	-173.9	-65.2	-15.1	0	0	0	110.6	K132 E133 D140	K132-D136 WeakPolarHBondContact O-CB 3.22Å; K132-D136 PolarHBondContact O-N 3.24Å; E133-D136 PolarHBondContact O-N 2.91Å; D136-D140 WeakPolarHBondContact O-CB 3.31Å; D136-D140 PolarHBondContact O-N 3.3Å
137	V	97.3	Very high	96.2	Very high	25 Å²	25	56.2 Å²	56.2	15%	0.152	27%	0.266	C	S	.	.	H	α-helix	trans	-65.3	-40.2	170.6	170.4	0	0	0	0	112.5	L55 W109 F121 E133 R135 D140 L141	L55-V137 HydrophobicContact CD2-CB 4.37Å; L55-V137 HydrophobicContact CD2-CG2 4.05Å; W109-V137 HydrophobicContact CH2-CG1 3.82Å; W109-V137 HydrophobicContact CZ3-CG1 3.58Å; F121-V137 HydrophobicContact CE2-CG1 4.15Å; F121-V137 HydrophobicContact CZ-CG1 4.34Å; E133-V137 HydrophobicContact CG-CG2 4.47Å; E133-V137 WeakPolarHBondContact O-CB 3.41Å; E133-V137 VanDerWaalsContact O-CG2 3.23Å; E133-V137 WeakPolarHBondContact O-CG2 3.45Å; E133-V137 PolarHBondContact O-N 2.84Å; R135-V137 VanDerWaalsContact C-N 3.33Å; R135-V137 PolarHBondContact O-N 2.86Å; V137-D140 PolarHBondContact O-N 2.94Å; V137-L141 VanDerWaalsContact O-CB 3.3Å; V137-L141 WeakPolarHBondContact O-CB 3.35Å; V137-L141 PolarHBondContact O-N 3.05Å
138	L	97.6	Very high	96.1	Very high	0 Å²	0	56 Å²	56	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-67.7	-41.3	176.7	178.6	56.4	0	0	0	112.1	F121 A134 R135 L141 L142 I152 L176 L179	F121-L138 HydrophobicContact CB-CD1 4.35Å; F121-L138 HydrophobicContact CD1-CB 4.41Å; F121-L138 HydrophobicContact CD1-CD1 4.05Å; F121-L138 HydrophobicContact CD1-CD2 4.12Å; F121-L138 HydrophobicContact CD1-CG 4.43Å; F121-L138 HydrophobicContact CD2-CD1 4.01Å; F121-L138 HydrophobicContact CE1-CB 3.85Å; F121-L138 HydrophobicContact CE1-CD1 4.34Å; F121-L138 HydrophobicContact CE1-CD2 4.16Å; F121-L138 HydrophobicContact CE1-CG 4.34Å; F121-L138 HydrophobicContact CE2-CB 4.17Å; F121-L138 HydrophobicContact CE2-CD1 4.3Å; F121-L138 HydrophobicContact CG-CD1 3.88Å; F121-L138 HydrophobicContact CZ-CB 3.72Å; F121-L138 HydrophobicContact CZ-CD1 4.46Å; A134-L138 VanDerWaalsContact O-CB 3.26Å; A134-L138 WeakPolarHBondContact O-CB 3.38Å; A134-L138 PolarHBondContact O-N 3.05Å; R135-L138 PolarHBondContact O-N 3.42Å; R135-L138 VanDerWaalsContact O-N 3.17Å; L138-L141 HydrophobicContact CD1-CD2 4.25Å; L138-L141 WeakPolarHBondContact O-CB 3.48Å; L138-L141 PolarHBondContact O-N 3.25Å; L138-L142 HydrophobicContact CD1-CD1 3.84Å; L138-L142 HydrophobicContact CD1-CG 3.99Å; L138-L142 HydrophobicContact CG-CD1 4.04Å; L138-L142 WeakPolarHBondContact O-CB 3.26Å; L138-L142 WeakPolarHBondContact O-CG 3.49Å; L138-L142 PolarHBondContact O-N 3.4Å; L138-I152 HydrophobicContact CD1-CD1 3.66Å; L138-L176 HydrophobicContact CD2-CD2 3.37Å; L138-L179 HydrophobicContact CG-CD1 4.35Å
139	A	97.2	Very high	96.1	Very high	11 Å²	11	51.9 Å²	51.9	9%	0.091	27%	0.265	C	S	.	.	H	α-helix	trans	-61.9	-45.3	174.4	0	0	0	0	0	111	R135 L141 L142 K143 L179	R135-A139 WeakPolarHBondContact O-CB 3.37Å; R135-A139 PolarHBondContact O-N 2.99Å; A139-L141 VanDerWaalsContact C-N 3.28Å; A139-L141 PolarHBondContact O-N 3.5Å; A139-L142 PolarHBondContact O-N 3.47Å; A139-K143 WeakPolarHBondContact O-CB 3.39Å; A139-K143 WeakPolarHBondContact O-CD 3.45Å; A139-K143 WeakPolarHBondContact O-CE 3.36Å; A139-K143 WeakPolarHBondContact O-CG 3.36Å; A139-K143 PolarHBondContact O-N 3.13Å; A139-L179 HydrophobicContact CB-CD1 3.92Å; A139-L179 HydrophobicContact CB-CD2 3.62Å; A139-L179 HydrophobicContact CB-CG 4.44Å
140	D	96.3	Very high	96.1	Very high	83 Å²	83	43.2 Å²	43.2	44%	0.444	22%	0.224	S	C	.	.	H	α-helix	trans	-69.1	-23.7	176.9	-86.2	11	0	0	0	113.8	D136 V137 K143 Q144	D136-D140 WeakPolarHBondContact O-CB 3.31Å; D136-D140 PolarHBondContact O-N 3.3Å; V137-D140 PolarHBondContact O-N 2.94Å; D140-K143 IonicContact OD1-NZ 3.36Å; D140-K143 PolarHBondContact OD1-NZ 3.11Å; D140-Q144 VanDerWaalsContact O-CG 3.28Å; D140-Q144 WeakPolarHBondContact O-CG 3.38Å; D140-Q144 PolarHBondContact O-NE2 3.21Å
141	L	96.6	Very high	96.2	Very high	1 Å²	1	41.1 Å²	41.1	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-73.7	-49.4	170.9	171.4	63.6	0	0	0	111.8	V53 Y113 V119 F121 V137 L138 A139 K143 Q144 V147	V53-L141 HydrophobicContact CG2-CD2 3.81Å; Y113-L141 HydrophobicContact CD1-CD1 4.08Å; Y113-L141 HydrophobicContact CE1-CD1 3.27Å; V119-L141 HydrophobicContact CG1-CD2 4.21Å; F121-L141 HydrophobicContact CD2-CD2 3.68Å; F121-L141 HydrophobicContact CE2-CD2 4.11Å; V137-L141 VanDerWaalsContact O-CB 3.3Å; V137-L141 WeakPolarHBondContact O-CB 3.35Å; V137-L141 PolarHBondContact O-N 3.05Å; L138-L141 HydrophobicContact CD1-CD2 4.25Å; L138-L141 WeakPolarHBondContact O-CB 3.48Å; L138-L141 PolarHBondContact O-N 3.25Å; A139-L141 VanDerWaalsContact C-N 3.28Å; A139-L141 PolarHBondContact O-N 3.5Å; L141-K143 VanDerWaalsContact C-N 3.35Å; L141-K143 PolarHBondContact O-N 2.56Å; L141-Q144 WeakPolarHBondContact O-CB 3.4Å; L141-Q144 VanDerWaalsContact O-CG 3.31Å; L141-Q144 WeakPolarHBondContact O-CG 3.26Å; L141-Q144 PolarHBondContact O-N 3.01Å; L141-V147 HydrophobicContact CD1-CG1 4.29Å; L141-V147 HydrophobicContact CD1-CG2 4.17Å; L141-V147 HydrophobicContact CG-CG1 4.45Å
142	L	96.3	Very high	96.3	Very high	5 Å²	5	40.9 Å²	40.9	3%	0.026	22%	0.216	C	C	.	.	H	α-helix	trans	-71	-26.1	-177.3	-72.6	175.6	0	0	0	113.5	L138 A139 Q144 V147 I152 L179 S183	L138-L142 HydrophobicContact CD1-CD1 3.84Å; L138-L142 HydrophobicContact CD1-CG 3.99Å; L138-L142 HydrophobicContact CG-CD1 4.04Å; L138-L142 WeakPolarHBondContact O-CB 3.26Å; L138-L142 WeakPolarHBondContact O-CG 3.49Å; L138-L142 PolarHBondContact O-N 3.4Å; A139-L142 PolarHBondContact O-N 3.47Å; L142-Q144 PolarHBondContact O-N 3.26Å; L142-V147 HydrophobicContact CD2-CG1 4.44Å; L142-I152 HydrophobicContact CD2-CD1 3.87Å; L142-I152 HydrophobicContact CD2-CG2 4.5Å; L142-I152 HydrophobicContact CG-CD1 4.42Å; L142-L179 HydrophobicContact CD1-CB 3.85Å; L142-S183 WeakPolarHBondContact O-CB 3.44Å
143	K	95.3	Very high	96.4	Very high	130 Å²	130	34.1 Å²	34.1	57%	0.565	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-13.7	170.8	-73.9	166.1	-151.3	165.1	0	114.4	A139 D140 L141	A139-K143 WeakPolarHBondContact O-CB 3.39Å; A139-K143 WeakPolarHBondContact O-CD 3.45Å; A139-K143 WeakPolarHBondContact O-CE 3.36Å; A139-K143 WeakPolarHBondContact O-CG 3.36Å; A139-K143 PolarHBondContact O-N 3.13Å; D140-K143 IonicContact OD1-NZ 3.36Å; D140-K143 PolarHBondContact OD1-NZ 3.11Å; L141-K143 VanDerWaalsContact C-N 3.35Å; L141-K143 PolarHBondContact O-N 2.56Å
144	Q	95.1	Very high	96.4	Very high	34 Å²	34	31.1 Å²	31.1	16%	0.159	17%	0.173	C	C	.	.			trans	-77.8	130.1	-171.5	-57.6	-57.9	-42.5	0	0	111.4	R110 Y113 D140 L141 L142 R146 V147 A148	R110-Q144 VanDerWaalsContact NH1-CD 3.29Å; Y113-Q144 HydrophobicContact CD2-CB 4.15Å; Y113-Q144 HydrophobicContact CD2-CG 4.09Å; Y113-Q144 HydrophobicContact CE2-CB 4.27Å; Y113-Q144 HydrophobicContact CE2-CG 3.7Å; D140-Q144 VanDerWaalsContact O-CG 3.28Å; D140-Q144 WeakPolarHBondContact O-CG 3.38Å; D140-Q144 PolarHBondContact O-NE2 3.21Å; L141-Q144 WeakPolarHBondContact O-CB 3.4Å; L141-Q144 VanDerWaalsContact O-CG 3.31Å; L141-Q144 WeakPolarHBondContact O-CG 3.26Å; L141-Q144 PolarHBondContact O-N 3.01Å; L142-Q144 PolarHBondContact O-N 3.26Å; Q144-R146 PolarHBondContact O-N 3.45Å; Q144-R146 VanDerWaalsContact O-N 3.09Å; Q144-V147 HydrophobicContact CB-CB 4.18Å; Q144-V147 HydrophobicContact CB-CG2 3.96Å; Q144-V147 WeakPolarHBondContact O-CA 3.36Å; Q144-V147 PolarHBondContact O-N 3.5Å; Q144-A148 PolarHBondContact O-N 2.96Å
145	P	93.8	Very high	96.4	Very high	104 Å²	104	31 Å²	31	68%	0.675	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-23.7	180	-27.8	36	0	0	0	115	V147 R227	P145-V147 VanDerWaalsContact C-N 3.31Å; P145-R227 PolarHBondContact O-NH2 2.91Å
146	R	95.1	Very high	96.4	Very high	30 Å²	30	27.2 Å²	27.2	11%	0.113	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-2.7	173.9	-56.1	-169.4	-164.9	-159.3	4.3	113.7	Y113 Q144 K150 D231 R234 P235	Y113-R146 VanDerWaalsContact O-O 3.06Å; Q144-R146 PolarHBondContact O-N 3.45Å; Q144-R146 VanDerWaalsContact O-N 3.09Å; R146-K150 WeakPolarHBondContact O-CD 3.4Å; R146-K150 WeakPolarHBondContact O-CE 3.42Å; R146-K150 PolarHBondContact O-NZ 3.26Å; R146-D231 HydrophobicContact CG-CB 4.33Å; R146-D231 PolarHBondContact NH1-O 2.89Å; R146-R234 PolarHBondContact NH1-O 2.82Å; R146-R234 PolarHBondContact NH2-O 2.59Å; R146-P235 PolarHBondContact NH2-O 2.93Å
147	V	96.1	Very high	96.4	Very high	2 Å²	2	24.1 Å²	24.1	1%	0.012	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.9	-37.7	-176.9	-177.9	0	0	0	0	112.1	Y113 V119 L141 L142 Q144 P145 G149 K150	Y113-V147 HydrophobicContact CD1-CG2 3.68Å; Y113-V147 HydrophobicContact CD2-CG2 3.99Å; Y113-V147 HydrophobicContact CE1-CG2 4.28Å; Y113-V147 HydrophobicContact CG-CG2 3.53Å; V119-V147 HydrophobicContact CG2-CG1 4.16Å; L141-V147 HydrophobicContact CD1-CG1 4.29Å; L141-V147 HydrophobicContact CD1-CG2 4.17Å; L141-V147 HydrophobicContact CG-CG1 4.45Å; L142-V147 HydrophobicContact CD2-CG1 4.44Å; Q144-V147 HydrophobicContact CB-CB 4.18Å; Q144-V147 HydrophobicContact CB-CG2 3.96Å; Q144-V147 WeakPolarHBondContact O-CA 3.36Å; Q144-V147 PolarHBondContact O-N 3.5Å; P145-V147 VanDerWaalsContact C-N 3.31Å; V147-G149 PolarHBondContact O-N 2.68Å; V147-K150 VanDerWaalsContact O-CB 3.24Å; V147-K150 WeakPolarHBondContact O-CB 3.36Å; V147-K150 PolarHBondContact O-N 3.31Å
148	A	94.6	Very high	96.3	Very high	30 Å²	30	25 Å²	25	25%	0.248	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.5	136.3	177.6	0	0	0	0	0	112.1	Q144 K150 S183 R227	Q144-A148 PolarHBondContact O-N 2.96Å; A148-K150 PolarHBondContact O-N 2.87Å; A148-S183 CarbonylContact C-O 3.48Å; A148-S183 WeakPolarHBondContact CA-O 3.49Å; A148-R227 VanDerWaalsContact O-CZ 3.26Å; A148-R227 PolarHBondContact O-NH1 3.04Å; A148-R227 PolarHBondContact O-NH2 3.31Å
149	G	92.9	Very high	96.1	Very high	37 Å²	37	27.9 Å²	27.9	38%	0.381	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.3	-15.4	-174.3	0	0	0	0	0	114.9	V147 S183 R184 S185	V147-G149 PolarHBondContact O-N 2.68Å; G149-S183 PolarHBondContact N-O 2.83Å; G149-R184 WeakPolarHBondContact CA-O 3.43Å; G149-S185 PolarHBondContact N-OG 2.94Å
150	K	96.6	Very high	95.8	Very high	2 Å²	2	30.5 Å²	30.5	1%	0.009	17%	0.169	C	C	.	.	S	Bend	trans	-78.6	140.1	173.4	-57.8	-172.9	177.2	171.4	0	109.5	Y113 A116 R146 V147 A148 S185 L224 D231	Y113-K150 PolarHBondContact O-NZ 3.29Å; A116-K150 VanDerWaalsContact O-CD 3.24Å; A116-K150 WeakPolarHBondContact O-CD 3.3Å; A116-K150 VanDerWaalsContact O-CE 3.29Å; A116-K150 WeakPolarHBondContact O-CE 3.48Å; A116-K150 PolarHBondContact O-NZ 2.86Å; R146-K150 WeakPolarHBondContact O-CD 3.4Å; R146-K150 WeakPolarHBondContact O-CE 3.42Å; R146-K150 PolarHBondContact O-NZ 3.26Å; V147-K150 VanDerWaalsContact O-CB 3.24Å; V147-K150 WeakPolarHBondContact O-CB 3.36Å; V147-K150 PolarHBondContact O-N 3.31Å; A148-K150 PolarHBondContact O-N 2.87Å; K150-S185 WeakPolarHBondContact O-CB 3.22Å; K150-S185 PolarHBondContact O-OG 3.09Å; K150-L224 HydrophobicContact CD-CD1 4.29Å; K150-L224 HydrophobicContact CG-CD1 3.95Å; K150-D231 IonicContact NZ-OD2 3.97Å
151	P	97.6	Very high	95.7	Very high	6 Å²	6	31.1 Å²	31.1	4%	0.039	17%	0.167	C	C	.	.			trans	-68.6	146.5	-178.4	29.2	-36.6	0	0	0	111.8	G118 V119 L186 L213 A216 V217	G118-P151 WeakPolarHBondContact CA-O 3.46Å; V119-P151 PolarHBondContact N-O 3.4Å; P151-L186 CarbonylContact C-O 3.57Å; P151-L186 WeakPolarHBondContact CA-O 3.34Å; P151-L186 HydrophobicContact CB-CB 4.11Å; P151-L213 HydrophobicContact CB-CD1 3.85Å; P151-L213 HydrophobicContact CG-CD1 3.96Å; P151-A216 HydrophobicContact CB-CB 3.71Å; P151-A216 HydrophobicContact CG-CB 4.21Å; P151-V217 HydrophobicContact CG-CB 4.48Å; P151-V217 HydrophobicContact CG-CG2 3.5Å
152	I	98.1	Very high	95.2	Very high	2 Å²	2	39.9 Å²	39.9	1%	0.01	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	131.9	-176.9	-171.8	165.9	0	0	0	112	V119 F121 L138 L142 L186 C187 H188 W212	V119-I152 HydrophobicContact CB-CG1 4.26Å; V119-I152 HydrophobicContact CG1-CD1 4.36Å; V119-I152 HydrophobicContact CG1-CG1 4.38Å; V119-I152 CarbonylContact O-C 3.55Å; V119-I152 WeakPolarHBondContact O-CA 3.39Å; F121-I152 HydrophobicContact CB-CD1 4.11Å; F121-I152 HydrophobicContact CB-CG1 4.46Å; L138-I152 HydrophobicContact CD1-CD1 3.66Å; L142-I152 HydrophobicContact CD2-CD1 3.87Å; L142-I152 HydrophobicContact CD2-CG2 4.5Å; L142-I152 HydrophobicContact CG-CD1 4.42Å; I152-L186 PolarHBondContact N-O 3.4Å; I152-C187 HydrophobicContact CG2-CB 3.93Å; I152-C187 WeakPolarHBondContact O-CA 3.45Å; I152-H188 PolarHBondContact O-N 3.13Å; I152-W212 WeakPolarHBondContact O-CZ3 3.34Å
153	L	98.3	Very high	94.9	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	118.3	170.9	175.1	69.9	0	0	0	109.1	V119 I120 F121 L155 H188 E190 W212 L213	V119-L153 PolarHBondContact O-N 3.49Å; I120-L153 CarbonylContact C-O 3.57Å; I120-L153 WeakPolarHBondContact CA-O 3.19Å; I120-L153 HydrophobicContact CD1-CD2 4.2Å; I120-L153 HydrophobicContact CG1-CB 4.24Å; I120-L153 HydrophobicContact CG1-CD2 4.06Å; I120-L153 HydrophobicContact CG2-CD2 4.43Å; F121-L153 PolarHBondContact N-O 2.97Å; L153-L155 HydrophobicContact CD1-CD2 4.48Å; L153-L155 HydrophobicContact CD2-CD2 3.78Å; L153-L155 HydrophobicContact CD2-CG 4.2Å; L153-L155 HydrophobicContact CG-CD2 4.02Å; L153-L155 HydrophobicContact CG-CG 4.35Å; L153-H188 HydrophobicContact CD1-CB 4.42Å; L153-E190 HydrophobicContact CD1-CB 4.03Å; L153-W212 HydrophobicContact CD1-CE3 4.39Å; L153-L213 HydrophobicContact CB-CB 4.29Å; L153-L213 HydrophobicContact CB-CD1 4.46Å; L153-L213 HydrophobicContact CB-CD2 4.04Å
154	V	98.3	Very high	94.9	Very high	1 Å²	1	39.8 Å²	39.8	1%	0.006	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	112.4	170.3	-176.9	0	0	0	0	108.6	F121 V123 A156 L176 H188 I189 E190	F121-V154 WeakPolarHBondContact O-CA 3.23Å; V123-V154 HydrophobicContact CG2-CG1 3.97Å; V154-A156 PolarHBondContact O-N 3.31Å; V154-L176 HydrophobicContact CG2-CD1 4.34Å; V154-L176 HydrophobicContact CG2-CD2 4.47Å; V154-H188 PolarHBondContact N-O 2.87Å; V154-I189 HydrophobicContact CB-CG1 4.23Å; V154-I189 HydrophobicContact CB-CG2 4.44Å; V154-I189 HydrophobicContact CG1-CG2 4.49Å; V154-I189 WeakPolarHBondContact O-CA 3.39Å; V154-E190 PolarHBondContact O-N 2.9Å
