A0A077Z3A2_TRITR Loading...

glutamate dehydrogenase [NAD(P)(+)]

AlphaFold DB , UniProt , Accession A0A077Z3A2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 473 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	35.8	Very low	34.8	Very low	256 Å²	256	169 Å²	169	100%	1.261	87%	0.868	S	S	*	*				0	124.4	0	-53.7	170.4	-176.4	0	0	107
2	G	37	Very low	34.9	Very low	71 Å²	71	170.3 Å²	170.3	73%	0.732	86%	0.863	S	S	*	*			cis	-170.6	162.4	-10.6	0	0	0	0	0	110.1
3	R	36.1	Very low	34.8	Very low	252 Å²	252	176 Å²	176	95%	0.951	87%	0.867	S	S	*	*			trans	74.1	105.7	177.7	-54.4	-173.2	-173.7	-151.8	0.4	117.6
4	L	32.3	Very low	34.5	Very low	164 Å²	164	170.6 Å²	170.6	86%	0.859	87%	0.865	S	S	*	*			trans	-69.5	154.4	152.1	-64.4	87.2	0	0	0	110
5	F	37.5	Very low	34.3	Very low	199 Å²	199	173.7 Å²	173.7	87%	0.873	86%	0.864	S	S	*	*			trans	-157.8	125.7	132.9	-111.5	-75.3	0	0	0	109.8
6	S	33.8	Very low	34	Very low	110 Å²	110	177.6 Å²	177.6	77%	0.769	87%	0.866	S	S	*	*			trans	-117.9	141	162.8	78	0	0	0	0	108.3
7	L	36.6	Very low	34	Very low	162 Å²	162	173.5 Å²	173.5	85%	0.848	86%	0.856	S	S	*	*			trans	-134.3	111	175.1	-99.2	163.9	0	0	0	109.8
8	R	32.3	Very low	34	Very low	221 Å²	221	170.7 Å²	170.7	83%	0.834	85%	0.85	S	S	*	*			trans	-85.2	152.6	166.9	-80.6	174.7	160.4	173.2	-6.7	109.8
9	N	30.8	Very low	33.8	Very low	151 Å²	151	173.9 Å²	173.9	81%	0.807	85%	0.851	S	S	*	*			trans	73.2	98.6	153	-60.2	-18	0	0	0	120.2
10	C	35.1	Very low	33.5	Very low	122 Å²	122	170.3 Å²	170.3	82%	0.824	85%	0.85	S	S	*	*			trans	-158.7	145.1	147.2	-92.3	0	0	0	0	107.8
11	L	35.9	Very low	33.5	Very low	151 Å²	151	171 Å²	171	79%	0.791	85%	0.851	S	S	*	*			cis	-143.6	114.2	-9	-101.6	160.2	0	0	0	111.5
12	K	35.7	Very low	33.2	Very low	185 Å²	185	164.6 Å²	164.6	80%	0.804	83%	0.832	S	S	*	*			trans	13.7	134.4	143.9	-73.6	175.2	176.8	173.1	0	121.7
13	R	33	Very low	33	Very low	244 Å²	244	167.7 Å²	167.7	92%	0.921	84%	0.837	S	S	*	*			trans	80.5	101.1	141.9	-71	175.9	172.8	-173.4	-3.1	120.6
14	A	31.6	Very low	32.6	Very low	101 Å²	101	163.9 Å²	163.9	84%	0.835	83%	0.834	S	S	*	*				-154.6	113.4	117.9	0	0	0	0	0	109.4
15	Y	31.6	Very low	32.7	Very low	217 Å²	217	160.5 Å²	160.5	85%	0.851	83%	0.83	S	S	*	*			trans	-131.6	129.8	176.5	-116.3	-