155	L	97.8	Very high	94.9	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.005	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	103.5	171	-69.2	-174.9	0	0	0	109	M67 I120 F121 V122 V123 L153 N157 E190 T206	M67-L155 HydrophobicContact CE-CD1 4.35Å; I120-L155 HydrophobicContact CG2-CD1 3.63Å; I120-L155 HydrophobicContact CG2-CG 3.77Å; F121-L155 PolarHBondContact O-N 2.89Å; V122-L155 HydrophobicContact CB-CB 4.5Å; V122-L155 HydrophobicContact CG1-CB 4.25Å; V122-L155 HydrophobicContact CG2-CB 4.28Å; V122-L155 HydrophobicContact CG2-CD1 4.11Å; V123-L155 PolarHBondContact N-O 3.16Å; L153-L155 HydrophobicContact CD1-CD2 4.48Å; L153-L155 HydrophobicContact CD2-CD2 3.78Å; L153-L155 HydrophobicContact CD2-CG 4.2Å; L153-L155 HydrophobicContact CG-CD2 4.02Å; L153-L155 HydrophobicContact CG-CG 4.35Å; L155-N157 VanDerWaalsContact C-N 3.31Å; L155-N157 PolarHBondContact O-N 3.44Å; L155-E190 HydrophobicContact CD2-CB 3.97Å; L155-E190 HydrophobicContact CD2-CG 4.36Å; L155-T206 HydrophobicContact CD1-CG2 3.67Å; L155-T206 HydrophobicContact CD2-CG2 4.4Å
156	A	97.2	Very high	94.9	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	82.5	173.6	0	0	0	0	0	108.5	V154 Q159 L170 I189 E190 C192	V154-A156 PolarHBondContact O-N 3.31Å; A156-Q159 VanDerWaalsContact O-CG 3.3Å; A156-Q159 WeakPolarHBondContact O-CG 3.43Å; A156-L170 HydrophobicContact CB-CD1 3.32Å; A156-I189 HydrophobicContact CB-CG2 4.14Å; A156-E190 PolarHBondContact N-O 2.88Å; A156-E190 VanDerWaalsContact N-O 3.09Å; A156-C192 PolarHBondContact O-N 2.86Å
157	N	96.2	Very high	94.6	Very high	3 Å²	3	36.8 Å²	36.8	2%	0.016	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	161.8	-164.8	-165.9	26.4	0	0	0	113	A58 V122 V123 S125 L155 C192 A194	A58-N157 PolarHBondContact O-ND2 3.26Å; V122-N157 HydrophobicContact CG1-CB 3.94Å; V123-N157 WeakPolarHBondContact O-CA 3.46Å; V123-N157 VanDerWaalsContact O-CB 3.25Å; V123-N157 WeakPolarHBondContact O-CB 3.26Å; V123-N157 PolarHBondContact O-N 3.1Å; S125-N157 VanDerWaalsContact CB-O 3.26Å; S125-N157 WeakPolarHBondContact CB-O 3.33Å; S125-N157 PolarHBondContact N-O 3.14Å; S125-N157 PolarHBondContact OG-O 3.49Å; L155-N157 VanDerWaalsContact C-N 3.31Å; L155-N157 PolarHBondContact O-N 3.44Å; N157-C192 CarbonylContact C-O 3.57Å; N157-C192 WeakPolarHBondContact CA-O 3.43Å; N157-C192 PolarHBondContact OD1-SG 2.86Å; N157-A194 PolarHBondContact OD1-N 3.01Å
158	K	94.9	Very high	94.3	Very high	43 Å²	43	37.8 Å²	37.8	19%	0.187	21%	0.208	C	C	.	.			trans	67.7	35.4	-179	-44.3	-166.2	-164.6	169.4	0	114.6	K57 D124 D160 K161 C192	K57-K158 WeakPolarHBondContact O-CE 3.31Å; K57-K158 PolarHBondContact O-NZ 2.88Å; D124-K158 WeakPolarHBondContact OD1-CD 3.43Å; D124-K158 WeakPolarHBondContact OD2-CD 3.49Å; D124-K158 WeakPolarHBondContact OD2-CE 3.2Å; D124-K158 IonicContact OD2-NZ 2.9Å; D124-K158 PolarHBondContact OD2-NZ 2.94Å; K158-D160 VanDerWaalsContact C-OD1 3.31Å; K158-D160 VanDerWaalsContact CA-OD1 3.24Å; K158-D160 WeakPolarHBondContact CA-OD1 3.42Å; K158-D160 PolarHBondContact O-N 3.29Å; K158-K161 HydrophobicContact CB-CD 4.18Å; K158-K161 PolarHBondContact O-N 3.29Å; K158-C192 PolarHBondContact N-O 2.84Å
159	Q	94.3	Very high	94.2	Very high	60 Å²	60	38.8 Å²	38.8	28%	0.28	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-1.6	171.4	-62.1	-74	-55.6	0	0	113.9	S125 A156 K161 L165 P191 C192	S125-Q159 VanDerWaalsContact CB-NE2 3.29Å; S125-Q159 PolarHBondContact OG-NE2 3.03Å; A156-Q159 VanDerWaalsContact O-CG 3.3Å; A156-Q159 WeakPolarHBondContact O-CG 3.43Å; Q159-K161 VanDerWaalsContact C-N 3.3Å; Q159-L165 PolarHBondContact NE2-O 3.47Å; Q159-P191 HydrophobicContact CG-CB 4Å; Q159-C192 WeakPolarHBondContact CB-O 3.37Å; Q159-C192 VanDerWaalsContact CG-O 3.3Å; Q159-C192 WeakPolarHBondContact CG-O 3.42Å; Q159-C192 PolarHBondContact N-O 2.94Å; Q159-C192 VanDerWaalsContact N-O 3.15Å
160	D	91.6	Very high	94.3	Very high	67 Å²	67	37 Å²	37	36%	0.358	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-3.1	170.4	56.3	-61	0	0	0	113.9	K158 S193 M196	K158-D160 VanDerWaalsContact C-OD1 3.31Å; K158-D160 VanDerWaalsContact CA-OD1 3.24Å; K158-D160 WeakPolarHBondContact CA-OD1 3.42Å; K158-D160 PolarHBondContact O-N 3.29Å; D160-S193 WeakPolarHBondContact OD1-CB 3.39Å; D160-S193 PolarHBondContact OD1-OG 3.41Å; D160-M196 HydrophobicContact CB-CE 4.12Å; D160-M196 HydrophobicContact CB-CG 4.03Å
161	K	92.4	Very high	94.1	Very high	95 Å²	95	37.8 Å²	37.8	41%	0.413	19%	0.194	S	C	.	.	S	Bend	trans	-104.6	139.7	178.8	-67.7	175.6	167.5	-167.3	0	112.3	S126 K158 Q159 N163 A164	S126-K161 WeakPolarHBondContact OG-CD 3.42Å; S126-K161 PolarHBondContact OG-NZ 3.35Å; K158-K161 HydrophobicContact CB-CD 4.18Å; K158-K161 PolarHBondContact O-N 3.29Å; Q159-K161 VanDerWaalsContact C-N 3.3Å; K161-N163 VanDerWaalsContact C-N 3.27Å; K161-N163 PolarHBondContact O-N 2.94Å; K161-N163 VanDerWaalsContact O-N 3.11Å; K161-A164 WeakPolarHBondContact O-CB 3.35Å; K161-A164 PolarHBondContact O-N 2.92Å
162	M	87.3	Confident	93.9	Very high	186 Å²	186	43.5 Å²	43.5	92%	0.916	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50.7	-38	-179.7	-60.5	-57.4	-67.7	0	0	115	A164	M162-A164 VanDerWaalsContact C-N 3.33Å; M162-A164 PolarHBondContact O-N 3.45Å
163	N	89.9	Confident	93.8	Very high	117 Å²	117	46.7 Å²	46.7	63%	0.626	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.6	8.7	-174.5	-62.7	3.4	0	0	0	113.7	R128 K161 L165	R128-N163 PolarHBondContact NE-O 3.14Å; K161-N163 VanDerWaalsContact C-N 3.27Å; K161-N163 PolarHBondContact O-N 2.94Å; K161-N163 VanDerWaalsContact O-N 3.11Å; N163-L165 PolarHBondContact O-N 3.48Å
164	A	94.9	Very high	93.6	Very high	16 Å²	16	46.7 Å²	46.7	13%	0.132	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-64.5	123.9	-175.2	0	0	0	0	0	112.3	S125 K161 M162	S125-A164 WeakPolarHBondContact O-CA 3.43Å; K161-A164 WeakPolarHBondContact O-CB 3.35Å; K161-A164 PolarHBondContact O-N 2.92Å; M162-A164 VanDerWaalsContact C-N 3.33Å; M162-A164 PolarHBondContact O-N 3.45Å
165	L	94.8	Very high	93.5	Very high	1 Å²	1	49 Å²	49	1%	0.005	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-57.8	130.3	169.2	-75.9	157.6	0	0	0	111.7	S125 R128 M131 Q159 N163 E169 L170 I173	S125-L165 WeakPolarHBondContact CB-O 3.39Å; S125-L165 WeakPolarHBondContact O-CB 3.23Å; S125-L165 WeakPolarHBondContact O-CG 3.41Å; S125-L165 PolarHBondContact O-N 3.15Å; S125-L165 PolarHBondContact OG-O 2.93Å; R128-L165 HydrophobicContact CG-CD1 3.86Å; R128-L165 HydrophobicContact CG-CG 4.02Å; R128-L165 VanDerWaalsContact NH1-CD2 3.31Å; M131-L165 HydrophobicContact CE-CD1 3.37Å; M131-L165 HydrophobicContact CG-CD1 3.61Å; M131-L165 HydrophobicContact SD-CD1 3.92Å; Q159-L165 PolarHBondContact NE2-O 3.47Å; N163-L165 PolarHBondContact O-N 3.48Å; L165-E169 WeakPolarHBondContact CA-OE2 3.37Å; L165-E169 HydrophobicContact CB-CB 4.49Å; L165-E169 HydrophobicContact CD2-CB 3.48Å; L165-E169 VanDerWaalsContact CD2-CB 3.48Å; L165-E169 HydrophobicContact CD2-CG 4.14Å; L165-E169 WeakPolarHBondContact CD2-OE1 3.49Å; L165-L170 HydrophobicContact CB-CD2 4.11Å; L165-L170 HydrophobicContact CB-CG 4.03Å; L165-L170 HydrophobicContact CD1-CD2 4.14Å; L165-I173 HydrophobicContact CD1-CD1 4.36Å; L165-I173 HydrophobicContact CD2-CD1 3.54Å
166	L	93.1	Very high	93.3	Very high	94 Å²	94	49 Å²	49	49%	0.492	25%	0.252	S	S	.	.	P	Polyproline II helix	trans	-66.4	159.8	170.8	-66	173.4	0	0	0	111.2	S168 E169 L170	L166-S168 WeakPolarHBondContact CB-OG 3.46Å; L166-S168 PolarHBondContact O-N 3.17Å; L166-E169 HydrophobicContact CB-CG 4.4Å; L166-E169 PolarHBondContact N-OE2 3.4Å; L166-E169 PolarHBondContact O-N 3.38Å; L166-L170 WeakPolarHBondContact O-CG 3.44Å; L166-L170 PolarHBondContact O-N 3.43Å; L166-L170 VanDerWaalsContact O-N 3.1Å
167	G	90.1	Very high	93	Very high	9 Å²	9	51.3 Å²	51.3	9%	0.093	26%	0.263	C	S	.	.	H	α-helix	trans	-58.6	-28.4	176.2	0	0	0	0	0	113.6	I171	G167-I171 WeakPolarHBondContact O-CG1 3.45Å; G167-I171 PolarHBondContact O-N 3.25Å
168	S	89.5	Confident	92.9	Very high	23 Å²	23	57.7 Å²	57.7	16%	0.161	29%	0.291	C	S	.	.	H	α-helix	trans	-68.1	-56.8	173.6	44.2	0	0	0	0	112.9	L166 L170 I171 E172 I429	L166-S168 WeakPolarHBondContact CB-OG 3.46Å; L166-S168 PolarHBondContact O-N 3.17Å; S168-L170 PolarHBondContact O-N 3.42Å; S168-L170 VanDerWaalsContact O-N 3.13Å; S168-I171 WeakPolarHBondContact O-CB 3.38Å; S168-I171 PolarHBondContact O-N 3.28Å; S168-E172 PolarHBondContact O-N 2.84Å; S168-I429 VanDerWaalsContact CB-CD1 3.45Å; S168-I429 VanDerWaalsContact CB-CG1 3.4Å
169	E	92.9	Very high	92.8	Very high	52 Å²	52	56.6 Å²	56.6	24%	0.243	29%	0.287	C	S	.	.	H	α-helix	trans	-54.9	-34.9	177.2	-61.1	172.9	93.5	0	0	111	R128 L165 L166 E172 I173	R128-E169 IonicContact CZ-OE1 3.27Å; R128-E169 VanDerWaalsContact CZ-OE1 3.3Å; R128-E169 IonicContact NH1-OE1 3.42Å; R128-E169 PolarHBondContact NH1-OE1 3.34Å; R128-E169 IonicContact NH2-OE1 3.15Å; R128-E169 PolarHBondContact NH2-OE1 3.25Å; R128-E169 IonicContact NH2-OE2 3.45Å; R128-E169 PolarHBondContact NH2-OE2 3.46Å; L165-E169 WeakPolarHBondContact CA-OE2 3.37Å; L165-E169 HydrophobicContact CB-CB 4.49Å; L165-E169 HydrophobicContact CD2-CB 3.48Å; L165-E169 VanDerWaalsContact CD2-CB 3.48Å; L165-E169 HydrophobicContact CD2-CG 4.14Å; L165-E169 WeakPolarHBondContact CD2-OE1 3.49Å; L166-E169 HydrophobicContact CB-CG 4.4Å; L166-E169 PolarHBondContact N-OE2 3.4Å; L166-E169 PolarHBondContact O-N 3.38Å; E169-E172 PolarHBondContact O-N 2.99Å; E169-I173 HydrophobicContact CB-CD1 4.28Å; E169-I173 VanDerWaalsContact O-CB 3.31Å; E169-I173 WeakPolarHBondContact O-CB 3.34Å; E169-I173 WeakPolarHBondContact O-CD1 3.48Å; E169-I173 WeakPolarHBondContact O-CG1 3.47Å; E169-I173 PolarHBondContact O-N 3.44Å
170	L	94.2	Very high	92.8	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-67.6	-34.8	175.3	-73.3	173.5	0	0	0	114.4	V123 M131 A156 L165 L166 S168 E172 L174	V123-L170 HydrophobicContact CG1-CD2 3.99Å; M131-L170 HydrophobicContact CE-CD2 3.82Å; M131-L170 HydrophobicContact SD-CD2 3.77Å; A156-L170 HydrophobicContact CB-CD1 3.32Å; L165-L170 HydrophobicContact CB-CD2 4.11Å; L165-L170 HydrophobicContact CB-CG 4.03Å; L165-L170 HydrophobicContact CD1-CD2 4.14Å; L166-L170 WeakPolarHBondContact O-CG 3.44Å; L166-L170 PolarHBondContact O-N 3.43Å; L166-L170 VanDerWaalsContact O-N 3.1Å; S168-L170 PolarHBondContact O-N 3.42Å; S168-L170 VanDerWaalsContact O-N 3.13Å; L170-E172 VanDerWaalsContact C-N 3.31Å; L170-E172 PolarHBondContact O-N 3.07Å; L170-L174 HydrophobicContact CD2-CD1 4.12Å; L170-L174 HydrophobicContact CD2-CG 4.4Å; L170-L174 VanDerWaalsContact O-CB 3.23Å; L170-L174 WeakPolarHBondContact O-CB 3.29Å; L170-L174 WeakPolarHBondContact O-CG 3.45Å; L170-L174 PolarHBondContact O-N 3.25Å
171	I	93.3	Very high	92.8	Very high	17 Å²	17	53.5 Å²	53.5	9%	0.087	27%	0.273	C	S	.	.	H	α-helix	trans	-60.1	-46.1	174.9	-69.8	162.4	0	0	0	109.8	G167 S168 S175 L176 I189 F422 Y425	G167-I171 WeakPolarHBondContact O-CG1 3.45Å; G167-I171 PolarHBondContact O-N 3.25Å; S168-I171 WeakPolarHBondContact O-CB 3.38Å; S168-I171 PolarHBondContact O-N 3.28Å; I171-S175 CarbonylContact O-C 3.59Å; I171-S175 WeakPolarHBondContact O-CA 3.38Å; I171-S175 PolarHBondContact O-N 2.8Å; I171-L176 HydrophobicContact CG1-CD1 4.28Å; I171-L176 PolarHBondContact O-N 3.37Å; I171-I189 HydrophobicContact CD1-CD1 3.81Å; I171-I189 HydrophobicContact CG1-CD1 3.26Å; I171-F422 HydrophobicContact CD1-CD1 4.34Å; I171-F422 HydrophobicContact CG1-CE1 4.42Å; I171-F422 HydrophobicContact CG2-CD1 4.1Å; I171-F422 HydrophobicContact CG2-CE1 4.31Å; I171-Y425 HydrophobicContact CD1-CD1 3.5Å; I171-Y425 HydrophobicContact CD1-CD2 4.35Å; I171-Y425 HydrophobicContact CD1-CE1 4.09Å; I171-Y425 HydrophobicContact CD1-CG 3.65Å
172	E	93.6	Very high	92.9	Very high	127 Å²	127	55.4 Å²	55.4	59%	0.593	28%	0.283	S	S	*	.	H	α-helix	trans	-71	-54.5	-176.9	-64.2	172.3	-164.2	0	0	111.3	S168 E169 L170 L174 S175	S168-E172 PolarHBondContact O-N 2.84Å; E169-E172 PolarHBondContact O-N 2.99Å; L170-E172 VanDerWaalsContact C-N 3.31Å; L170-E172 PolarHBondContact O-N 3.07Å; E172-L174 PolarHBondContact O-N 3.28Å; E172-S175 WeakPolarHBondContact O-CA 3.49Å; E172-S175 PolarHBondContact O-N 2.8Å; E172-S175 PolarHBondContact O-OG 3.31Å
173	I	95.3	Very high	93.2	Very high	69 Å²	69	46.9 Å²	46.9	35%	0.354	24%	0.241	S	C	.	.	H	α-helix	trans	-65.2	-39.7	-174.7	-66.9	167.2	0	0	0	112.1	M131 R135 L165 E169 S175	M131-I173 HydrophobicContact CB-CG2 3.67Å; M131-I173 HydrophobicContact CG-CG2 4.21Å; R135-I173 WeakPolarHBondContact CD-O 3.27Å; L165-I173 HydrophobicContact CD1-CD1 4.36Å; L165-I173 HydrophobicContact CD2-CD1 3.54Å; E169-I173 HydrophobicContact CB-CD1 4.28Å; E169-I173 VanDerWaalsContact O-CB 3.31Å; E169-I173 WeakPolarHBondContact O-CB 3.34Å; E169-I173 WeakPolarHBondContact O-CD1 3.48Å; E169-I173 WeakPolarHBondContact O-CG1 3.47Å; E169-I173 PolarHBondContact O-N 3.44Å; I173-S175 VanDerWaalsContact C-N 3.29Å
174	L	95.1	Very high	93.3	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-3.1	174	-53.5	176.5	0	0	0	112.5	V123 M131 A134 R135 L170 E172 L176 L179	V123-L174 HydrophobicContact CG2-CD1 4.13Å; M131-L174 HydrophobicContact SD-CD2 4.13Å; A134-L174 HydrophobicContact CB-CD2 4.14Å; R135-L174 HydrophobicContact CB-CD2 3.87Å; L170-L174 HydrophobicContact CD2-CD1 4.12Å; L170-L174 HydrophobicContact CD2-CG 4.4Å; L170-L174 VanDerWaalsContact O-CB 3.23Å; L170-L174 WeakPolarHBondContact O-CB 3.29Å; L170-L174 WeakPolarHBondContact O-CG 3.45Å; L170-L174 PolarHBondContact O-N 3.25Å; E172-L174 PolarHBondContact O-N 3.28Å; L174-L176 HydrophobicContact CB-CD2 3.63Å; L174-L176 HydrophobicContact CB-CG 3.86Å; L174-L176 HydrophobicContact CD1-CD2 4.12Å; L174-L176 PolarHBondContact O-N 3.26Å; L174-L179 WeakPolarHBondContact O-CD1 3.31Å
175	S	95.1	Very high	93.2	Very high	48 Å²	48	50.5 Å²	50.5	34%	0.336	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.4	42.8	-178	-51.3	0	0	0	0	113	I171 E172 I173 E177 K178 L179	I171-S175 CarbonylContact O-C 3.59Å; I171-S175 WeakPolarHBondContact O-CA 3.38Å; I171-S175 PolarHBondContact O-N 2.8Å; E172-S175 WeakPolarHBondContact O-CA 3.49Å; E172-S175 PolarHBondContact O-N 2.8Å; E172-S175 PolarHBondContact O-OG 3.31Å; I173-S175 VanDerWaalsContact C-N 3.29Å; S175-E177 PolarHBondContact O-N 2.86Å; S175-K178 PolarHBondContact O-N 2.87Å; S175-L179 PolarHBondContact O-N 3.02Å
176	L	93.3	Very high	93.2	Very high	1 Å²	1	52.9 Å²	52.9	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-58.2	-52	-164.8	-67.5	-179.5	0	0	0	112.5	L138 V154 I171 L174 K178 L179 V180 I189 F422	L138-L176 HydrophobicContact CD2-CD2 3.37Å; V154-L176 HydrophobicContact CG2-CD1 4.34Å; V154-L176 HydrophobicContact CG2-CD2 4.47Å; I171-L176 HydrophobicContact CG1-CD1 4.28Å; I171-L176 PolarHBondContact O-N 3.37Å; L174-L176 HydrophobicContact CB-CD2 3.63Å; L174-L176 HydrophobicContact CB-CG 3.86Å; L174-L176 HydrophobicContact CD1-CD2 4.12Å; L174-L176 PolarHBondContact O-N 3.26Å; L176-K178 VanDerWaalsContact C-N 3.25Å; L176-K178 PolarHBondContact O-N 3.17Å; L176-L179 PolarHBondContact O-N 3.48Å; L176-V180 WeakPolarHBondContact O-CB 3.5Å; L176-V180 WeakPolarHBondContact O-CG2 3.49Å; L176-V180 PolarHBondContact O-N 3.17Å; L176-I189 HydrophobicContact CD1-CD1 3.4Å; L176-I189 HydrophobicContact CD1-CG1 3.98Å; L176-F422 HydrophobicContact CB-CE1 4.32Å
177	E	90.6	Very high	93.4	Very high	49 Å²	49	49 Å²	49	23%	0.229	24%	0.236	C	C	.	.	H	α-helix	trans	-46.2	-48.7	178.1	178.6	-179.7	-156.7	0	0	112.3	S175 N181 F422 R426	S175-E177 PolarHBondContact O-N 2.86Å; E177-N181 VanDerWaalsContact O-CB 3.24Å; E177-N181 WeakPolarHBondContact O-CB 3.31Å; E177-N181 PolarHBondContact O-N 2.97Å; E177-N181 PolarHBondContact O-OD1 3.28Å; E177-F422 HydrophobicContact CB-CD1 4.1Å; E177-F422 HydrophobicContact CB-CD2 3.97Å; E177-F422 HydrophobicContact CB-CE1 4.25Å; E177-F422 HydrophobicContact CB-CE2 4.13Å; E177-F422 HydrophobicContact CB-CG 3.96Å; E177-F422 HydrophobicContact CB-CZ 4.27Å; E177-F422 HydrophobicContact CG-CB 4.36Å; E177-F422 HydrophobicContact CG-CD2 3.86Å; E177-F422 HydrophobicContact CG-CE2 4.35Å; E177-F422 HydrophobicContact CG-CG 4.05Å; E177-R426 IonicContact OE1-CZ 2.9Å; E177-R426 VanDerWaalsContact OE1-CZ 3.26Å; E177-R426 IonicContact OE1-NH1 2.76Å; E177-R426 PolarHBondContact OE1-NH1 3.05Å; E177-R426 IonicContact OE1-NH2 3.3Å; E177-R426 PolarHBondContact OE1-NH2 3.35Å; E177-R426 IonicContact OE2-CZ 3.26Å; E177-R426 IonicContact OE2-NH1 2.73Å; E177-R426 PolarHBondContact OE2-NH1 3.07Å
178	K	93.9	Very high	93.6	Very high	138 Å²	138	50.6 Å²	50.6	60%	0.6	24%	0.241	S	C	*	.	H	α-helix	trans	-62.9	-46.9	178.5	-179.2	175.3	-179.9	173	0	112.5	S175 L176 Q182	S175-K178 PolarHBondContact O-N 2.87Å; L176-K178 VanDerWaalsContact C-N 3.25Å; L176-K178 PolarHBondContact O-N 3.17Å; K178-Q182 VanDerWaalsContact O-CB 3.3Å; K178-Q182 WeakPolarHBondContact O-CB 3.43Å; K178-Q182 WeakPolarHBondContact O-CG 3.37Å; K178-Q182 PolarHBondContact O-N 2.95Å; K178-Q182 VanDerWaalsContact O-N 3.09Å
179	L	94.6	Very high	94	Very high	20 Å²	20	49.6 Å²	49.6	11%	0.105	23%	0.234	C	C	.	.	H	α-helix	trans	-69.1	-39.7	-178	-62.9	179.2	0	0	0	112.1	L138 A139 L142 L174 S175 L176 Q182 S183	L138-L179 HydrophobicContact CG-CD1 4.35Å; A139-L179 HydrophobicContact CB-CD1 3.92Å; A139-L179 HydrophobicContact CB-CD2 3.62Å; A139-L179 HydrophobicContact CB-CG 4.44Å; L142-L179 HydrophobicContact CD1-CB 3.85Å; L174-L179 WeakPolarHBondContact O-CD1 3.31Å; S175-L179 PolarHBondContact O-N 3.02Å; L176-L179 PolarHBondContact O-N 3.48Å; L179-Q182 PolarHBondContact O-N 2.77Å; L179-S183 WeakPolarHBondContact O-CB 3.45Å; L179-S183 PolarHBondContact O-N 3.39Å; L179-S183 PolarHBondContact O-OG 2.89Å
180	V	93.1	Very high	94.1	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.006	22%	0.223	C	C	.	.	H	α-helix	trans	-69	-44.8	-178.5	169	0	0	0	0	110.7	L176 S183 R184 S185 C187 L418 F422	L176-V180 WeakPolarHBondContact O-CB 3.5Å; L176-V180 WeakPolarHBondContact O-CG2 3.49Å; L176-V180 PolarHBondContact O-N 3.17Å; V180-S183 PolarHBondContact O-N 2.95Å; V180-S183 PolarHBondContact O-OG 3.13Å; V180-R184 WeakPolarHBondContact O-CA 3.44Å; V180-R184 PolarHBondContact O-N 3.39Å; V180-S185 WeakPolarHBondContact CG1-O 3.41Å; V180-S185 PolarHBondContact O-N 3.13Å; V180-C187 HydrophobicContact CB-CB 4.27Å; V180-C187 HydrophobicContact CG1-CB 3.52Å; V180-C187 HydrophobicContact CG2-CB 3.64Å; V180-L418 HydrophobicContact CG1-CD1 3.78Å; V180-F422 HydrophobicContact CB-CE2 4.43Å; V180-F422 HydrophobicContact CB-CZ 4.32Å; V180-F422 HydrophobicContact CG1-CE2 4.06Å; V180-F422 HydrophobicContact CG1-CZ 4.17Å; V180-F422 HydrophobicContact CG2-CZ 4.42Å
181	N	92.1	Very high	94.1	Very high	61 Å²	61	49.3 Å²	49.3	33%	0.326	24%	0.236	S	C	.	.	H	α-helix	trans	-66.9	-38.5	175.1	-66.5	3.2	0	0	0	111.3	E177 R184	E177-N181 VanDerWaalsContact O-CB 3.24Å; E177-N181 WeakPolarHBondContact O-CB 3.31Å; E177-N181 PolarHBondContact O-N 2.97Å; E177-N181 PolarHBondContact O-OD1 3.28Å; N181-R184 PolarHBondContact O-N 2.92Å
182	Q	93.9	Very high	94.1	Very high	134 Å²	134	48.6 Å²	48.6	63%	0.626	23%	0.232	S	C	*	.	H	α-helix	trans	-64.3	-37.3	174.6	-78.5	177.9	-12.1	0	0	113	K178 L179	K178-Q182 VanDerWaalsContact O-CB 3.3Å; K178-Q182 WeakPolarHBondContact O-CB 3.43Å; K178-Q182 WeakPolarHBondContact O-CG 3.37Å; K178-Q182 PolarHBondContact O-N 2.95Å; K178-Q182 VanDerWaalsContact O-N 3.09Å; L179-Q182 PolarHBondContact O-N 2.77Å
183	S	93.1	Very high	94	Very high	7 Å²	7	43 Å²	43	5%	0.049	21%	0.207	C	C	.	.	H	α-helix	trans	-86.7	-8.3	177.5	77.8	0	0	0	0	113.9	L142 A148 G149 L179 V180 S185	L142-S183 WeakPolarHBondContact O-CB 3.44Å; A148-S183 CarbonylContact C-O 3.48Å; A148-S183 WeakPolarHBondContact CA-O 3.49Å; G149-S183 PolarHBondContact N-O 2.83Å; L179-S183 WeakPolarHBondContact O-CB 3.45Å; L179-S183 PolarHBondContact O-N 3.39Å; L179-S183 PolarHBondContact O-OG 2.89Å; V180-S183 PolarHBondContact O-N 2.95Å; V180-S183 PolarHBondContact O-OG 3.13Å; S183-S185 PolarHBondContact O-N 2.99Å; S183-S185 VanDerWaalsContact OG-CB 3.28Å; S183-S185 WeakPolarHBondContact OG-CB 3.33Å; S183-S185 PolarHBondContact OG-N 3.41Å; S183-S185 PolarHBondContact OG-OG 3.14Å
184	R	93.4	Very high	93.6	Very high	210 Å²	210	39.8 Å²	39.8	79%	0.792	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.8	29.5	-171.5	-55.7	-178	178.9	-177.4	-2	113.9	G149 V180 N181	G149-R184 WeakPolarHBondContact CA-O 3.43Å; V180-R184 WeakPolarHBondContact O-CA 3.44Å; V180-R184 PolarHBondContact O-N 3.39Å; N181-R184 PolarHBondContact O-N 2.92Å
185	S	92.9	Very high	93.1	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.21	C	C	.	.			trans	-88.2	136.9	-179.3	-70.3	0	0	0	0	110.5	G149 K150 V180 S183 C187 L418	G149-S185 PolarHBondContact N-OG 2.94Å; K150-S185 WeakPolarHBondContact O-CB 3.22Å; K150-S185 PolarHBondContact O-OG 3.09Å; V180-S185 WeakPolarHBondContact CG1-O 3.41Å; V180-S185 PolarHBondContact O-N 3.13Å; S183-S185 PolarHBondContact O-N 2.99Å; S183-S185 VanDerWaalsContact OG-CB 3.28Å; S183-S185 WeakPolarHBondContact OG-CB 3.33Å; S183-S185 PolarHBondContact OG-N 3.41Å; S183-S185 PolarHBondContact OG-OG 3.14Å; S185-C187 PolarHBondContact O-N 3.14Å; S185-L418 WeakPolarHBondContact O-CD1 2.98Å
186	L	94.9	Very high	92.3	Very high	50 Å²	50	44.2 Å²	44.2	26%	0.262	21%	0.209	S	C	.	.			trans	-64.8	133.7	164.5	-70	167	0	0	0	109.4	P151 I152 W212 A216 L219 L418	P151-L186 CarbonylContact C-O 3.57Å; P151-L186 WeakPolarHBondContact CA-O 3.34Å; P151-L186 HydrophobicContact CB-CB 4.11Å; I152-L186 PolarHBondContact N-O 3.4Å; L186-W212 HydrophobicContact CB-CH2 4.13Å; L186-W212 HydrophobicContact CB-CZ2 4.35Å; L186-A216 HydrophobicContact CD1-CB 4.11Å; L186-L219 HydrophobicContact CD1-CD1 3.71Å; L186-L418 HydrophobicContact CD2-CD2 3.75Å
187	C	95.9	Very high	91.3	Very high	12 Å²	12	44.7 Å²	44.7	8%	0.081	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	140.7	-177.6	-175.1	0	0	0	0	112.6	I152 V180 S185 F422	I152-C187 HydrophobicContact CG2-CB 3.93Å; I152-C187 WeakPolarHBondContact O-CA 3.45Å; V180-C187 HydrophobicContact CB-CB 4.27Å; V180-C187 HydrophobicContact CG1-CB 3.52Å; V180-C187 HydrophobicContact CG2-CB 3.64Å; S185-C187 PolarHBondContact O-N 3.14Å; C187-F422 HydrophobicContact CB-CZ 4.46Å
188	H	95.8	Very high	90.3	Very high	43 Å²	43	44 Å²	44	20%	0.199	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	151.9	167.3	175.1	57.7	0	0	0	110.6	I152 L153 V154 E190 W212	I152-H188 PolarHBondContact O-N 3.13Å; L153-H188 HydrophobicContact CD1-CB 4.42Å; V154-H188 PolarHBondContact N-O 2.87Å; H188-E190 IonicContact CD2-OE2 3.81Å; H188-E190 IonicContact CE1-OE2 2.76Å; H188-E190 IonicContact NE2-OE2 2.79Å; H188-E190 PolarHBondContact NE2-OE2 2.91Å; H188-W212 HydrophobicContact CB-CD2 3.34Å; H188-W212 HydrophobicContact CB-CE3 3.46Å; H188-W212 VanDerWaalsContact CB-CE3 3.46Å; H188-W212 HydrophobicContact CB-CG 3.99Å; H188-W212 HydrophobicContact CB-CH2 3.77Å; H188-W212 HydrophobicContact CB-CZ2 3.61Å; H188-W212 HydrophobicContact CB-CZ3 3.69Å; H188-W212 AromaticContact CD2-CG 3.94Å; H188-W212 AromaticContact CG-CD2 3.88Å; H188-W212 AromaticContact CG-CG 3.99Å
189	I	96.3	Very high	89.2	Confident	3 Å²	3	45.2 Å²	45.2	2%	0.015	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	120	-178.1	-51.1	170.9	0	0	0	108.4	V154 A156 I171 L176 Y425	V154-I189 HydrophobicContact CB-CG1 4.23Å; V154-I189 HydrophobicContact CB-CG2 4.44Å; V154-I189 HydrophobicContact CG1-CG2 4.49Å; V154-I189 WeakPolarHBondContact O-CA 3.39Å; A156-I189 HydrophobicContact CB-CG2 4.14Å; I171-I189 HydrophobicContact CD1-CD1 3.81Å; I171-I189 HydrophobicContact CG1-CD1 3.26Å; L176-I189 HydrophobicContact CD1-CD1 3.4Å; L176-I189 HydrophobicContact CD1-CG1 3.98Å; I189-Y425 PolarHBondContact O-OH 3.11Å
190	E	95.5	Very high	87.8	Confident	4 Å²	4	53.1 Å²	53.1	2%	0.019	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	106.2	-175.2	-172.3	67.1	-125	0	0	109.7	L153 V154 L155 A156 H188 C192 K205 R208	L153-E190 HydrophobicContact CD1-CB 4.03Å; V154-E190 PolarHBondContact O-N 2.9Å; L155-E190 HydrophobicContact CD2-CB 3.97Å; L155-E190 HydrophobicContact CD2-CG 4.36Å; A156-E190 PolarHBondContact N-O 2.88Å; A156-E190 VanDerWaalsContact N-O 3.09Å; H188-E190 IonicContact CD2-OE2 3.81Å; H188-E190 IonicContact CE1-OE2 2.76Å; H188-E190 IonicContact NE2-OE2 2.79Å; H188-E190 PolarHBondContact NE2-OE2 2.91Å; E190-C192 PolarHBondContact O-N 2.82Å; E190-K205 HydrophobicContact CG-CB 4.42Å; E190-K205 WeakPolarHBondContact CG-O 3.28Å; E190-R208 IonicContact OE1-CZ 3.86Å; E190-R208 IonicContact OE1-NE 2.56Å; E190-R208 PolarHBondContact OE1-NE 3.3Å; E190-R208 IonicContact OE1-NH2 2.82Å; E190-R208 PolarHBondContact OE1-NH2 2.9Å; E190-R208 IonicContact OE2-NE 2.73Å
191	P	94.4	Very high	86.1	Confident	42 Å²	42	62.5 Å²	62.5	27%	0.273	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	114.6	175.2	-18.9	32.5	0	0	0	110.7	Q159 K205	Q159-P191 HydrophobicContact CG-CB 4Å; P191-K205 WeakPolarHBondContact O-CD 3.47Å
192	C	93	Very high	84.3	Confident	1 Å²	1	64.5 Å²	64.5	1%	0.007	29%	0.293	C	S	.	.			trans	-133.4	162.5	-174.2	68.8	0	0	0	0	113.2	A156 N157 K158 Q159 E190 K205	A156-C192 PolarHBondContact O-N 2.86Å; N157-C192 CarbonylContact C-O 3.57Å; N157-C192 WeakPolarHBondContact CA-O 3.43Å; N157-C192 PolarHBondContact OD1-SG 2.86Å; K158-C192 PolarHBondContact N-O 2.84Å; Q159-C192 WeakPolarHBondContact CB-O 3.37Å; Q159-C192 VanDerWaalsContact CG-O 3.3Å; Q159-C192 WeakPolarHBondContact CG-O 3.42Å; Q159-C192 PolarHBondContact N-O 2.94Å; Q159-C192 VanDerWaalsContact N-O 3.15Å; E190-C192 PolarHBondContact O-N 2.82Å; C192-K205 HydrophobicContact CB-CB 4.2Å
193	S	92	Very high	82.8	Confident	10 Å²	10	61.8 Å²	61.8	7%	0.07	28%	0.283	C	S	.	.			trans	-129.3	107	156.8	173.1	0	0	0	0	108.1	D160 L195 M196 D197	D160-S193 WeakPolarHBondContact OD1-CB 3.39Å; D160-S193 PolarHBondContact OD1-OG 3.41Å; S193-L195 PolarHBondContact O-N 2.9Å; S193-M196 PolarHBondContact O-N 3.42Å; S193-M196 VanDerWaalsContact O-N 3.07Å; S193-M196 WeakPolarHBondContact OG-CG 3.26Å; S193-M196 PolarHBondContact OG-N 3.32Å; S193-D197 PolarHBondContact O-N 3.17Å
194	A	87.8	Confident	82.1	Confident	1 Å²	1	63.1 Å²	63.1	1%	0.008	29%	0.287	C	S	.	.	H	α-helix	trans	-55.8	-35.4	175.7	0	0	0	0	0	112.1	N157 D197 L198	N157-A194 PolarHBondContact OD1-N 3.01Å; A194-D197 PolarHBondContact O-N 3.18Å; A194-L198 WeakPolarHBondContact O-CD1 3.36Å; A194-L198 PolarHBondContact O-N 2.89Å; A194-L198 VanDerWaalsContact O-N 3.16Å
195	L	83.3	Confident	81.9	Confident	75 Å²	75	56.9 Å²	56.9	39%	0.393	27%	0.265	S	S	.	.	H	α-helix	trans	-69.6	-33.8	178.3	-174	60.8	0	0	0	112.3	S193 R199	S193-L195 PolarHBondContact O-N 2.9Å; L195-R199 PolarHBondContact O-N 3.12Å
196	M	78.7	Confident	81.8	Confident	67 Å²	67	56.9 Å²	56.9	33%	0.33	27%	0.265	S	S	.	.	H	α-helix	trans	-73.5	-39.2	171.6	-64.1	-59.4	116.7	0	0	112.1	D160 S193 L198 R199 R200	D160-M196 HydrophobicContact CB-CE 4.12Å; D160-M196 HydrophobicContact CB-CG 4.03Å; S193-M196 PolarHBondContact O-N 3.42Å; S193-M196 VanDerWaalsContact O-N 3.07Å; S193-M196 WeakPolarHBondContact OG-CG 3.26Å; S193-M196 PolarHBondContact OG-N 3.32Å; M196-L198 PolarHBondContact O-N 2.89Å; M196-R199 CarbonylContact O-C 3.59Å; M196-R199 PolarHBondContact O-N 3.34Å; M196-R200 PolarHBondContact O-N 3Å
197	D	72.6	Confident	81.7	Confident	11 Å²	11	55.3 Å²	55.3	6%	0.059	26%	0.257	C	S	.	.	H	α-helix	trans	-62.5	-25.4	177.1	-82.4	16.6	0	0	0	112.6	S193 A194 T206	S193-D197 PolarHBondContact O-N 3.17Å; A194-D197 PolarHBondContact O-N 3.18Å; D197-T206 WeakPolarHBondContact OD2-CB 3.29Å; D197-T206 PolarHBondContact OD2-N 2.85Å; D197-T206 VanDerWaalsContact OD2-N 3.12Å; D197-T206 PolarHBondContact OD2-OG1 2.82Å
198	L	69.8	Low	81.6	Confident	35 Å²	35	60.2 Å²	60.2	18%	0.183	27%	0.274	C	S	.	.	H	α-helix	trans	-77	-31.7	168.4	-90.7	83.9	0	0	0	113.5	S62 R65 P72 A194 M196	S62-L198 WeakPolarHBondContact O-CD1 3.37Å; R65-L198 HydrophobicContact CB-CD1 4.3Å; R65-L198 HydrophobicContact CB-CD2 4.45Å; P72-L198 HydrophobicContact CG-CB 4.41Å; P72-L198 WeakPolarHBondContact CG-O 3.41Å; A194-L198 WeakPolarHBondContact O-CD1 3.36Å; A194-L198 PolarHBondContact O-N 2.89Å; A194-L198 VanDerWaalsContact O-N 3.16Å; M196-L198 PolarHBondContact O-N 2.89Å
199	R	69.8	Low	81.6	Confident	163 Å²	163	58.2 Å²	58.2	62%	0.615	26%	0.264	S	S	*	.	H	α-helix	trans	-95.1	-25.6	-173.9	-73.7	-158.1	-82.7	-126	8.1	115.1	L195 M196	L195-R199 PolarHBondContact O-N 3.12Å; M196-R199 CarbonylContact O-C 3.59Å; M196-R199 PolarHBondContact O-N 3.34Å
200	R	65.1	Low	81.6	Confident	186 Å²	186	58 Å²	58	70%	0.702	26%	0.264	S	S	*	.			trans	-137.2	126.4	-169.5	-161.9	172.8	-176.9	176.6	1.3	111.4	M196 S202	M196-R200 PolarHBondContact O-N 3Å; R200-S202 VanDerWaalsContact C-N 3.33Å; R200-S202 PolarHBondContact O-N 2.86Å
201	W	58.7	Low	81.6	Confident	198 Å²	198	62.6 Å²	62.6	75%	0.75	28%	0.281	S	S	*	.			trans	-78.4	-10.3	-166.3	-135.4	-78.6	0	0	0	115.4
202	S	54.1	Low	81.7	Confident	103 Å²	103	63.4 Å²	63.4	72%	0.72	28%	0.278	S	S	*	.	S	Bend	trans	-88.5	-28.8	-149.9	-48.4	0	0	0	0	117.4	R200	R200-S202 VanDerWaalsContact C-N 3.33Å; R200-S202 PolarHBondContact O-N 2.86Å
203	D	61.3	Low	81.9	Confident	76 Å²	76	63.4 Å²	63.4	41%	0.406	28%	0.278	S	S	.	.			trans	-146.6	96.6	171.3	-179.7	23.3	0	0	0	109.3	K205 R208	D203-K205 VanDerWaalsContact C-N 3.3Å; D203-K205 PolarHBondContact O-N 3.1Å; D203-K205 WeakPolarHBondContact OD2-CE 3.13Å; D203-K205 WeakPolarHBondContact OD2-CG 3.28Å; D203-R208 IonicContact OD1-NH1 2.77Å; D203-R208 IonicContact OD2-NH1 3.9Å; D203-R208 PolarHBondContact OD2-NH1 2.81Å
204	R	78.1	Confident	82.1	Confident	35 Å²	35	63 Å²	63	13%	0.132	28%	0.275	C	S	.	.			trans	-83.9	73.5	-175.9	-66	171.9	176.6	-99.8	-0.3	110.1	G66 T206 L207 R208	G66-R204 PolarHBondContact O-NH1 2.86Å; G66-R204 VanDerWaalsContact O-NH1 3.08Å; R204-T206 PolarHBondContact O-N 2.9Å; R204-L207 HydrophobicContact CB-CB 3.99Å; R204-L207 WeakPolarHBondContact O-CA 3.49Å; R204-L207 WeakPolarHBondContact O-CB 3.4Å; R204-L207 PolarHBondContact O-N 3.06Å; R204-R208 PolarHBondContact O-N 3.33Å
205	K	89.9	Confident	82.5	Confident	79 Å²	79	69.1 Å²	69.1	34%	0.343	30%	0.298	S	S	.	.	H	α-helix	trans	-56.1	-38	-174.9	-60.4	-176.3	-173.1	178.4	0	111.7	E190 P191 C192 D203 L207 R208 G209	E190-K205 HydrophobicContact CG-CB 4.42Å; E190-K205 WeakPolarHBondContact CG-O 3.28Å; P191-K205 WeakPolarHBondContact O-CD 3.47Å; C192-K205 HydrophobicContact CB-CB 4.2Å; D203-K205 VanDerWaalsContact C-N 3.3Å; D203-K205 PolarHBondContact O-N 3.1Å; D203-K205 WeakPolarHBondContact OD2-CE 3.13Å; D203-K205 WeakPolarHBondContact OD2-CG 3.28Å; K205-L207 VanDerWaalsContact C-N 3.3Å; K205-L207 PolarHBondContact O-N 3.3Å; K205-R208 WeakPolarHBondContact O-CA 3.41Å; K205-R208 WeakPolarHBondContact O-CB 3.43Å; K205-R208 PolarHBondContact O-N 3.18Å; K205-G209 PolarHBondContact O-N 2.76Å
206	T	91.4	Very high	83.1	Confident	0 Å²	0	66 Å²	66	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-60.2	-39.1	176.8	-41.2	0	0	0	0	112.1	M67 L155 D197 R204 L210	M67-T206 HydrophobicContact CE-CG2 3.46Å; M67-T206 VanDerWaalsContact CE-CG2 3.46Å; M67-T206 HydrophobicContact CG-CG2 4.05Å; L155-T206 HydrophobicContact CD1-CG2 3.67Å; L155-T206 HydrophobicContact CD2-CG2 4.4Å; D197-T206 WeakPolarHBondContact OD2-CB 3.29Å; D197-T206 PolarHBondContact OD2-N 2.85Å; D197-T206 VanDerWaalsContact OD2-N 3.12Å; D197-T206 PolarHBondContact OD2-OG1 2.82Å; R204-T206 PolarHBondContact O-N 2.9Å; T206-L210 PolarHBondContact O-N 3.09Å
207	L	92.1	Very high	83.9	Confident	18 Å²	18	62.8 Å²	62.8	9%	0.094	27%	0.267	C	S	.	.	H	α-helix	trans	-75.8	-30	174.5	-177.7	62	0	0	0	112.5	V89 R204 K205 L210 R211	V89-L207 HydrophobicContact CG2-CD1 4.32Å; R204-L207 HydrophobicContact CB-CB 3.99Å; R204-L207 WeakPolarHBondContact O-CA 3.49Å; R204-L207 WeakPolarHBondContact O-CB 3.4Å; R204-L207 PolarHBondContact O-N 3.06Å; K205-L207 VanDerWaalsContact C-N 3.3Å; K205-L207 PolarHBondContact O-N 3.3Å; L207-L210 HydrophobicContact CD1-CD2 4.23Å; L207-L210 PolarHBondContact O-N 3.44Å; L207-R211 WeakPolarHBondContact O-CG 3.45Å; L207-R211 PolarHBondContact O-N 2.74Å
208	R	93.3	Very high	84.9	Confident	115 Å²	115	64 Å²	64	43%	0.434	28%	0.277	S	S	.	.	H	α-helix	trans	-61.9	-45.9	172.4	-176.1	172.6	69.9	-163	12.2	111.1	E190 D203 R204 K205 R211 W212	E190-R208 IonicContact OE1-CZ 3.86Å; E190-R208 IonicContact OE1-NE 2.56Å; E190-R208 PolarHBondContact OE1-NE 3.3Å; E190-R208 IonicContact OE1-NH2 2.82Å; E190-R208 PolarHBondContact OE1-NH2 2.9Å; E190-R208 IonicContact OE2-NE 2.73Å; D203-R208 IonicContact OD1-NH1 2.77Å; D203-R208 IonicContact OD2-NH1 3.9Å; D203-R208 PolarHBondContact OD2-NH1 2.81Å; R204-R208 PolarHBondContact O-N 3.33Å; K205-R208 WeakPolarHBondContact O-CA 3.41Å; K205-R208 WeakPolarHBondContact O-CB 3.43Å; K205-R208 PolarHBondContact O-N 3.18Å; R208-R211 PolarHBondContact O-N 3.14Å; R208-W212 PolarHBondContact O-N 3.39Å; R208-W212 VanDerWaalsContact O-N 3.13Å
209	G	95.5	Very high	85.9	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-59.7	-44.3	172.9	0	0	0	0	0	112.6	K205 R211 W212 L213	K205-G209 PolarHBondContact O-N 2.76Å; G209-R211 PolarHBondContact O-N 2.99Å; G209-W212 WeakPolarHBondContact O-CB 3.47Å; G209-W212 PolarHBondContact O-N 2.97Å; G209-W212 VanDerWaalsContact O-N 3.14Å; G209-L213 PolarHBondContact O-N 3.11Å
210	L	96.3	Very high	86.9	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-60.1	-41.9	175.7	178.6	61.3	0	0	0	112.1	M67 L87 V89 V94 L96 I120 T206 L207 W212 L213 L214	M67-L210 HydrophobicContact CE-CB 4.11Å; M67-L210 HydrophobicContact SD-CB 4.35Å; M67-L210 HydrophobicContact SD-CD2 3.77Å; L87-L210 HydrophobicContact CD1-CD2 4.12Å; V89-L210 HydrophobicContact CG2-CD2 3.91Å; V94-L210 HydrophobicContact CG1-CD1 4.45Å; L96-L210 HydrophobicContact CD2-CD1 4.48Å; I120-L210 HydrophobicContact CD1-CD1 4.29Å; T206-L210 PolarHBondContact O-N 3.09Å; L207-L210 HydrophobicContact CD1-CD2 4.23Å; L207-L210 PolarHBondContact O-N 3.44Å; L210-W212 VanDerWaalsContact C-N 3.31Å; L210-W212 PolarHBondContact O-N 3.08Å; L210-L213 PolarHBondContact O-N 2.73Å; L210-L213 VanDerWaalsContact O-N 3.13Å; L210-L214 HydrophobicContact CD1-CD1 4.33Å; L210-L214 HydrophobicContact CD1-CG 4.15Å; L210-L214 HydrophobicContact CG-CD1 4.06Å; L210-L214 HydrophobicContact CG-CG 4.35Å; L210-L214 WeakPolarHBondContact O-CG 3.38Å; L210-L214 PolarHBondContact O-N 2.83Å
211	R	95.9	Very high	88.2	Confident	99 Å²	99	58.4 Å²	58.4	37%	0.374	27%	0.269	S	S	.	.	H	α-helix	trans	-62.7	-35.6	175.2	-66.7	176.3	-153.6	-123.5	17	112.7	V89 E90 L207 R208 G209 R215	V89-R211 HydrophobicContact CG1-CG 3.96Å; E90-R211 VanDerWaalsContact OE1-CD 3.28Å; E90-R211 WeakPolarHBondContact OE1-CD 3.13Å; E90-R211 IonicContact OE1-CZ 3.17Å; E90-R211 IonicContact OE1-NE 2.75Å; E90-R211 IonicContact OE1-NH1 3.3Å; E90-R211 PolarHBondContact OE1-NH1 2.77Å; L207-R211 WeakPolarHBondContact O-CG 3.45Å; L207-R211 PolarHBondContact O-N 2.74Å; R208-R211 PolarHBondContact O-N 3.14Å; G209-R211 PolarHBondContact O-N 2.99Å; R211-R215 WeakPolarHBondContact O-CG 2.98Å; R211-R215 PolarHBondContact O-N 3.46Å; R211-R215 VanDerWaalsContact O-N 3.14Å
212	W	96.8	Very high	89.9	Confident	60 Å²	60	53.3 Å²	53.3	23%	0.227	26%	0.261	C	S	.	.	H	α-helix	trans	-62.3	-46.9	171.4	174.9	97.4	0	0	0	110.6	I152 L153 L186 H188 R208 G209 L210 L214 R215 A216	I152-W212 WeakPolarHBondContact O-CZ3 3.34Å; L153-W212 HydrophobicContact CD1-CE3 4.39Å; L186-W212 HydrophobicContact CB-CH2 4.13Å; L186-W212 HydrophobicContact CB-CZ2 4.35Å; H188-W212 HydrophobicContact CB-CD2 3.34Å; H188-W212 HydrophobicContact CB-CE3 3.46Å; H188-W212 VanDerWaalsContact CB-CE3 3.46Å; H188-W212 HydrophobicContact CB-CG 3.99Å; H188-W212 HydrophobicContact CB-CH2 3.77Å; H188-W212 HydrophobicContact CB-CZ2 3.61Å; H188-W212 HydrophobicContact CB-CZ3 3.69Å; H188-W212 AromaticContact CD2-CG 3.94Å; H188-W212 AromaticContact CG-CD2 3.88Å; H188-W212 AromaticContact CG-CG 3.99Å; R208-W212 PolarHBondContact O-N 3.39Å; R208-W212 VanDerWaalsContact O-N 3.13Å; G209-W212 WeakPolarHBondContact O-CB 3.47Å; G209-W212 PolarHBondContact O-N 2.97Å; G209-W212 VanDerWaalsContact O-N 3.14Å; L210-W212 VanDerWaalsContact C-N 3.31Å; L210-W212 PolarHBondContact O-N 3.08Å; W212-L214 VanDerWaalsContact C-N 3.34Å; W212-L214 PolarHBondContact O-N 3.05Å; W212-R215 PolarHBondContact O-N 3.42Å; W212-R215 VanDerWaalsContact O-N 3.13Å; W212-A216 HydrophobicContact CH2-CB 3.96Å; W212-A216 HydrophobicContact CZ2-CB 4.12Å; W212-A216 HydrophobicContact CZ3-CB 4.2Å; W212-A216 PolarHBondContact O-N 3.34Å
213	L	97.8	Very high	91.8	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-62.5	-40.1	-178.6	-177.5	60.2	0	0	0	112.1	I50 I120 P151 L153 G209 L210 A216 V217	I50-L213 HydrophobicContact CD1-CD2 3.94Å; I50-L213 HydrophobicContact CD1-CG 4.21Å; I50-L213 HydrophobicContact CG1-CD2 4.43Å; I50-L213 HydrophobicContact CG2-CD2 3.81Å; I120-L213 HydrophobicContact CD1-CD2 4.14Å; I120-L213 HydrophobicContact CG1-CD2 3.54Å; P151-L213 HydrophobicContact CB-CD1 3.85Å; P151-L213 HydrophobicContact CG-CD1 3.96Å; L153-L213 HydrophobicContact CB-CB 4.29Å; L153-L213 HydrophobicContact CB-CD1 4.46Å; L153-L213 HydrophobicContact CB-CD2 4.04Å; G209-L213 PolarHBondContact O-N 3.11Å; L210-L213 PolarHBondContact O-N 2.73Å; L210-L213 VanDerWaalsContact O-N 3.13Å; L213-A216 PolarHBondContact O-N 3.46Å; L213-V217 WeakPolarHBondContact O-CB 3.43Å; L213-V217 WeakPolarHBondContact O-CG2 3.49Å; L213-V217 PolarHBondContact O-N 3.25Å
214	L	96.6	Very high	93.3	Very high	1 Å²	1	51.3 Å²	51.3	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-65.9	-37.1	175.6	-65.7	169.7	0	0	0	112.3	V48 V89 Y92 V94 L210 W212 V217 C218	V48-L214 HydrophobicContact CB-CD2 4.12Å; V48-L214 HydrophobicContact CG1-CD2 4Å; V48-L214 HydrophobicContact CG2-CD2 4.24Å; V89-L214 HydrophobicContact CB-CD1 3.65Å; V89-L214 HydrophobicContact CG1-CD1 3.9Å; V89-L214 HydrophobicContact CG2-CD1 3.9Å; Y92-L214 HydrophobicContact CD1-CD2 4.25Å; Y92-L214 HydrophobicContact CD2-CB 4.16Å; Y92-L214 HydrophobicContact CD2-CD1 4.11Å; Y92-L214 HydrophobicContact CE2-CB 4.25Å; Y92-L214 HydrophobicContact CG-CB 4.34Å; Y92-L214 HydrophobicContact CG-CD1 4.21Å; Y92-L214 HydrophobicContact CG-CD2 4.14Å; Y92-L214 HydrophobicContact CG-CG 4.46Å; V94-L214 HydrophobicContact CG1-CD2 4.3Å; V94-L214 HydrophobicContact CG2-CD1 3.86Å; V94-L214 HydrophobicContact CG2-CD2 3.68Å; V94-L214 HydrophobicContact CG2-CG 4.41Å; L210-L214 HydrophobicContact CD1-CD1 4.33Å; L210-L214 HydrophobicContact CD1-CG 4.15Å; L210-L214 HydrophobicContact CG-CD1 4.06Å; L210-L214 HydrophobicContact CG-CG 4.35Å; L210-L214 WeakPolarHBondContact O-CG 3.38Å; L210-L214 PolarHBondContact O-N 2.83Å; W212-L214 VanDerWaalsContact C-N 3.34Å; W212-L214 PolarHBondContact O-N 3.05Å; L214-V217 PolarHBondContact O-N 3.34Å; L214-C218 WeakPolarHBondContact O-CB 3.39Å; L214-C218 PolarHBondContact O-N 3.35Å
215	R	95.4	Very high	94.2	Very high	130 Å²	130	51.2 Å²	51.2	49%	0.491	25%	0.247	S	C	.	.	H	α-helix	trans	-67.8	-38.3	172.3	-73.1	-171.8	-59.7	-93	0.7	112.4	R211 W212 C218 L219	R211-R215 WeakPolarHBondContact O-CG 2.98Å; R211-R215 PolarHBondContact O-N 3.46Å; R211-R215 VanDerWaalsContact O-N 3.14Å; W212-R215 PolarHBondContact O-N 3.42Å; W212-R215 VanDerWaalsContact O-N 3.13Å; R215-C218 VanDerWaalsContact O-CB 3.31Å; R215-C218 WeakPolarHBondContact O-CB 3.22Å; R215-C218 PolarHBondContact O-N 2.83Å; R215-C218 VanDerWaalsContact O-N 3.16Å; R215-L219 PolarHBondContact O-N 3.23Å
216	A	95.6	Very high	94.4	Very high	9 Å²	9	49.8 Å²	49.8	7%	0.074	25%	0.25	C	C	.	.	H	α-helix	trans	-64.8	-42.7	174.1	0	0	0	0	0	111.7	P151 L186 W212 L213 C218 L219	P151-A216 HydrophobicContact CB-CB 3.71Å; P151-A216 HydrophobicContact CG-CB 4.21Å; L186-A216 HydrophobicContact CD1-CB 4.11Å; W212-A216 HydrophobicContact CH2-CB 3.96Å; W212-A216 HydrophobicContact CZ2-CB 4.12Å; W212-A216 HydrophobicContact CZ3-CB 4.2Å; W212-A216 PolarHBondContact O-N 3.34Å; L213-A216 PolarHBondContact O-N 3.46Å; A216-C218 PolarHBondContact O-N 2.98Å; A216-L219 PolarHBondContact O-N 3.46Å
217	V	95.5	Very high	94.6	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-61.7	-28.9	171	165.3	0	0	0	0	112.3	V48 I50 H117 P151 L213 L214 Y221 L224	V48-V217 HydrophobicContact CG1-CG1 3.9Å; V48-V217 HydrophobicContact CG1-CG2 4.49Å; V48-V217 HydrophobicContact CG2-CG1 4.11Å; I50-V217 HydrophobicContact CD1-CG2 4.38Å; H117-V217 HydrophobicContact CB-CG1 4.29Å; H117-V217 HydrophobicContact CB-CG2 4.5Å; P151-V217 HydrophobicContact CG-CB 4.48Å; P151-V217 HydrophobicContact CG-CG2 3.5Å; L213-V217 WeakPolarHBondContact O-CB 3.43Å; L213-V217 WeakPolarHBondContact O-CG2 3.49Å; L213-V217 PolarHBondContact O-N 3.25Å; L214-V217 PolarHBondContact O-N 3.34Å; V217-Y221 HydrophobicContact CG1-CD2 4.02Å; V217-Y221 WeakPolarHBondContact O-CA 3.38Å; V217-Y221 WeakPolarHBondContact O-CB 3.26Å; V217-Y221 PolarHBondContact O-N 2.91Å; V217-L224 HydrophobicContact CB-CD2 4.36Å; V217-L224 HydrophobicContact CG1-CD2 4.01Å; V217-L224 HydrophobicContact CG2-CD2 4.26Å
218	C	93.3	Very high	94.8	Very high	38 Å²	38	53 Å²	53	26%	0.257	26%	0.262	S	S	.	.	H	α-helix	trans	-72.2	-24.5	-179	-168.4	0	0	0	0	113.9	Y92 L214 R215 A216	Y92-C218 WeakPolarHBondContact OH-CB 3.41Å; Y92-C218 PolarHBondContact OH-SG 2.84Å; L214-C218 WeakPolarHBondContact O-CB 3.39Å; L214-C218 PolarHBondContact O-N 3.35Å; R215-C218 VanDerWaalsContact O-CB 3.31Å; R215-C218 WeakPolarHBondContact O-CB 3.22Å; R215-C218 PolarHBondContact O-N 2.83Å; R215-C218 VanDerWaalsContact O-N 3.16Å; A216-C218 PolarHBondContact O-N 2.98Å
219	L	91.9	Very high	94.8	Very high	120 Å²	120	49.8 Å²	49.8	63%	0.628	26%	0.261	S	S	*	.	H	α-helix	trans	-60.5	-54.4	-175.9	-63.3	173.5	0	0	0	111	L186 R215 A216	L186-L219 HydrophobicContact CD1-CD1 3.71Å; R215-L219 PolarHBondContact O-N 3.23Å; A216-L219 PolarHBondContact O-N 3.46Å
220	D	90.1	Very high	94.7	Very high	100 Å²	100	56.3 Å²	56.3	54%	0.535	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.7	30.6	-176.2	-47.6	-51.3	0	0	0	111.7	P222 D223 L224	D220-P222 VanDerWaalsContact C-CD 3.47Å; D220-D223 PolarHBondContact O-N 3.17Å; D220-L224 VanDerWaalsContact O-CB 3.23Å; D220-L224 WeakPolarHBondContact O-CB 3.41Å; D220-L224 PolarHBondContact O-N 3.36Å
221	Y	93.2	Very high	94.6	Very high	45 Å²	45	57.5 Å²	57.5	18%	0.176	30%	0.297	C	S	.	.	H	α-helix	trans	-53.3	-43.4	-168.7	-177.7	-105.5	0	0	0	115	R46 K47 V48 V217 C225	R46-Y221 HydrophobicContact CB-CE1 4.14Å; R46-Y221 HydrophobicContact CB-CE2 4.1Å; R46-Y221 HydrophobicContact CG-CD1 4.3Å; R46-Y221 HydrophobicContact CG-CE1 3.82Å; R46-Y221 HydrophobicContact CG-CE2 4.49Å; K47-Y221 PolarHBondContact N-OH 3.04Å; K47-Y221 PolarHBondContact O-OH 3.31Å; K47-Y221 VanDerWaalsContact O-OH 3.08Å; V48-Y221 HydrophobicContact CG2-CE2 4.04Å; V217-Y221 HydrophobicContact CG1-CD2 4.02Å; V217-Y221 WeakPolarHBondContact O-CA 3.38Å; V217-Y221 WeakPolarHBondContact O-CB 3.26Å; V217-Y221 PolarHBondContact O-N 2.91Å; Y221-C225 WeakPolarHBondContact CE2-SG 3.39Å; Y221-C225 WeakPolarHBondContact O-CB 3.44Å; Y221-C225 PolarHBondContact O-N 2.96Å; Y221-C225 PolarHBondContact O-SG 3.18Å; Y221-C225 VanDerWaalsContact O-SG 3.36Å
222	P	93.1	Very high	94.3	Very high	91 Å²	91	55.8 Å²	55.8	59%	0.591	30%	0.3	S	S	*	.	H	α-helix	trans	-62.5	-49.4	180	-21.5	34.4	0	0	0	112.7	D220 C225 A226	D220-P222 VanDerWaalsContact C-CD 3.47Å; P222-C225 PolarHBondContact O-N 2.99Å; P222-A226 WeakPolarHBondContact O-CB 3.43Å; P222-A226 PolarHBondContact O-N 2.81Å
223	D	93.8	Very high	93.8	Very high	120 Å²	120	61 Å²	61	64%	0.642	33%	0.325	S	S	*	.	H	α-helix	trans	-69.3	-37.4	-178.6	-60.2	-66.6	0	0	0	111.7	D220 A226 R227	D220-D223 PolarHBondContact O-N 3.17Å; D223-A226 PolarHBondContact O-N 2.67Å; D223-R227 VanDerWaalsContact O-CB 3.29Å; D223-R227 WeakPolarHBondContact O-CB 3.28Å; D223-R227 PolarHBondContact O-N 2.76Å
224	L	94.8	Very high	93.2	Very high	17 Å²	17	67.9 Å²	67.9	9%	0.089	35%	0.351	C	S	.	.	H	α-helix	trans	-63.6	-42.1	173.7	-179.1	54.2	0	0	0	111.8	H117 K150 V217 D220 V228	H117-L224 HydrophobicContact CB-CD2 4.25Å; H117-L224 HydrophobicContact CB-CG 4.35Å; K150-L224 HydrophobicContact CD-CD1 4.29Å; K150-L224 HydrophobicContact CG-CD1 3.95Å; V217-L224 HydrophobicContact CB-CD2 4.36Å; V217-L224 HydrophobicContact CG1-CD2 4.01Å; V217-L224 HydrophobicContact CG2-CD2 4.26Å; D220-L224 VanDerWaalsContact O-CB 3.23Å; D220-L224 WeakPolarHBondContact O-CB 3.41Å; D220-L224 PolarHBondContact O-N 3.36Å; L224-V228 HydrophobicContact CD1-CG2 4.44Å; L224-V228 WeakPolarHBondContact O-CB 3.41Å; L224-V228 VanDerWaalsContact O-CG2 3.29Å; L224-V228 WeakPolarHBondContact O-CG2 3.49Å; L224-V228 PolarHBondContact O-N 2.86Å
225	C	95.6	Very high	92.1	Very high	33 Å²	33	72.5 Å²	72.5	22%	0.223	38%	0.381	C	S	.	.	H	α-helix	trans	-66.5	-42	173.1	-76.3	0	0	0	0	112.4	H117 Y221 P222 R227 V228 A229	H117-C225 PolarHBondContact NE2-SG 3.27Å; H117-C225 VanDerWaalsContact NE2-SG 3.36Å; Y221-C225 WeakPolarHBondContact CE2-SG 3.39Å; Y221-C225 WeakPolarHBondContact O-CB 3.44Å; Y221-C225 PolarHBondContact O-N 2.96Å; Y221-C225 PolarHBondContact O-SG 3.18Å; Y221-C225 VanDerWaalsContact O-SG 3.36Å; P222-C225 PolarHBondContact O-N 2.99Å; C225-R227 VanDerWaalsContact C-N 3.34Å; C225-R227 PolarHBondContact O-N 2.9Å; C225-V228 PolarHBondContact O-N 3.03Å; C225-A229 WeakPolarHBondContact O-CB 3.48Å; C225-A229 PolarHBondContact O-N 3.41Å
226	A	95.2	Very high	91.1	Very high	49 Å²	49	68.2 Å²	68.2	41%	0.405	37%	0.367	S	S	.	.	H	α-helix	trans	-60.3	-44.9	175.7	0	0	0	0	0	111.3	P222 D223 A229 Q230	P222-A226 WeakPolarHBondContact O-CB 3.43Å; P222-A226 PolarHBondContact O-N 2.81Å; D223-A226 PolarHBondContact O-N 2.67Å; A226-A229 PolarHBondContact O-N 3.37Å; A226-Q230 WeakPolarHBondContact O-CG 3.32Å; A226-Q230 PolarHBondContact O-N 3.2Å
227	R	95.3	Very high	89.6	Confident	72 Å²	72	72 Å²	72	27%	0.272	38%	0.383	S	S	.	.	H	α-helix	trans	-63.1	-45.7	174.4	179.1	178.3	169.1	-165.4	1.3	112.5	P145 A148 D223 C225 A229 Q230 D231	P145-R227 PolarHBondContact O-NH2 2.91Å; A148-R227 VanDerWaalsContact O-CZ 3.26Å; A148-R227 PolarHBondContact O-NH1 3.04Å; A148-R227 PolarHBondContact O-NH2 3.31Å; D223-R227 VanDerWaalsContact O-CB 3.29Å; D223-R227 WeakPolarHBondContact O-CB 3.28Å; D223-R227 PolarHBondContact O-N 2.76Å; C225-R227 VanDerWaalsContact C-N 3.34Å; C225-R227 PolarHBondContact O-N 2.9Å; R227-A229 VanDerWaalsContact C-N 3.29Å; R227-A229 PolarHBondContact O-N 3.2Å; R227-Q230 WeakPolarHBondContact O-CB 3.39Å; R227-Q230 PolarHBondContact O-N 2.9Å; R227-Q230 VanDerWaalsContact O-N 3.08Å; R227-D231 IonicContact NE-OD2 2.7Å; R227-D231 PolarHBondContact NE-OD2 2.96Å; R227-D231 WeakPolarHBondContact O-CB 3.42Å; R227-D231 PolarHBondContact O-N 3.27Å
228	V	95.8	Very high	87.5	Confident	13 Å²	13	76.5 Å²	76.5	8%	0.079	41%	0.413	C	S	.	.	H	α-helix	trans	-59.2	-40.9	175.4	163.1	0	0	0	0	111.2	E115 A116 L224 C225 Q230 D231 S232	E115-V228 WeakPolarHBondContact O-CG1 3.49Å; A116-V228 WeakPolarHBondContact O-CG2 3.41Å; L224-V228 HydrophobicContact CD1-CG2 4.44Å; L224-V228 WeakPolarHBondContact O-CB 3.41Å; L224-V228 VanDerWaalsContact O-CG2 3.29Å; L224-V228 WeakPolarHBondContact O-CG2 3.49Å; L224-V228 PolarHBondContact O-N 2.86Å; C225-V228 PolarHBondContact O-N 3.03Å; V228-Q230 PolarHBondContact O-N 2.86Å; V228-D231 PolarHBondContact O-N 3.09Å; V228-S232 WeakPolarHBondContact O-CB 3.46Å; V228-S232 PolarHBondContact O-N 2.67Å
229	A	94.4	Very high	85.5	Confident	49 Å²	49	85 Å²	85	41%	0.405	44%	0.44	S	S	.	.	H	α-helix	trans	-66.7	-20.5	176.7	0	0	0	0	0	113.9	C225 A226 R227 K233	C225-A229 WeakPolarHBondContact O-CB 3.48Å; C225-A229 PolarHBondContact O-N 3.41Å; A226-A229 PolarHBondContact O-N 3.37Å; R227-A229 VanDerWaalsContact C-N 3.29Å; R227-A229 PolarHBondContact O-N 3.2Å; A229-K233 VanDerWaalsContact O-CD 3.23Å; A229-K233 WeakPolarHBondContact O-CD 3.25Å; A229-K233 WeakPolarHBondContact O-CE 3.18Å; A229-K233 WeakPolarHBondContact O-CG 3.33Å
230	Q	93.6	Very high	83.6	Confident	136 Å²	136	82.3 Å²	82.3	64%	0.636	42%	0.424	S	S	*	.	H	α-helix	trans	-87.3	-53.2	171.2	-65.6	169.7	13.9	0	0	111.3	A226 R227 V228 S232 K233 R234	A226-Q230 WeakPolarHBondContact O-CG 3.32Å; A226-Q230 PolarHBondContact O-N 3.2Å; R227-Q230 WeakPolarHBondContact O-CB 3.39Å; R227-Q230 PolarHBondContact O-N 2.9Å; R227-Q230 VanDerWaalsContact O-N 3.08Å; V228-Q230 PolarHBondContact O-N 2.86Å; Q230-S232 PolarHBondContact O-N 3.22Å; Q230-K233 PolarHBondContact O-N 2.92Å; Q230-R234 PolarHBondContact O-N 3.49Å; Q230-R234 VanDerWaalsContact O-N 3.09Å
231	D	92.9	Very high	81.6	Confident	25 Å²	25	85.9 Å²	85.9	13%	0.134	43%	0.43	C	S	.	.	H	α-helix	trans	-62.2	-28.4	-178.5	-85.2	-29	0	0	0	112.8	R146 K150 R227 V228	R146-D231 HydrophobicContact CG-CB 4.33Å; R146-D231 PolarHBondContact NH1-O 2.89Å; K150-D231 IonicContact NZ-OD2 3.97Å; R227-D231 IonicContact NE-OD2 2.7Å; R227-D231 PolarHBondContact NE-OD2 2.96Å; R227-D231 WeakPolarHBondContact O-CB 3.42Å; R227-D231 PolarHBondContact O-N 3.27Å; V228-D231 PolarHBondContact O-N 3.09Å
232	S	89.7	Confident	79.3	Confident	63 Å²	63	90.8 Å²	90.8	44%	0.441	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-30	173.5	175.5	0	0	0	0	113	V228 Q230	V228-S232 WeakPolarHBondContact O-CB 3.46Å; V228-S232 PolarHBondContact O-N 2.67Å; Q230-S232 PolarHBondContact O-N 3.22Å
233	K	87.3	Confident	77.4	Confident	170 Å²	170	95.4 Å²	95.4	74%	0.739	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-26.2	-179.6	-66.7	176.3	-171.2	174.3	0	112.9	A229 Q230 P235	A229-K233 VanDerWaalsContact O-CD 3.23Å; A229-K233 WeakPolarHBondContact O-CD 3.25Å; A229-K233 WeakPolarHBondContact O-CE 3.18Å; A229-K233 WeakPolarHBondContact O-CG 3.33Å; Q230-K233 PolarHBondContact O-N 2.92Å; K233-P235 WeakPolarHBondContact O-CD 3.42Å
234	R	83.2	Confident	75.1	Confident	144 Å²	144	95.5 Å²	95.5	54%	0.543	46%	0.46	S	S	.	.	S	Bend	trans	-68.1	122.4	-178.7	-174.4	179.5	173.2	154.1	2.4	111.1	R146 Q230 E237	R146-R234 PolarHBondContact NH1-O 2.82Å; R146-R234 PolarHBondContact NH2-O 2.59Å; Q230-R234 PolarHBondContact O-N 3.49Å; Q230-R234 VanDerWaalsContact O-N 3.09Å; R234-E237 IonicContact CZ-OE1 3.42Å; R234-E237 IonicContact NE-OE1 3.3Å; R234-E237 PolarHBondContact NE-OE1 3.45Å; R234-E237 IonicContact NH2-OE1 3.8Å; R234-E237 PolarHBondContact NH2-OE1 2.86Å
235	P	75.1	Confident	72.5	Confident	99 Å²	99	97.5 Å²	97.5	64%	0.643	49%	0.485	S	S	*	.	P	Polyproline II helix	trans	-54.5	153.8	172.2	-26.1	35.6	0	0	0	112.9	R146 K233	R146-P235 PolarHBondContact NH2-O 2.93Å; K233-P235 WeakPolarHBondContact O-CD 3.42Å
236	L	73.1	Confident	70.2	Confident	39 Å²	39	105.6 Å²	105.6	20%	0.204	51%	0.511	C	S	.	.	P	Polyproline II helix	trans	-74.8	139.2	168.9	-69.6	176.4	0	0	0	110.5	R110 E111	R110-L236 HydrophobicContact CB-CD1 4.38Å; E111-L236 HydrophobicContact CB-CD1 4.45Å; E111-L236 HydrophobicContact CG-CD1 3.55Å
237	E	64.4	Low	68	Low	88 Å²	88	107.5 Å²	107.5	41%	0.411	52%	0.519	S	S	.	.	P	Polyproline II helix	trans	-64.8	139.9	-173.4	-61.5	-61.1	154.4	0	0	111.4	R234 R239 E240	R234-E237 IonicContact CZ-OE1 3.42Å; R234-E237 IonicContact NE-OE1 3.3Å; R234-E237 PolarHBondContact NE-OE1 3.45Å; R234-E237 IonicContact NH2-OE1 3.8Å; R234-E237 PolarHBondContact NH2-OE1 2.86Å; E237-R239 VanDerWaalsContact C-N 3.28Å; E237-R239 PolarHBondContact O-N 3.05Å; E237-R239 VanDerWaalsContact O-N 3.11Å; E237-E240 WeakPolarHBondContact O-CB 3.29Å; E237-E240 PolarHBondContact O-N 2.88Å
238	P	52.8	Low	65.6	Low	95 Å²	95	109.7 Å²	109.7	62%	0.617	53%	0.532	S	S	*	.	H	α-helix	trans	-55.2	-36.1	-172.1	-29.8	36.2	0	0	0	115.3	E240 R241	P238-E240 PolarHBondContact O-N 3.29Å; P238-E240 VanDerWaalsContact O-N 3.09Å; P238-R241 WeakPolarHBondContact O-CB 3.47Å; P238-R241 PolarHBondContact O-N 2.95Å
239	R	51.1	Low	63.2	Low	218 Å²	218	116.5 Å²	116.5	82%	0.823	56%	0.561	S	S	*	*	H	α-helix	trans	-57.8	-21.1	176.2	-83.9	-176.1	168.4	179.8	-3.1	114	E237	E237-R239 VanDerWaalsContact C-N 3.28Å; E237-R239 PolarHBondContact O-N 3.05Å; E237-R239 VanDerWaalsContact O-N 3.11Å
240	E	52.2	Low	61.1	Low	62 Å²	62	118.8 Å²	118.8	29%	0.29	57%	0.569	S	S	.	*	H	α-helix	trans	-84.1	-24.5	176.2	-56.5	-159.7	101	0	0	112.8	R110 E237 P238	R110-E240 WeakPolarHBondContact CD-OE1 3.33Å; R110-E240 IonicContact CZ-OE1 3.61Å; R110-E240 IonicContact NE-OE1 2.73Å; R110-E240 IonicContact NH1-OE1 3.15Å; R110-E240 PolarHBondContact NH1-OE1 3.44Å; E237-E240 WeakPolarHBondContact O-CB 3.29Å; E237-E240 PolarHBondContact O-N 2.88Å; P238-E240 PolarHBondContact O-N 3.29Å; P238-E240 VanDerWaalsContact O-N 3.09Å
241	R	47.2	Very low	59.1	Low	175 Å²	175	119.3 Å²	119.3	66%	0.66	57%	0.572	S	S	*	*	H	α-helix	trans	-71.8	-35.1	178.2	-65.2	-175.3	173.7	-161.1	-4.4	112.3	P238 K243 K244	P238-R241 WeakPolarHBondContact O-CB 3.47Å; P238-R241 PolarHBondContact O-N 2.95Å; R241-K243 PolarHBondContact O-N 2.82Å; R241-K244 WeakPolarHBondContact O-CB 3.25Å; R241-K244 PolarHBondContact O-N 3.14Å
242	E	45.6	Very low	57.1	Low	148 Å²	148	125.7 Å²	125.7	69%	0.692	59%	0.594	S	S	*	*	G	3₁₀ helix	trans	-59.3	-32.9	-176.1	-61.9	-173.4	133.5	0	0	113.1	K244 G245	E242-K244 PolarHBondContact O-N 3.06Å; E242-G245 PolarHBondContact O-N 3.06Å
243	K	51.4	Low	55.4	Low	189 Å²	189	127 Å²	127	82%	0.822	60%	0.595	S	S	*	*	G	3₁₀ helix	trans	-63	-23.3	175.2	-69.2	-171.9	178.3	-178.1	0	113.3	R241	R241-K243 PolarHBondContact O-N 2.82Å
244	K	47.4	Very low	53.8	Low	121 Å²	121	121 Å²	121	53%	0.526	57%	0.574	S	S	.	*	G	3₁₀ helix	trans	-80.4	-17.2	173.4	-59.6	-169.5	177.9	-169.6	0	113.3	E111 R241 E242 R246 P247	E111-K244 IonicContact OE1-NZ 3.62Å; E111-K244 PolarHBondContact OE1-NZ 3.19Å; R241-K244 WeakPolarHBondContact O-CB 3.25Å; R241-K244 PolarHBondContact O-N 3.14Å; E242-K244 PolarHBondContact O-N 3.06Å; K244-R246 PolarHBondContact O-N 3.47Å; K244-P247 WeakPolarHBondContact O-CD 3.33Å
245	G	38.4	Very low	52.4	Low	60 Å²	60	121.7 Å²	121.7	62%	0.619	58%	0.581	S	S	*	*	S	Bend	trans	-84.1	-1.7	-172.1	0	0	0	0	0	116.4	E242 P247	E242-G245 PolarHBondContact O-N 3.06Å; G245-P247 VanDerWaalsContact C-CD 3.5Å
246	R	47.6	Very low	51.5	Low	203 Å²	203	121.9 Å²	121.9	77%	0.766	58%	0.576	S	S	*	*			trans	-95.3	-7.9	-174.4	-105.3	-177.4	-179.2	-168.7	0.4	119.9	K244	K244-R246 PolarHBondContact O-N 3.47Å
247	P	48.6	Very low	50.5	Low	88 Å²	88	125.7 Å²	125.7	57%	0.571	59%	0.593	S	S	*	*	H	α-helix	trans	-69.6	-39.4	-176.1	27.5	-32.9	0	0	0	113.3	K244 G245 K249 V250 Q251	K244-P247 WeakPolarHBondContact O-CD 3.33Å; G245-P247 VanDerWaalsContact C-CD 3.5Å; P247-K249 PolarHBondContact O-N 3.29Å; P247-V250 PolarHBondContact O-N 3.39Å; P247-Q251 PolarHBondContact O-N 3.24Å
248	E	46.1	Very low	50.1	Low	118 Å²	118	130.3 Å²	130.3	55%	0.551	61%	0.607	S	S	*	*	H	α-helix	trans	-62.1	-41.8	-176.1	-79.6	-152.7	97	0	0	114	V250 Q251 R252	E248-V250 VanDerWaalsContact C-N 3.32Å; E248-V250 PolarHBondContact O-N 3.44Å; E248-Q251 PolarHBondContact O-N 3.32Å; E248-R252 WeakPolarHBondContact O-CG 3.28Å; E248-R252 PolarHBondContact O-N 2.97Å; E248-R252 IonicContact OE1-CZ 2.67Å; E248-R252 IonicContact OE1-NE 2.9Å; E248-R252 IonicContact OE1-NH2 2.77Å; E248-R252 PolarHBondContact OE1-NH2 3.35Å; E248-R252 IonicContact OE2-NH2 3.99Å
249	K	46	Very low	49.9	Very low	157 Å²	157	132.4 Å²	132.4	68%	0.683	61%	0.61	S	S	*	*	H	α-helix	trans	-66.2	-35.6	-176.4	-78	-172.7	174.5	-179.2	0	111.8	P247 R252 I253	P247-K249 PolarHBondContact O-N 3.29Å; K249-R252 PolarHBondContact O-N 3.12Å; K249-I253 WeakPolarHBondContact O-CD1 3.3Å; K249-I253 WeakPolarHBondContact O-CG1 3.45Å; K249-I253 PolarHBondContact O-N 3.21Å
250	V	50.5	Low	49.9	Very low	96 Å²	96	130.9 Å²	130.9	58%	0.582	60%	0.604	S	S	*	*	H	α-helix	trans	-70	-38.7	176.8	-176.6	0	0	0	0	111.4	P247 E248 R252 I253 S254	P247-V250 PolarHBondContact O-N 3.39Å; E248-V250 VanDerWaalsContact C-N 3.32Å; E248-V250 PolarHBondContact O-N 3.44Å; V250-R252 VanDerWaalsContact C-N 3.34Å; V250-R252 PolarHBondContact O-N 3.01Å; V250-I253 PolarHBondContact O-N 3.04Å; V250-S254 PolarHBondContact O-N 2.93Å; V250-S254 VanDerWaalsContact O-N 3.1Å; V250-S254 PolarHBondContact O-OG 2.89Å
251	Q	50	Low	49.7	Very low	147 Å²	147	131.1 Å²	131.1	69%	0.687	61%	0.613	S	S	*	*	H	α-helix	trans	-65.5	-34.1	172.4	-102.1	-175.6	5.2	0	0	113	P247 E248 S254 K255	P247-Q251 PolarHBondContact O-N 3.24Å; E248-Q251 PolarHBondContact O-N 3.32Å; Q251-S254 PolarHBondContact O-OG 3.3Å; Q251-K255 VanDerWaalsContact O-CB 3.29Å; Q251-K255 WeakPolarHBondContact O-CB 3.43Å; Q251-K255 PolarHBondContact O-N 3.28Å
252	R	50.9	Low	49.8	Very low	160 Å²	160	127.6 Å²	127.6	60%	0.604	62%	0.615	S	S	*	*	H	α-helix	trans	-71.8	-39.2	175.5	-68.5	-179.2	-163.3	-162.8	7.9	112.4	E248 K249 V250 L256	E248-R252 WeakPolarHBondContact O-CG 3.28Å; E248-R252 PolarHBondContact O-N 2.97Å; E248-R252 IonicContact OE1-CZ 2.67Å; E248-R252 IonicContact OE1-NE 2.9Å; E248-R252 IonicContact OE1-NH2 2.77Å; E248-R252 PolarHBondContact OE1-NH2 3.35Å; E248-R252 IonicContact OE2-NH2 3.99Å; K249-R252 PolarHBondContact O-N 3.12Å; V250-R252 VanDerWaalsContact C-N 3.34Å; V250-R252 PolarHBondContact O-N 3.01Å; R252-L256 WeakPolarHBondContact O-CB 3.5Å; R252-L256 PolarHBondContact O-N 2.81Å
253	I	55.5	Low	49.9	Very low	91 Å²	91	129.1 Å²	129.1	47%	0.467	62%	0.62	S	S	.	*	H	α-helix	trans	-62.3	-56.7	176.3	-70.5	160.6	0	0	0	110.6	K249 V250 K255 L256 E257	K249-I253 WeakPolarHBondContact O-CD1 3.3Å; K249-I253 WeakPolarHBondContact O-CG1 3.45Å; K249-I253 PolarHBondContact O-N 3.21Å; V250-I253 PolarHBondContact O-N 3.04Å; I253-K255 PolarHBondContact O-N 2.75Å; I253-K255 VanDerWaalsContact O-N 3.14Å; I253-L256 WeakPolarHBondContact O-CA 3.17Å; I253-L256 WeakPolarHBondContact O-CB 3.5Å; I253-L256 PolarHBondContact O-N 2.98Å; I253-E257 HydrophobicContact CG2-CG 4.28Å; I253-E257 WeakPolarHBondContact CG2-OE2 3.37Å; I253-E257 WeakPolarHBondContact O-CG 2.89Å; I253-E257 PolarHBondContact O-N 3.27Å
254	S	53.7	Low	49.7	Very low	43 Å²	43	123.6 Å²	123.6	30%	0.301	61%	0.605	S	S	.	*	H	α-helix	trans	-59.6	-29.7	-179.5	52.1	0	0	0	0	114	V250 Q251 R258	V250-S254 PolarHBondContact O-N 2.93Å; V250-S254 VanDerWaalsContact O-N 3.1Å; V250-S254 PolarHBondContact O-OG 2.89Å; Q251-S254 PolarHBondContact O-OG 3.3Å; S254-R258 WeakPolarHBondContact O-CG 3.26Å; S254-R258 PolarHBondContact O-N 3.42Å
255	K	53.5	Low	49.5	Very low	159 Å²	159	124.6 Å²	124.6	69%	0.691	62%	0.616	S	S	*	*	H	α-helix	trans	-77.1	-31.7	174.1	-158.6	170.5	-172	176.5	0	112.8	Q251 I253 M259	Q251-K255 VanDerWaalsContact O-CB 3.29Å; Q251-K255 WeakPolarHBondContact O-CB 3.43Å; Q251-K255 PolarHBondContact O-N 3.28Å; I253-K255 PolarHBondContact O-N 2.75Å; I253-K255 VanDerWaalsContact O-N 3.14Å; K255-M259 VanDerWaalsContact O-CG 3.22Å; K255-M259 WeakPolarHBondContact O-CG 3.49Å; K255-M259 PolarHBondContact O-N 3.25Å
256	L	55.7	Low	49.8	Very low	103 Å²	103	129.6 Å²	129.6	54%	0.539	63%	0.627	S	S	.	*	H	α-helix	trans	-75.8	-34.8	174.7	-174.9	62.7	0	0	0	112.3	R252 I253 M259 R260	R252-L256 WeakPolarHBondContact O-CB 3.5Å; R252-L256 PolarHBondContact O-N 2.81Å; I253-L256 WeakPolarHBondContact O-CA 3.17Å; I253-L256 WeakPolarHBondContact O-CB 3.5Å; I253-L256 PolarHBondContact O-N 2.98Å; L256-M259 PolarHBondContact O-N 3Å; L256-R260 PolarHBondContact O-N 2.73Å; L256-R260 VanDerWaalsContact O-N 3.14Å
257	E	52.5	Low	49.5	Very low	118 Å²	118	131.6 Å²	131.6	55%	0.551	64%	0.635	S	S	*	*	H	α-helix	trans	-67.8	-44.8	177.2	-71.8	171.6	145	0	0	112.1	I253 M259 R260 S261	I253-E257 HydrophobicContact CG2-CG 4.28Å; I253-E257 WeakPolarHBondContact CG2-OE2 3.37Å; I253-E257 WeakPolarHBondContact O-CG 2.89Å; I253-E257 PolarHBondContact O-N 3.27Å; E257-M259 PolarHBondContact O-N 3.02Å; E257-R260 WeakPolarHBondContact O-CA 3.43Å; E257-R260 WeakPolarHBondContact O-CB 3.38Å; E257-R260 PolarHBondContact O-N 3.29Å; E257-S261 PolarHBondContact O-N 3.16Å
258	R	54.5	Low	49.2	Very low	185 Å²	185	136.4 Å²	136.4	70%	0.698	65%	0.65	S	S	*	*	H	α-helix	trans	-59.7	-33.6	172.6	-71.4	175.4	-175.2	169.5	3.1	112.9	S254 R260 S261 S262	S254-R258 WeakPolarHBondContact O-CG 3.26Å; S254-R258 PolarHBondContact O-N 3.42Å; R258-R260 VanDerWaalsContact C-N 3.27Å; R258-R260 PolarHBondContact O-N 3.39Å; R258-S261 PolarHBondContact O-OG 3.21Å; R258-S262 WeakPolarHBondContact O-CB 3.36Å; R258-S262 PolarHBondContact O-N 3.17Å
259	M	49.7	Very low	48.7	Very low	140 Å²	140	137.4 Å²	137.4	69%	0.69	66%	0.663	S	S	*	*	H	α-helix	trans	-76.4	-11.5	174.4	-68.2	-66.9	-66.7	0	0	113.5	K255 L256 E257	K255-M259 VanDerWaalsContact O-CG 3.22Å; K255-M259 WeakPolarHBondContact O-CG 3.49Å; K255-M259 PolarHBondContact O-N 3.25Å; L256-M259 PolarHBondContact O-N 3Å; E257-M259 PolarHBondContact O-N 3.02Å
260	R	51.1	Low	48.2	Very low	185 Å²	185	138.6 Å²	138.6	70%	0.698	67%	0.671	S	S	*	*	H	α-helix	trans	-92.9	-44.4	171.5	-79.2	179.1	164.8	179.5	-5.8	112.2	L256 E257 R258 S262 K263	L256-R260 PolarHBondContact O-N 2.73Å; L256-R260 VanDerWaalsContact O-N 3.14Å; E257-R260 WeakPolarHBondContact O-CA 3.43Å; E257-R260 WeakPolarHBondContact O-CB 3.38Å; E257-R260 PolarHBondContact O-N 3.29Å; R258-R260 VanDerWaalsContact C-N 3.27Å; R258-R260 PolarHBondContact O-N 3.39Å; R260-S262 VanDerWaalsContact C-N 3.34Å; R260-S262 PolarHBondContact O-N 2.92Å; R260-K263 PolarHBondContact O-N 3.28Å; R260-K263 VanDerWaalsContact O-N 3.15Å
261	S	47	Very low	47.1	Very low	67 Å²	67	145.4 Å²	145.4	47%	0.469	69%	0.686	S	S	.	*	H	α-helix	trans	-63.8	-37.9	177.7	65.3	0	0	0	0	112.2	E257 R258 K263 S264	E257-S261 PolarHBondContact O-N 3.16Å; R258-S261 PolarHBondContact O-OG 3.21Å; S261-K263 PolarHBondContact O-N 3.03Å; S261-S264 PolarHBondContact O-N 2.96Å; S261-S264 PolarHBondContact O-OG 2.97Å
262	S	49.8	Very low	46.1	Very low	102 Å²	102	143.1 Å²	143.1	71%	0.713	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.7	10.3	174.9	-168.9	0	0	0	0	114.6	R258 R260	R258-S262 WeakPolarHBondContact O-CB 3.36Å; R258-S262 PolarHBondContact O-N 3.17Å; R260-S262 VanDerWaalsContact C-N 3.34Å; R260-S262 PolarHBondContact O-N 2.92Å
263	K	48.3	Very low	45	Very low	180 Å²	180	147.1 Å²	147.1	78%	0.783	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.9	-6.6	-177.3	-135.3	174.1	-173.7	178.3	0	114.5	R260 S261	R260-K263 PolarHBondContact O-N 3.28Å; R260-K263 VanDerWaalsContact O-N 3.15Å; S261-K263 PolarHBondContact O-N 3.03Å
264	S	46	Very low	43.8	Very low	73 Å²	73	150.3 Å²	150.3	51%	0.51	72%	0.72	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.2	-36.3	172.7	40.5	0	0	0	0	112.7	S261 L266	S261-S264 PolarHBondContact O-N 2.96Å; S261-S264 PolarHBondContact O-OG 2.97Å; S264-L266 PolarHBondContact O-N 3.21Å
265	D	43.6	Very low	42.6	Very low	141 Å²	141	156.9 Å²	156.9	75%	0.754	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.6	11.3	-158.6	-55.1	-2.3	0	0	0	114.1
266	L	44.7	Very low	41.6	Very low	166 Å²	166	155.3 Å²	155.3	87%	0.869	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.2	17.9	-177.7	-140.6	78.7	0	0	0	113.9	S264	S264-L266 PolarHBondContact O-N 3.21Å
267	R	41.2	Very low	40.4	Very low	244 Å²	244	157.7 Å²	157.7	92%	0.921	74%	0.744	S	S	*	*	S	Bend	trans	-138	25	-174.8	-78.3	-164.6	170.6	-160.9	-2.6	116.5
268	Q	43.6	Very low	39.2	Very low	190 Å²	190	162.4 Å²	162.4	89%	0.888	76%	0.757	S	S	*	*			trans	-146.9	48.4	176.1	-149.1	170.5	6	0	0	117.1
269	V	34.1	Very low	37.9	Very low	138 Å²	138	161 Å²	161	84%	0.836	76%	0.763	S	S	*	*			trans	-136	89.7	161.7	-171.9	0	0	0	0	111.3
270	H	35.8	Very low	36.9	Very low	182 Å²	182	159.9 Å²	159.9	84%	0.843	77%	0.769	S	S	*	*			trans	-162.7	136.8	154	-117.3	73.9	0	0	0	110.7
271	R	28.4	Very low	35.8	Very low	239 Å²	239	154.7 Å²	154.7	90%	0.902	77%	0.774	S	S	*	*			trans	66.3	139.5	-172.6	-59.6	178.9	176	172.4	-1.6	114
272	S	29.3	Very low	35.1	Very low	100 Å²	100	161.4 Å²	161.4	70%	0.699	80%	0.797	S	S	*	*			cis	-173	137.5	-10.1	46.7	0	0	0	0	112
273	R	27.5	Very low	34.3	Very low	243 Å²	243	160.3 Å²	160.3	92%	0.917	80%	0.802	S	S	*	*				176.7	136.7	118.7	-104.1	179.2	170.5	170.5	-2.9	112
274	D	29	Very low	33.5	Very low	158 Å²	158	161.4 Å²	161.4	85%	0.845	81%	0.807	S	S	*	*			trans	-97.1	173.9	166.2	-80.1	-69.8	0	0	0	111.8
275	K	30.4	Very low	33	Very low	182 Å²	182	166 Å²	166	79%	0.791	83%	0.825	S	S	*	*			trans	90.7	133.4	-175.5	-57.3	-179.4	167.4	-151.8	0	114.2
276	E	30.8	Very low	33	Very low	125 Å²	125	167.7 Å²	167.7	58%	0.584	83%	0.829	S	S	*	*			cis	-160	164.2	-6.4	-104.5	165.2	-119.6	0	0	105.2
277	K	30.5	Very low	32.7	Very low	153 Å²	153	165.9 Å²	165.9	67%	0.665	83%	0.826	S	S	*	*			cis	-162	158.9	16.2	-132.6	155.1	-176.6	149.2	0	110.1
278	R	28	Very low	33	Very low	217 Å²	217	162.6 Å²	162.6	82%	0.819	83%	0.825	S	S	*	*			trans	17.8	132.5	156	-62.9	175	179.1	173.4	-2.2	121.5
279	N	28.2	Very low	32.9	Very low	156 Å²	156	163.7 Å²	163.7	83%	0.834	82%	0.821	S	S	*	*				-166.2	159.3	104.8	-102.7	-5.5	0	0	0	115.8
280	S	26.9	Very low	33.2	Very low	116 Å²	116	162.3 Å²	162.3	81%	0.811	81%	0.809	S	S	*	*			trans	-20.8	151.2	172.9	56.1	0	0	0	0	122.2
281	G	29.9	Very low	33.3	Very low	77 Å²	77	163.2 Å²	163.2	79%	0.794	82%	0.817	S	S	*	*			trans	146.2	122.7	144.9	0	0	0	0	0	115.6
282	E	31.7	Very low	34.3	Very low	207 Å²	207	159.7 Å²	159.7	97%	0.967	82%	0.815	S	S	*	*			trans	-82.6	142	169.6	-63.6	176.1	105.7	0	0	111
283	G	32	Very low	35.2	Very low	79 Å²	79	162.8 Å²	162.8	81%	0.814	82%	0.818	S	S	*	*			trans	-165.2	96.2	-175	0	0	0	0	0	114.3
284	K	32.8	Very low	35.9	Very low	203 Å²	203	159.9 Å²	159.9	88%	0.883	81%	0.812	S	S	*	*			trans	-60	133.5	179.3	-145.7	175.5	-168.5	172.2	0	112.3
285	L	35.6	Very low	36.5	Very low	169 Å²	169	160.4 Å²	160.4	89%	0.885	81%	0.809	S	S	*	*				175.1	166.4	129.9	-93.7	166	0	0	0	112.8
286	Q	43	Very low	37	Very low	178 Å²	178	159.1 Å²	159.1	83%	0.832	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-97.4	150.9	-169.8	-65.5	-179.8	-8.5	0	0	113.9
287	P	38	Very low	37.7	Very low	127 Å²	127	157.8 Å²	157.8	83%	0.825	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-76.5	137.3	172.3	31.4	-34.3	0	0	0	112.4	R289	P287-R289 PolarHBondContact O-N 3.12Å
288	I	47.3	Very low	38.2	Very low	175 Å²	175	156.9 Å²	156.9	90%	0.897	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-67.6	129.7	176.5	-65.1	175.9	0	0	0	110.5
289	R	41.1	Very low	38.9	Very low	213 Å²	213	155.5 Å²	155.5	80%	0.804	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-85.8	143	-178.9	-137.2	-179.1	176.1	161.4	-0.8	111.2	P287	P287-R289 PolarHBondContact O-N 3.12Å
290	N	40.9	Very low	39.5	Very low	110 Å²	110	156.7 Å²	156.7	59%	0.588	81%	0.811	S	S	*	*			trans	66.7	106.2	157	-54.2	-28.5	0	0	0	119.7
291	M	38.8	Very low	40.1	Very low	201 Å²	201	161.7 Å²	161.7	99%	0.99	81%	0.812	S	S	*	*			trans	-130.1	33.8	144.7	-89.8	-128.5	-73	0	0	112.8
292	L	47.9	Very low	40.6	Very low	165 Å²	165	165.8 Å²	165.8	86%	0.864	82%	0.815	S	S	*	*			trans	-114.5	44.7	177.7	-116.4	168.9	0	0	0	112.7
293	Q	49.1	Very low	41	Very low	165 Å²	165	167.3 Å²	167.3	77%	0.771	81%	0.812	S	S	*	*			trans	-140.3	62.8	176.3	-70.1	-166.7	-8.2	0	0	112.8
294	K	42.4	Very low	41.4	Very low	181 Å²	181	168.2 Å²	168.2	79%	0.787	81%	0.806	S	S	*	*	S	Bend	trans	-148.3	-2.5	170.5	-121.6	165.8	-171.6	173.6	0	119.3	T297	K294-T297 PolarHBondContact O-OG1 3.45Å
295	E	40.9	Very low	41.5	Very low	169 Å²	169	168.6 Å²	168.6	79%	0.79	81%	0.807	S	S	*	*	S	Bend	trans	-87.8	-26.6	178.8	-64.4	-155.4	114.7	0	0	114.9	T297	E295-T297 VanDerWaalsContact C-N 3.31Å; E295-T297 PolarHBondContact O-N 3.03Å
296	N	41	Very low	41.5	Very low	155 Å²	155	170 Å²	170	83%	0.829	81%	0.806	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.1	-4.4	-173.7	-76.6	-20.8	0	0	0	115.2
297	T	45.6	Very low	41	Very low	97 Å²	97	170 Å²	170	60%	0.595	81%	0.809	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.6	-27.4	-175.5	47.9	0	0	0	0	114.2	K294 E295	K294-T297 PolarHBondContact O-OG1 3.45Å; E295-T297 VanDerWaalsContact C-N 3.31Å; E295-T297 PolarHBondContact O-N 3.03Å
298	L	41.7	Very low	40.6	Very low	135 Å²	135	173.8 Å²	173.8	71%	0.707	81%	0.812	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.8	-38.4	-176	-89.1	158	0	0	0	113.6	K300 R301	L298-K300 PolarHBondContact O-N 3.29Å; L298-K300 VanDerWaalsContact O-N 3.17Å; L298-R301 PolarHBondContact O-N 2.91Å
299	K	41.2	Very low	39.7	Very low	187 Å²	187	175.2 Å²	175.2	81%	0.813	81%	0.812	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.6	-16.6	-179.4	-71.8	177.6	-179.4	168.3	0	114
300	K	42.3	Very low	39.1	Very low	182 Å²	182	174.4 Å²	174.4	79%	0.791	81%	0.814	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.3	-13.5	-177	-145.3	172	-174.3	178.7	0	114.5	L298	L298-K300 PolarHBondContact O-N 3.29Å; L298-K300 VanDerWaalsContact O-N 3.17Å
301	R	39.5	Very low	38.8	Very low	221 Å²	221	175 Å²	175	83%	0.834	82%	0.824	S	S	*	*	S	Bend	trans	-89.9	-10.6	-179.1	-81.4	-172.5	169.5	-172	-2.9	115.7	L298	L298-R301 PolarHBondContact O-N 2.91Å
302	L	40.7	Very low	38.3	Very low	163 Å²	163	171.1 Å²	171.1	85%	0.853	81%	0.811	S	S	*	*	S	Bend	trans	-93.8	3.6	-176.8	-76.2	169.9	0	0	0	115.4
303	R	39.1	Very low	37.2	Very low	239 Å²	239	172.3 Å²	172.3	90%	0.902	81%	0.809	S	S	*	*	S	Bend	trans	-114.9	2.1	-176.4	-72.9	-167.9	172.8	-145.1	-1.5	116.1
304	S	41.2	Very low	36.2	Very low	97 Å²	97	170.8 Å²	170.8	68%	0.678	81%	0.811	S	S	*	*	S	Bend	trans	-113	10.6	-171.8	53.1	0	0	0	0	116.3
305	K	35.3	Very low	35.5	Very low	212 Å²	212	171.7 Å²	171.7	92%	0.922	82%	0.815	S	S	*	*			trans	-120.6	65.6	173.1	-75	-165.9	173.3	-174.3	0	112.9
306	K	34.5	Very low	34.9	Very low	197 Å²	197	172.4 Å²	172.4	86%	0.857	82%	0.818	S	S	*	*			trans	-149.8	60.6	169.4	-159.3	-175.9	-178.1	-176.8	0	113.3
307	M	32.6	Very low	34.2	Very low	179 Å²	179	168.7 Å²	168.7	88%	0.882	82%	0.817	S	S	*	*			trans	-148.4	149.8	168.2	-89.9	-57.2	171.8	0	0	112.4
308	K	29.8	Very low	33.4	Very low	206 Å²	206	170.1 Å²	170.1	90%	0.896	83%	0.825	S	S	*	*			trans	66.6	127.8	173.5	-56.7	-172.8	-179.7	-174.2	0	117.8
309	K	29.2	Very low	32.8	Very low	205 Å²	205	173.2 Å²	173.2	89%	0.891	83%	0.833	S	S	*	*			trans	-160.9	152.2	169.9	-136	-174.3	-173.6	-172.9	0	110.4
310	K	27.4	Very low	32.2	Very low	197 Å²	197	170.9 Å²	170.9	86%	0.857	83%	0.83	S	S	*	*			trans	69.5	157.2	-175.5	-61.5	-172.2	173.9	-173.7	0	114.5
311	P	35.7	Very low	31.5	Very low	121 Å²	121	168.9 Å²	168.9	79%	0.786	83%	0.832	S	S	*	*			cis	-118.2	-161.8	1.9	43.5	-29.7	0	0	0	112.5
312	V	27.2	Very low	31	Very low	120 Å²	120	166.3 Å²	166.3	73%	0.727	83%	0.829	S	S	*	*			cis	-163.4	159.2	-47.6	146.9	0	0	0	0	108.5
313	K	25.9	Very low	30.3	Very low	190 Å²	190	167.4 Å²	167.4	83%	0.826	83%	0.83	S	S	*	*			trans	78.4	138.5	177.8	-74.3	164.1	177.9	-177.5	0	115.9
314	V	28.3	Very low	29.8	Very low	134 Å²	134	160.1 Å²	160.1	81%	0.812	82%	0.822	S	S	*	*			cis	107.5	111.4	17.3	169.6	0	0	0	0	113.7
315	K	26.4	Very low	29.6	Very low	199 Å²	199	161.7 Å²	161.7	87%	0.865	83%	0.829	S	S	*	*				-165.8	162.2	128.8	-116	-171.2	176.5	-168.8	0	111.7
316	E	27.6	Very low	29.2	Very low	184 Å²	184	160.4 Å²	160.4	86%	0.86	83%	0.827	S	S	*	*			trans	-90.1	165.8	179.2	-60.8	139.3	116.4	0	0	112.7
317	G	27.3	Very low	28.9	Very low	78 Å²	78	160.2 Å²	160.2	80%	0.804	83%	0.829	S	S	*	*			trans	-168.8	126.5	167.9	0	0	0	0	0	110.1
318	V	28.6	Very low	28.6	Very low	127 Å²	127	160.5 Å²	160.5	77%	0.77	83%	0.828	S	S	*	*			trans	-123.9	135.4	-174	175.4	0	0	0	0	109.1
319	K	28.5	Very low	28.5	Very low	200 Å²	200	158.9 Å²	158.9	87%	0.87	82%	0.824	S	S	*	*			trans	-177.1	167.4	133.1	-104	178.1	179.9	-166.2	0	113.8
320	D	28.4	Very low	28.4	Very low	138 Å²	138	158.4 Å²	158.4	74%	0.738	83%	0.825	S	S	*	*			trans	-102.2	-154.9	-160.3	-41.6	-95.8	0	0	0	112.5
321	V	28.9	Very low	28.3	Very low	140 Å²	140	152.4 Å²	152.4	85%	0.848	82%	0.818	S	S	*	*			trans	86.5	144.4	177.3	-172.4	0	0	0	0	115.2
322	E	28.1	Very low	27.8	Very low	166 Å²	166	156.3 Å²	156.3	78%	0.776	83%	0.826	S	S	*	*			cis	-175.2	171.6	-46.9	-158.3	157.7	-155.1	0	0	106.1
323	E	27.1	Very low	27.8	Very low	186 Å²	186	154.6 Å²	154.6	87%	0.869	82%	0.824	S	S	*	*			trans	65.1	163.8	165	-54.6	-157.6	120.2	0	0	119.7
324	A	28.1	Very low	28	Very low	87 Å²	87	153.3 Å²	153.3	72%	0.719	83%	0.827	S	S	*	*			trans	-131.9	169.2	171	0	0	0	0	0	107.9
325	P	36.1	Very low	28	Very low	129 Å²	129	155.4 Å²	155.4	84%	0.838	83%	0.828	S	S	*	*				-137.6	-173.6	126.3	37.1	-25	0	0	0	113.5
326	E	28.3	Very low	28.1	Very low	186 Å²	186	149.6 Å²	149.6	87%	0.869	82%	0.824	S	S	*	*			trans	-94.5	-149	-177.6	-57	179.8	126.3	0	0	111.2
327	E	27.4	Very low	28.2	Very low	193 Å²	193	148.6 Å²	148.6	90%	0.902	82%	0.819	S	S	*	*			trans	73.5	152.5	-179.2	-58	177.5	-158.9	0	0	117.2
328	E	27.3	Very low	28.3	Very low	185 Å²	185	152.2 Å²	152.2	86%	0.864	82%	0.815	S	S	*	*				-150.8	-136.8	-52.8	-138.4	178.8	-153.1	0	0	109.2
329	E	28	Very low	28.3	Very low	172 Å²	172	154.4 Å²	154.4	80%	0.804	82%	0.817	S	S	*	*			trans	-86.6	177.3	-164.5	-65.3	-154.9	116.6	0	0	117.3
330	E	26.8	Very low	28.1	Very low	195 Å²	195	148.9 Å²	148.9	91%	0.911	80%	0.804	S	S	*	*			trans	74.2	142.3	169.1	-52.9	-164.1	173.9	0	0	117.9
331	G	24.6	Very low	28.2	Very low	70 Å²	70	148.2 Å²	148.2	72%	0.722	81%	0.81	S	S	*	*			cis	143.9	123.6	-8.8	0	0	0	0	0	112.7
332	E	25.4	Very low	28.3	Very low	204 Å²	204	145 Å²	145	95%	0.953	81%	0.806	S	S	*	*			trans	-158	150.2	154.5	-132.9	177.5	-171.5	0	0	111
333	A	26.1	Very low	28.3	Very low	84 Å²	84	142.1 Å²	142.1	69%	0.694	80%	0.804	S	S	*	*			trans	-99.2	166	177	0	0	0	0	0	110.9
334	N	30	Very low	28.5	Very low	163 Å²	163	144.1 Å²	144.1	87%	0.872	80%	0.803	S	S	*	*			trans	-146.1	154.1	139.4	-141.7	-42.1	0	0	0	110.6
335	E	30	Very low	28.6	Very low	178 Å²	178	147.7 Å²	147.7	83%	0.832	81%	0.81	S	S	*	*			trans	-96.5	171.9	-162.1	-58.5	-174.3	128.8	0	0	112.9
336	G	27.1	Very low	28.5	Very low	77 Å²	77	150.9 Å²	150.9	79%	0.794	81%	0.811	S	S	*	*			trans	-178.4	78.8	-177.1	0	0	0	0	0	111.2
337	E	29.6	Very low	28.6	Very low	162 Å²	162	145.9 Å²	145.9	76%	0.757	80%	0.801	S	S	*	*			trans	-65.8	150.9	-174.7	-42	176.7	127.3	0	0	113.6
338	Q	29.7	Very low	28.9	Very low	155 Å²	155	142.4 Å²	142.4	72%	0.724	80%	0.798	S	S	*	*				173.1	135.5	92.1	-112.2	156.7	39.8	0	0	113
339	E	28.4	Very low	29.1	Very low	172 Å²	172	139.1 Å²	139.1	80%	0.804	80%	0.796	S	S	*	*			trans	43.9	152.7	138.6	-72.6	-149.9	-155.7	0	0	124.4
340	S	25.7	Very low	29.2	Very low	84 Å²	84	134.7 Å²	134.7	59%	0.587	79%	0.788	S	S	*	*			cis	-167.4	-178.9	-19.4	56.2	0	0	0	0	110.4
341	S	30.6	Very low	29.4	Very low	125 Å²	125	132.8 Å²	132.8	87%	0.874	78%	0.784	S	S	*	*			trans	67.9	147.5	-176.3	78.9	0	0	0	0	116
342	G	29.3	Very low	29.7	Very low	73 Å²	73	136.7 Å²	136.7	75%	0.753	79%	0.786	S	S	*	*			cis	135.4	132.3	0.5	0	0	0	0	0	110.6
343	S	29.8	Very low	30.5	Very low	105 Å²	105	132.6 Å²	132.6	73%	0.734	78%	0.777	S	S	*	*			cis	-164.1	154.2	-0.3	64.1	0	0	0	0	111.6
344	R	30	Very low	31.4	Very low	228 Å²	228	134 Å²	134	86%	0.86	78%	0.78	S	S	*	*			trans	57.2	138.3	150.9	-67.7	174.3	-175.7	171.2	3.3	117.6
345	D	31.5	Very low	31.4	Very low	161 Å²	161	136.6 Å²	136.6	86%	0.861	78%	0.783	S	S	*	*				-143.5	174.4	68.7	-102.1	-33.9	0	0	0	118
346	K	33.1	Very low	31.3	Very low	197 Å²	197	138 Å²	138	86%	0.857	79%	0.787	S	S	*	*			trans	-110.2	165.6	-178.4	-89.7	-177.1	178.7	-176.3	0	110
347	A	30.4	Very low	31.3	Very low	80 Å²	80	140.2 Å²	140.2	66%	0.661	79%	0.79	S	S	*	*			cis	-167.1	-175.9	-4.3	0	0	0	0	0	111.4
348	S	32.7	Very low	31.2	Very low	120 Å²	120	141.8 Å²	141.8	84%	0.839	79%	0.794	S	S	*	*			trans	84.6	147.7	164.5	80.6	0	0	0	0	117.2
349	S	32.3	Very low	31	Very low	117 Å²	117	142.7 Å²	142.7	82%	0.818	80%	0.803	S	S	*	*			cis	-144.9	178.2	6	-162.4	0	0	0	0	113.1
350	A	31.2	Very low	30.8	Very low	78 Å²	78	144 Å²	144	65%	0.645	81%	0.806	S	S	*	*			trans	-58.3	141.4	178.5	0	0	0	0	0	113.6
351	L	29.6	Very low	30.7	Very low	156 Å²	156	145.5 Å²	145.5	82%	0.817	82%	0.816	S	S	*	*				66.3	124.6	56.7	-62.8	171.6	0	0	0	113.1
352	I	32.3	Very low	30.4	Very low	152 Å²	152	149.2 Å²	149.2	78%	0.779	82%	0.817	S	S	*	*			cis	-155.3	-154.4	-18.3	-2.4	167	0	0	0	105.8
353	P	42.1	Very low	30.2	Very low	117 Å²	117	152.2 Å²	152.2	76%	0.76	82%	0.82	S	S	*	*			cis	-127.1	-174.7	-12.5	42.7	-25.7	0	0	0	114.5
354	P	45.1	Very low	29.9	Very low	115 Å²	115	155.6 Å²	155.6	75%	0.747	82%	0.822	S	S	*	*			trans	-117.1	177.2	-178	42.3	-33.7	0	0	0	115.7
355	K	28.3	Very low	29.6	Very low	216 Å²	216	150.4 Å²	150.4	94%	0.939	82%	0.816	S	S	*	*			trans	-154.3	147.9	151	-114.4	158.4	-168.1	172.8	0	114.4
356	K	29.1	Very low	29.3	Very low	209 Å²	209	149.7 Å²	149.7	91%	0.909	81%	0.805	S	S	*	*			trans	-108.9	150.1	174.7	-61	167.6	-178.3	165.9	0	109.4
357	S	26.9	Very low	29	Very low	123 Å²	123	146.6 Å²	146.6	86%	0.86	79%	0.793	S	S	*	*			trans	-151.2	160.7	146.3	64.2	0	0	0	0	111.1
358	K	26.5	Very low	28.7	Very low	195 Å²	195	149 Å²	149	85%	0.848	80%	0.795	S	S	*	*			trans	-118.5	155.4	175.4	-55	164.4	-179.4	168.2	0	107.3
359	L	25.6	Very low	28.4	Very low	174 Å²	174	150.3 Å²	150.3	91%	0.911	79%	0.79	S	S	*	*			trans	-161.1	178.1	133.9	-133.1	70.4	0	0	0	113.4
360	K	24.3	Very low	28.2	Very low	199 Å²	199	151.5 Å²	151.5	87%	0.865	79%	0.786	S	S	*	*			trans	-130.7	141.8	-178.9	-57.5	170.5	178.2	174.4	0	110.4
361	S	24.9	Very low	27.9	Very low	115 Å²	115	155.3 Å²	155.3	80%	0.804	80%	0.795	S	S	*	*			trans	-166.5	130.9	152.5	29.5	0	0	0	0	107
362	K	24	Very low	27.8	Very low	204 Å²	204	152 Å²	152	89%	0.887	79%	0.791	S	S	*	*				82.2	113.5	59.5	-81.6	-168	172.5	-176.4	0	113.9
363	T	24.7	Very low	28.5	Very low	135 Å²	135	151.2 Å²	151.2	83%	0.828	80%	0.795	S	S	*	*			trans	-33.1	154.7	160.5	-3.3	0	0	0	0	113.9
364	K	24.2	Very low	27.6	Very low	177 Å²	177	148.6 Å²	148.6	77%	0.77	79%	0.79	S	S	*	*				176	157	61	-150.8	-162.9	179.2	-174.2	0	111.9
365	V	23.8	Very low	26.6	Very low	119 Å²	119	148.6 Å²	148.6	72%	0.721	79%	0.793	S	S	*	*			trans	68.9	145.1	153.2	153.5	0	0	0	0	116.5
366	K	24.3	Very low	26.7	Very low	146 Å²	146	146.7 Å²	146.7	64%	0.635	79%	0.792	S	S	*	*			cis	-154.2	175.5	-4	-130.5	-174.9	-179.5	-132	0	110.8
367	E	26.1	Very low	26.5	Very low	131 Å²	131	144.9 Å²	144.9	61%	0.612	79%	0.787	S	S	*	*			trans	10.2	154	139	-71.5	160.5	-146	0	0	121.3
368	D	25.7	Very low	26.5	Very low	132 Å²	132	144.7 Å²	144.7	71%	0.706	79%	0.785	S	S	*	*			cis	-161	179.1	5.8	-133.2	-39.9	0	0	0	114.3
369	M	25.4	Very low	26.4	Very low	147 Å²	147	142 Å²	142	72%	0.724	78%	0.78	S	S	*	*			trans	62.8	119.4	155.7	-71.2	173.6	73.5	0	0	119.9
370	L	28.2	Very low	26.6	Very low	142 Å²	142	142.7 Å²	142.7	74%	0.743	78%	0.779	S	S	*	*				64.9	120.4	99.1	-61.5	177.7	0	0	0	113.9
371	D	24	Very low	26.7	Very low	157 Å²	157	139.2 Å²	139.2	84%	0.84	78%	0.775	S	S	*	*				-163.7	-176.6	72.3	-106.1	-34.8	0	0	0	115
372	A	28.4	Very low	27.4	Very low	87 Å²	87	139 Å²	139	72%	0.719	77%	0.77	S	S	*	*			trans	-136.1	-172.2	171	0	0	0	0	0	108.8
373	P	45.8	Very low	27.6	Very low	135 Å²	135	135.1 Å²	135.1	88%	0.877	76%	0.764	S	S	*	*			cis	-134.1	-163.4	-4	43.5	-25.1	0	0	0	113.5
374	G	23.4	Very low	27.7	Very low	63 Å²	63	138.4 Å²	138.4	65%	0.649	77%	0.766	S	S	*	*			trans	130.2	100.1	164.9	0	0	0	0	0	112.5
375	S	25.8	Very low	27.9	Very low	114 Å²	114	134.1 Å²	134.1	80%	0.797	76%	0.764	S	S	*	*				76.8	112.5	63.8	75.6	0	0	0	0	114.8
376	L	28.6	Very low	28.1	Very low	177 Å²	177	138.8 Å²	138.8	93%	0.927	78%	0.775	S	S	*	*			trans	-169.1	163.5	132	-104.4	165.4	0	0	0	110.3
377	E	25.7	Very low	28.2	Very low	170 Å²	170	135.6 Å²	135.6	79%	0.794	78%	0.783	S	S	*	*			trans	-112.6	158.7	-165.4	-54	179.6	133.5	0	0	113.4
378	S	26.6	Very low	28.4	Very low	119 Å²	119	136.9 Å²	136.9	83%	0.832	79%	0.789	S	S	*	*			trans	-153.5	146.3	141.7	54.1	0	0	0	0	110.8
379	N	25.5	Very low	28.4	Very low	138 Å²	138	142.5 Å²	142.5	74%	0.738	80%	0.8	S	S	*	*			trans	-94.3	160.4	-176.8	-67.8	-74.5	0	0	0	110.4
380	E	28.6	Very low	28.6	Very low	189 Å²	189	143.9 Å²	143.9	88%	0.883	80%	0.802	S	S	*	*				-159.5	166.9	82.9	-87.5	-163.1	158	0	0	114.7
381	T	26.8	Very low	28.7	Very low	127 Å²	127	147 Å²	147	78%	0.779	81%	0.81	S	S	*	*			trans	-148.9	161	177.2	72.1	0	0	0	0	107.5
382	P	40.2	Very low	29	Very low	109 Å²	109	149.4 Å²	149.4	71%	0.708	81%	0.813	S	S	*	*				-144.5	169	56.9	32.5	-7.7	0	0	0	115.2
383	T	27.4	Very low	29	Very low	123 Å²	123	154.9 Å²	154.9	76%	0.755	82%	0.821	S	S	*	*				-172.5	142.8	79.2	31.3	0	0	0	0	115
384	K	27.6	Very low	28.2	Very low	204 Å²	204	155 Å²	155	89%	0.887	82%	0.819	S	S	*	*			trans	15.1	140.1	143.7	-66.8	173.3	-174.6	173.6	0	119.5
385	A	29	Very low	28.4	Very low	88 Å²	88	157.8 Å²	157.8	73%	0.727	82%	0.823	S	S	*	*			cis	-168.5	166.2	3.2	0	0	0	0	0	115.2
386	K	26.4	Very low	28.5	Very low	217 Å²	217	162 Å²	162	94%	0.943	83%	0.827	S	S	*	*			trans	50.5	120.5	154.4	-73.9	-177.8	175.6	-178.9	0	121
387	G	26.3	Very low	28.5	Very low	78 Å²	78	159.2 Å²	159.2	80%	0.804	82%	0.817	S	S	*	*			trans	-173.3	123.7	161.1	0	0	0	0	0	113.8
388	E	30.4	Very low	28.7	Very low	159 Å²	159	160.7 Å²	160.7	74%	0.743	82%	0.821	S	S	*	*			trans	-56.6	147.8	-167.7	-55.1	-171.9	139.3	0	0	117.8	K390	E388-K390 WeakPolarHBondContact OE2-CE 3.28Å; E388-K390 IonicContact OE2-NZ 2.93Å; E388-K390 PolarHBondContact OE2-NZ 3.3Å
389	R	26.7	Very low	28.8	Very low	249 Å²	249	165.8 Å²	165.8	94%	0.94	82%	0.822	S	S	*	*			trans	-106.8	117.2	164.2	-83.8	179.4	164.1	175.3	-4.4	111.7
390	K	29.7	Very low	29.1	Very low	176 Å²	176	168.9 Å²	168.9	77%	0.765	83%	0.828	S	S	*	*			trans	-103.4	107.7	172	-77.2	172.4	178.9	145.4	0	112.1	E388	E388-K390 WeakPolarHBondContact OE2-CE 3.28Å; E388-K390 IonicContact OE2-NZ 2.93Å; E388-K390 PolarHBondContact OE2-NZ 3.3Å
391	K	29.1	Very low	29.2	Very low	209 Å²	209	166.9 Å²	166.9	91%	0.909	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-76.5	123.2	170.7	-67	-178.9	178.2	177.9	0	110
392	K	31.2	Very low	29.4	Very low	207 Å²	207	169.3 Å²	169.3	90%	0.9	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-92.3	130.5	166.4	-77.4	-175.6	174.8	178.6	0	110.3
393	K	28.4	Very low	29.1	Very low	201 Å²	201	171.2 Å²	171.2	87%	0.874	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-79.3	145.8	175.2	-72	-179	176.4	178.2	0	110.8
394	V	28.9	Very low	29.2	Very low	139 Å²	139	170.3 Å²	170.3	84%	0.842	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-80.1	132.9	170.1	176.7	0	0	0	0	109.6
395	V	27.6	Very low	29.5	Very low	121 Å²	121	167.1 Å²	167.1	73%	0.733	82%	0.815	S	S	*	*			trans	-115.4	113.4	174.5	-178.3	0	0	0	0	109.6	V397	V395-V397 HydrophobicContact CG1-CG2 4.08Å; V395-V397 PolarHBondContact O-N 3.41Å
396	K	27.9	Very low	29.7	Very low	202 Å²	202	171 Å²	171	88%	0.878	82%	0.818	S	S	*	*			trans	-84.9	92.7	178.3	-108.4	179	175.5	174.4	0	110.5	K398	K396-K398 PolarHBondContact O-N 3.48Å
397	V	29.5	Very low	29.8	Very low	119 Å²	119	164 Å²	164	72%	0.721	81%	0.807	S	S	*	*			trans	-84.1	110.5	173.8	-177.7	0	0	0	0	110.3	V395 R399	V395-V397 HydrophobicContact CG1-CG2 4.08Å; V395-V397 PolarHBondContact O-N 3.41Å; V397-R399 PolarHBondContact O-N 3.01Å
398	K	29.1	Very low	30.2	Very low	200 Å²	200	169.1 Å²	169.1	87%	0.87	81%	0.812	S	S	*	*			trans	-73.4	106.2	168.7	-72.5	-179.6	175.9	178.6	0	109.6	K396	K396-K398 PolarHBondContact O-N 3.48Å
399	R	29.2	Very low	30.2	Very low	227 Å²	227	166.7 Å²	166.7	86%	0.857	81%	0.81	S	S	*	*			trans	-78.2	122.7	163.5	-87.3	-174.4	168.9	171.8	-3.7	109.8	V397	V397-R399 PolarHBondContact O-N 3.01Å
400	K	31	Very low	30.9	Very low	202 Å²	202	162.3 Å²	162.3	88%	0.878	81%	0.811	S	S	*	*			trans	-84.8	116.7	167.4	-66.7	176.5	177.3	178.3	0	108
401	N	31.6	Very low	31	Very low	147 Å²	147	156.7 Å²	156.7	79%	0.786	80%	0.797	S	S	*	*			trans	-89.8	106.5	165.7	-77.8	16.9	0	0	0	108.6
402	K	30.1	Very low	31.2	Very low	178 Å²	178	158.2 Å²	158.2	77%	0.774	80%	0.799	S	S	*	*			trans	-85.2	112.9	168	-176.3	-175	178.7	-170.2	0	107.3	N404	K402-N404 WeakPolarHBondContact CE-OD1 3.38Å; K402-N404 PolarHBondContact O-N 3.35Å
403	I	34.5	Very low	31.7	Very low	150 Å²	150	153.7 Å²	153.7	77%	0.769	79%	0.793	S	S	*	*			trans	-80.5	109.9	172.2	-58.4	175.9	0	0	0	106.9
404	N	29.1	Very low	32	Very low	104 Å²	104	152.1 Å²	152.1	56%	0.556	79%	0.789	S	S	*	*			trans	-88.9	129.4	162	-79	14.4	0	0	0	107.7	K402	K402-N404 WeakPolarHBondContact CE-OD1 3.38Å; K402-N404 PolarHBondContact O-N 3.35Å
405	T	35.2	Very low	32.7	Very low	136 Å²	136	151.1 Å²	151.1	83%	0.834	79%	0.785	S	S	*	*			trans	-93.8	103.8	176.1	-55.5	0	0	0	0	109.2
406	E	32.8	Very low	33.7	Very low	170 Å²	170	150.9 Å²	150.9	79%	0.794	78%	0.784	S	S	*	*			trans	-127	151.6	169.9	-71	177.9	-163.9	0	0	109.6
407	G	28.7	Very low	34.7	Very low	69 Å²	69	146.3 Å²	146.3	71%	0.711	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-74.4	161.3	-156.7	0	0	0	0	0	116.1	P409	G407-P409 VanDerWaalsContact O-CD 3.25Å; G407-P409 WeakPolarHBondContact O-CD 3.48Å
408	M	33.3	Very low	36	Very low	186 Å²	186	141.4 Å²	141.4	92%	0.916	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-59.7	121.6	176.1	-75	-135.7	-63.4	0	0	112.5
409	P	31.6	Very low	37.3	Very low	109 Å²	109	133.1 Å²	133.1	71%	0.708	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-80.1	135	163.9	-7.4	26.7	0	0	0	110.1	G407 A411	G407-P409 VanDerWaalsContact O-CD 3.25Å; G407-P409 WeakPolarHBondContact O-CD 3.48Å; P409-A411 PolarHBondContact O-N 2.95Å
410	V	40.2	Very low	38.7	Very low	157 Å²	157	129.7 Å²	129.7	95%	0.952	70%	0.699	S	S	*	*			trans	-75.7	93.2	174.9	179.7	0	0	0	0	109.2
411	A	31.7	Very low	40	Very low	57 Å²	57	123.3 Å²	123.3	47%	0.471	68%	0.678	S	S	.	*			trans	-143.9	27.3	-168.8	0	0	0	0	0	116.4	P409 S413	P409-A411 PolarHBondContact O-N 2.95Å; A411-S413 PolarHBondContact O-N 2.6Å
412	Y	34	Very low	41.5	Very low	242 Å²	242	116.8 Å²	116.8	95%	0.949	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.8	65.5	171.8	-75.7	-73.1	0	0	0	112.3
413	S	41.1	Very low	43.2	Very low	112 Å²	112	110.5 Å²	110.5	78%	0.783	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-141.6	11.9	174.9	59.3	0	0	0	0	113.9	A411	A411-S413 PolarHBondContact O-N 2.6Å
414	Q	36	Very low	44.7	Very low	167 Å²	167	109.3 Å²	109.3	78%	0.78	61%	0.612	S	S	*	*	S	Bend	trans	-75.1	148.3	171.2	-68.6	-169.8	-9.1	0	0	111	V416	Q414-V416 PolarHBondContact O-N 3.08Å
415	P	42.6	Very low	46.2	Very low	119 Å²	119	107.7 Å²	107.7	77%	0.773	60%	0.598	S	S	*	*			trans	-66.9	126.8	176.4	28.3	-33.7	0	0	0	110.2	D417	P415-D417 PolarHBondContact O-N 2.92Å
416	V	48.3	Very low	47.9	Very low	116 Å²	116	106 Å²	106	70%	0.703	58%	0.577	S	S	*	*			trans	-70	100.9	164.4	-177.2	0	0	0	0	107.1	Q414 L418	Q414-V416 PolarHBondContact O-N 3.08Å; V416-L418 HydrophobicContact CG1-CD2 3.79Å; V416-L418 PolarHBondContact O-N 3.12Å
417	D	48.5	Very low	50	Low	106 Å²	106	104.7 Å²	104.7	57%	0.567	57%	0.568	S	S	*	*			trans	-73.2	111	172.1	-172	-0.1	0	0	0	109.3	P415 S419	P415-D417 PolarHBondContact O-N 2.92Å; D417-S419 PolarHBondContact O-N 3.46Å; D417-S419 VanDerWaalsContact OD1-CB 3.25Å; D417-S419 WeakPolarHBondContact OD1-CB 3.47Å; D417-S419 PolarHBondContact OD1-N 2.89Å
418	L	58.3	Low	52	Low	16 Å²	16	103.8 Å²	103.8	8%	0.084	55%	0.554	C	S	.	*	T	Hydrogen-bonded Turn	trans	-79.1	-0.9	-179.5	-57.4	172.8	0	0	0	112.4	V180 S185 L186 V416 E420 T421 F422	V180-L418 HydrophobicContact CG1-CD1 3.78Å; S185-L418 WeakPolarHBondContact O-CD1 2.98Å; L186-L418 HydrophobicContact CD2-CD2 3.75Å; V416-L418 HydrophobicContact CG1-CD2 3.79Å; V416-L418 PolarHBondContact O-N 3.12Å; L418-E420 PolarHBondContact O-N 2.86Å; L418-T421 WeakPolarHBondContact O-CB 3.11Å; L418-T421 PolarHBondContact O-N 3.29Å; L418-F422 WeakPolarHBondContact O-CD2 3.48Å; L418-F422 PolarHBondContact O-N 3.07Å
419	S	56.2	Low	53.8	Low	25 Å²	25	97 Å²	97	18%	0.175	52%	0.521	C	S	.	.	H	α-helix	trans	-48.9	-43.8	173.9	-168.2	0	0	0	0	111.4	D417 T421 F422 D423 R426	D417-S419 PolarHBondContact O-N 3.46Å; D417-S419 VanDerWaalsContact OD1-CB 3.25Å; D417-S419 WeakPolarHBondContact OD1-CB 3.47Å; D417-S419 PolarHBondContact OD1-N 2.89Å; S419-T421 PolarHBondContact O-N 3.06Å; S419-F422 CarbonylContact O-C 3.54Å; S419-F422 WeakPolarHBondContact O-CA 3.35Å; S419-F422 PolarHBondContact O-N 3.15Å; S419-D423 VanDerWaalsContact C-OD2 3.23Å; S419-D423 WeakPolarHBondContact O-CB 3.34Å; S419-D423 PolarHBondContact O-N 2.73Å; S419-D423 PolarHBondContact OG-OD2 3.07Å; S419-R426 PolarHBondContact OG-NH2 3.24Å
420	E	59.2	Low	55.7	Low	155 Å²	155	97.6 Å²	97.6	72%	0.724	52%	0.515	S	S	*	.	H	α-helix	trans	-54.1	-34.9	-179.5	-64.1	-163.5	150.2	0	0	113.7	L418 L424	L418-E420 PolarHBondContact O-N 2.86Å; E420-L424 PolarHBondContact O-N 2.94Å
421	T	57.8	Low	57.5	Low	69 Å²	69	92 Å²	92	42%	0.423	49%	0.485	S	S	.	.	H	α-helix	trans	-73	-39	178	-59.3	0	0	0	0	111.3	L418 S419	L418-T421 WeakPolarHBondContact O-CB 3.11Å; L418-T421 PolarHBondContact O-N 3.29Å; S419-T421 PolarHBondContact O-N 3.06Å
422	F	63.3	Low	59.4	Low	9 Å²	9	94.1 Å²	94.1	4%	0.039	49%	0.488	C	S	.	.	H	α-helix	trans	-78.7	-23.9	175.8	-67.5	-74.5	0	0	0	112.9	I171 L176 E177 V180 C187 L418 S419 Y425 R426	I171-F422 HydrophobicContact CD1-CD1 4.34Å; I171-F422 HydrophobicContact CG1-CE1 4.42Å; I171-F422 HydrophobicContact CG2-CD1 4.1Å; I171-F422 HydrophobicContact CG2-CE1 4.31Å; L176-F422 HydrophobicContact CB-CE1 4.32Å; E177-F422 HydrophobicContact CB-CD1 4.1Å; E177-F422 HydrophobicContact CB-CD2 3.97Å; E177-F422 HydrophobicContact CB-CE1 4.25Å; E177-F422 HydrophobicContact CB-CE2 4.13Å; E177-F422 HydrophobicContact CB-CG 3.96Å; E177-F422 HydrophobicContact CB-CZ 4.27Å; E177-F422 HydrophobicContact CG-CB 4.36Å; E177-F422 HydrophobicContact CG-CD2 3.86Å; E177-F422 HydrophobicContact CG-CE2 4.35Å; E177-F422 HydrophobicContact CG-CG 4.05Å; V180-F422 HydrophobicContact CB-CE2 4.43Å; V180-F422 HydrophobicContact CB-CZ 4.32Å; V180-F422 HydrophobicContact CG1-CE2 4.06Å; V180-F422 HydrophobicContact CG1-CZ 4.17Å; V180-F422 HydrophobicContact CG2-CZ 4.42Å; C187-F422 HydrophobicContact CB-CZ 4.46Å; L418-F422 WeakPolarHBondContact O-CD2 3.48Å; L418-F422 PolarHBondContact O-N 3.07Å; S419-F422 CarbonylContact O-C 3.54Å; S419-F422 WeakPolarHBondContact O-CA 3.35Å; S419-F422 PolarHBondContact O-N 3.15Å; F422-Y425 CarbonylContact O-C 3.43Å; F422-Y425 WeakPolarHBondContact O-CA 3.38Å; F422-Y425 WeakPolarHBondContact O-CB 3.08Å; F422-Y425 PolarHBondContact O-N 3.17Å; F422-Y425 VanDerWaalsContact O-N 3.16Å; F422-R426 PolarHBondContact O-N 3.26Å
423	D	65.8	Low	61.3	Low	47 Å²	47	88.5 Å²	88.5	25%	0.251	47%	0.468	S	S	.	.	H	α-helix	trans	-73.6	-32.3	177.3	-73.5	-41.3	0	0	0	112.5	S419 Y425 R426 K427	S419-D423 VanDerWaalsContact C-OD2 3.23Å; S419-D423 WeakPolarHBondContact O-CB 3.34Å; S419-D423 PolarHBondContact O-N 2.73Å; S419-D423 PolarHBondContact OG-OD2 3.07Å; D423-Y425 VanDerWaalsContact C-N 3.3Å; D423-R426 PolarHBondContact O-N 2.66Å; D423-R426 IonicContact OD1-CZ 3.57Å; D423-R426 IonicContact OD1-NE 2.67Å; D423-R426 PolarHBondContact OD1-NE 2.55Å; D423-R426 IonicContact OD1-NH2 3.74Å; D423-R426 PolarHBondContact OD1-NH2 3.11Å; D423-R426 IonicContact OD2-NH2 3.91Å; D423-K427 WeakPolarHBondContact O-CB 3.24Å; D423-K427 WeakPolarHBondContact O-CD 3.21Å; D423-K427 VanDerWaalsContact O-CG 3.26Å; D423-K427 WeakPolarHBondContact O-CG 3.29Å; D423-K427 PolarHBondContact O-N 3.15Å
424	L	64.9	Low	63.1	Low	125 Å²	125	87.7 Å²	87.7	65%	0.654	45%	0.452	S	S	*	.	H	α-helix	trans	-62.9	-38.9	166.3	-73.6	171.6	0	0	0	111.2	E420 A428	E420-L424 PolarHBondContact O-N 2.94Å; L424-A428 WeakPolarHBondContact O-CB 3.46Å; L424-A428 PolarHBondContact O-N 3.16Å
425	Y	61.6	Low	65	Low	70 Å²	70	88.1 Å²	88.1	28%	0.275	45%	0.447	S	S	.	.	H	α-helix	trans	-66.9	-45.8	172.3	-92.3	-89.6	0	0	0	112.3	I171 I189 F422 D423 K427 A428 I429	I171-Y425 HydrophobicContact CD1-CD1 3.5Å; I171-Y425 HydrophobicContact CD1-CD2 4.35Å; I171-Y425 HydrophobicContact CD1-CE1 4.09Å; I171-Y425 HydrophobicContact CD1-CG 3.65Å; I189-Y425 PolarHBondContact O-OH 3.11Å; F422-Y425 CarbonylContact O-C 3.43Å; F422-Y425 WeakPolarHBondContact O-CA 3.38Å; F422-Y425 WeakPolarHBondContact O-CB 3.08Å; F422-Y425 PolarHBondContact O-N 3.17Å; F422-Y425 VanDerWaalsContact O-N 3.16Å; D423-Y425 VanDerWaalsContact C-N 3.3Å; Y425-K427 PolarHBondContact O-N 3.15Å; Y425-A428 PolarHBondContact O-N 3.25Å; Y425-I429 WeakPolarHBondContact O-CD1 3.3Å; Y425-I429 WeakPolarHBondContact O-CG1 3.41Å; Y425-I429 PolarHBondContact O-N 3.47Å
426	R	71.1	Confident	66.5	Low	100 Å²	100	88.5 Å²	88.5	38%	0.377	44%	0.438	S	S	.	.	H	α-helix	trans	-55.5	-48.2	175	-80.2	-170.8	-91.7	-95.4	1.4	111.7	E177 S419 F422 D423 A428 I429 Q430	E177-R426 IonicContact OE1-CZ 2.9Å; E177-R426 VanDerWaalsContact OE1-CZ 3.26Å; E177-R426 IonicContact OE1-NH1 2.76Å; E177-R426 PolarHBondContact OE1-NH1 3.05Å; E177-R426 IonicContact OE1-NH2 3.3Å; E177-R426 PolarHBondContact OE1-NH2 3.35Å; E177-R426 IonicContact OE2-CZ 3.26Å; E177-R426 IonicContact OE2-NH1 2.73Å; E177-R426 PolarHBondContact OE2-NH1 3.07Å; S419-R426 PolarHBondContact OG-NH2 3.24Å; F422-R426 PolarHBondContact O-N 3.26Å; D423-R426 PolarHBondContact O-N 2.66Å; D423-R426 IonicContact OD1-CZ 3.57Å; D423-R426 IonicContact OD1-NE 2.67Å; D423-R426 PolarHBondContact OD1-NE 2.55Å; D423-R426 IonicContact OD1-NH2 3.74Å; D423-R426 PolarHBondContact OD1-NH2 3.11Å; D423-R426 IonicContact OD2-NH2 3.91Å; R426-A428 VanDerWaalsContact C-N 3.34Å; R426-A428 PolarHBondContact O-N 2.92Å; R426-I429 PolarHBondContact O-N 2.83Å; R426-Q430 WeakPolarHBondContact O-CB 3.48Å; R426-Q430 PolarHBondContact O-N 3.45Å
427	K	76.1	Confident	67.7	Low	142 Å²	142	87.1 Å²	87.1	62%	0.617	43%	0.427	S	S	*	.	H	α-helix	trans	-62.3	-39.3	177.5	-71.7	164.6	-175.5	166.5	0	112.2	D423 Y425 A431	D423-K427 WeakPolarHBondContact O-CB 3.24Å; D423-K427 WeakPolarHBondContact O-CD 3.21Å; D423-K427 VanDerWaalsContact O-CG 3.26Å; D423-K427 WeakPolarHBondContact O-CG 3.29Å; D423-K427 PolarHBondContact O-N 3.15Å; Y425-K427 PolarHBondContact O-N 3.15Å; K427-A431 WeakPolarHBondContact O-CB 3.4Å; K427-A431 PolarHBondContact O-N 3.08Å
428	A	70	Confident	68.8	Low	50 Å²	50	88.4 Å²	88.4	41%	0.413	43%	0.429	S	S	.	.	H	α-helix	trans	-68.1	-38.6	174.9	0	0	0	0	0	113	L424 Y425 R426 L432	L424-A428 WeakPolarHBondContact O-CB 3.46Å; L424-A428 PolarHBondContact O-N 3.16Å; Y425-A428 PolarHBondContact O-N 3.25Å; R426-A428 VanDerWaalsContact C-N 3.34Å; R426-A428 PolarHBondContact O-N 2.92Å; A428-L432 WeakPolarHBondContact O-CB 3.49Å; A428-L432 VanDerWaalsContact O-CG 3.26Å; A428-L432 WeakPolarHBondContact O-CG 3.39Å; A428-L432 PolarHBondContact O-N 3.39Å
429	I	71	Confident	69	Low	45 Å²	45	91 Å²	91	23%	0.231	45%	0.453	C	S	.	.	H	α-helix	trans	-63	-48	175	-70.2	162.8	0	0	0	110.4	S168 Y425 R426 L432 K433	S168-I429 VanDerWaalsContact CB-CD1 3.45Å; S168-I429 VanDerWaalsContact CB-CG1 3.4Å; Y425-I429 WeakPolarHBondContact O-CD1 3.3Å; Y425-I429 WeakPolarHBondContact O-CG1 3.41Å; Y425-I429 PolarHBondContact O-N 3.47Å; R426-I429 PolarHBondContact O-N 2.83Å; I429-L432 PolarHBondContact O-N 3.26Å; I429-K433 PolarHBondContact O-N 3.07Å
430	Q	72.5	Confident	69.2	Low	121 Å²	121	97.5 Å²	97.5	57%	0.565	48%	0.481	S	S	*	.	H	α-helix	trans	-62.6	-46.6	-179.1	-169.9	162.9	-10.4	0	0	111.2	R426 L432 K433 E434	R426-Q430 WeakPolarHBondContact O-CB 3.48Å; R426-Q430 PolarHBondContact O-N 3.45Å; Q430-L432 VanDerWaalsContact C-N 3.29Å; Q430-L432 PolarHBondContact O-N 2.56Å; Q430-K433 PolarHBondContact O-N 3.23Å; Q430-E434 WeakPolarHBondContact CG-OE1 3.41Å; Q430-E434 WeakPolarHBondContact O-CB 3.2Å; Q430-E434 VanDerWaalsContact O-CG 3.28Å; Q430-E434 WeakPolarHBondContact O-CG 3.1Å; Q430-E434 PolarHBondContact O-N 3.05Å
431	A	77.7	Confident	68.9	Low	40 Å²	40	93.3 Å²	93.3	33%	0.331	48%	0.479	S	S	.	.	H	α-helix	trans	-66.9	-22.8	175	0	0	0	0	0	114.4	K427 R435	K427-A431 WeakPolarHBondContact O-CB 3.4Å; K427-A431 PolarHBondContact O-N 3.08Å; A431-R435 WeakPolarHBondContact O-CD 3.44Å; A431-R435 VanDerWaalsContact O-CG 3.28Å; A431-R435 WeakPolarHBondContact O-CG 3.31Å
432	L	72.2	Confident	68.2	Low	101 Å²	101	101.1 Å²	101.1	53%	0.529	51%	0.511	S	S	.	.	H	α-helix	trans	-78.3	-40	170.9	-78.5	170	0	0	0	111.5	A428 I429 Q430 R435 Q436	A428-L432 WeakPolarHBondContact O-CB 3.49Å; A428-L432 VanDerWaalsContact O-CG 3.26Å; A428-L432 WeakPolarHBondContact O-CG 3.39Å; A428-L432 PolarHBondContact O-N 3.39Å; I429-L432 PolarHBondContact O-N 3.26Å; Q430-L432 VanDerWaalsContact C-N 3.29Å; Q430-L432 PolarHBondContact O-N 2.56Å; L432-R435 PolarHBondContact O-N 3.42Å; L432-Q436 PolarHBondContact O-N 3.07Å; L432-Q436 VanDerWaalsContact O-N 3.14Å
433	K	74.2	Confident	68.5	Low	124 Å²	124	105.8 Å²	105.8	54%	0.539	53%	0.534	S	S	.	.	H	α-helix	trans	-66.9	-46.8	177.6	-170.2	179	176.3	-177.5	0	111.5	I429 Q430 R435 Q436 D437	I429-K433 PolarHBondContact O-N 3.07Å; Q430-K433 PolarHBondContact O-N 3.23Å; K433-R435 PolarHBondContact O-N 2.92Å; K433-R435 VanDerWaalsContact O-N 3.12Å; K433-Q436 WeakPolarHBondContact O-CA 3.09Å; K433-Q436 PolarHBondContact O-N 3.12Å; K433-D437 VanDerWaalsContact O-CG 3.3Å; K433-D437 PolarHBondContact O-N 3.31Å
434	E	78.4	Confident	68.6	Low	94 Å²	94	108.8 Å²	108.8	44%	0.439	55%	0.549	S	S	.	.	H	α-helix	trans	-52.1	-36	173.6	-73.5	164.4	-174.6	0	0	112.4	Q430 Q438	Q430-E434 WeakPolarHBondContact CG-OE1 3.41Å; Q430-E434 WeakPolarHBondContact O-CB 3.2Å; Q430-E434 VanDerWaalsContact O-CG 3.28Å; Q430-E434 WeakPolarHBondContact O-CG 3.1Å; Q430-E434 PolarHBondContact O-N 3.05Å; E434-Q438 VanDerWaalsContact O-CB 3.29Å; E434-Q438 WeakPolarHBondContact O-CB 3.48Å; E434-Q438 WeakPolarHBondContact O-CG 3.17Å; E434-Q438 PolarHBondContact O-N 3.42Å
435	R	76.5	Confident	68.8	Low	177 Å²	177	107.9 Å²	107.9	67%	0.668	54%	0.544	S	S	*	.	H	α-helix	trans	-75.5	-30.3	175.3	-72.2	172.7	-179	-159.2	-1.1	114.1	A431 L432 K433 A439	A431-R435 WeakPolarHBondContact O-CD 3.44Å; A431-R435 VanDerWaalsContact O-CG 3.28Å; A431-R435 WeakPolarHBondContact O-CG 3.31Å; L432-R435 PolarHBondContact O-N 3.42Å; K433-R435 PolarHBondContact O-N 2.92Å; K433-R435 VanDerWaalsContact O-N 3.12Å; R435-A439 VanDerWaalsContact O-CB 3.28Å; R435-A439 WeakPolarHBondContact O-CB 3.44Å; R435-A439 PolarHBondContact O-N 2.81Å
436	Q	73.4	Confident	69.3	Low	127 Å²	127	110.2 Å²	110.2	59%	0.593	56%	0.559	S	S	*	*	H	α-helix	trans	-74.1	-43.3	173.5	-72	-174.8	-44.9	0	0	110.8	L432 K433 Q438 A439 Q440	L432-Q436 PolarHBondContact O-N 3.07Å; L432-Q436 VanDerWaalsContact O-N 3.14Å; K433-Q436 WeakPolarHBondContact O-CA 3.09Å; K433-Q436 PolarHBondContact O-N 3.12Å; Q436-Q438 VanDerWaalsContact C-N 3.34Å; Q436-Q438 PolarHBondContact O-N 3.36Å; Q436-A439 CarbonylContact O-C 3.58Å; Q436-A439 PolarHBondContact O-N 3.31Å; Q436-Q440 WeakPolarHBondContact O-CG 3.4Å; Q436-Q440 PolarHBondContact O-N 3.44Å
437	D	72.5	Confident	69.2	Low	87 Å²	87	110.8 Å²	110.8	47%	0.465	57%	0.571	S	S	.	*	H	α-helix	trans	-62.1	-42	176.1	-60.3	-18.6	0	0	0	110.4	K433 A439 Q440 G441	K433-D437 VanDerWaalsContact O-CG 3.3Å; K433-D437 PolarHBondContact O-N 3.31Å; D437-A439 VanDerWaalsContact C-N 3.3Å; D437-A439 PolarHBondContact O-N 3.48Å; D437-Q440 PolarHBondContact O-N 3.46Å; D437-G441 PolarHBondContact O-N 3.17Å
438	Q	71.1	Confident	68.7	Low	132 Å²	132	108.7 Å²	108.7	62%	0.617	57%	0.568	S	S	*	*	H	α-helix	trans	-63.9	-29.1	171.8	-77	168	15.1	0	0	114.1	E434 Q436	E434-Q438 VanDerWaalsContact O-CB 3.29Å; E434-Q438 WeakPolarHBondContact O-CB 3.48Å; E434-Q438 WeakPolarHBondContact O-CG 3.17Å; E434-Q438 PolarHBondContact O-N 3.42Å; Q436-Q438 VanDerWaalsContact C-N 3.34Å; Q436-Q438 PolarHBondContact O-N 3.36Å
439	A	64.1	Low	68.6	Low	71 Å²	71	112.9 Å²	112.9	59%	0.587	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.9	-1	178.9	0	0	0	0	0	113.9	R435 Q436 D437	R435-A439 VanDerWaalsContact O-CB 3.28Å; R435-A439 WeakPolarHBondContact O-CB 3.44Å; R435-A439 PolarHBondContact O-N 2.81Å; Q436-A439 CarbonylContact O-C 3.58Å; Q436-A439 PolarHBondContact O-N 3.31Å; D437-A439 VanDerWaalsContact C-N 3.3Å; D437-A439 PolarHBondContact O-N 3.48Å
440	Q	58.8	Low	68.4	Low	162 Å²	162	118.2 Å²	118.2	76%	0.757	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.8	-4.5	171	-68.6	-176.4	-3	0	0	112.5	Q436 D437	Q436-Q440 WeakPolarHBondContact O-CG 3.4Å; Q436-Q440 PolarHBondContact O-N 3.44Å; D437-Q440 PolarHBondContact O-N 3.46Å
441	G	54.3	Low	68.1	Low	67 Å²	67	117.9 Å²	117.9	69%	0.691	61%	0.609	S	S	*	*			trans	-100	19	172.7	0	0	0	0	0	114.3	D437	D437-G441 PolarHBondContact O-N 3.17Å
442	Q	43.7	Very low	67.2	Low	233 Å²	233	125 Å²	125	100%	1.089	63%	0.634	S	S	*	*			trans	-131.4	0	174.9	-67.2	-171.7	-4.2	0	0	109.6

Retrieved 442 of 442 residues in 215.2 ms (Link to these results)

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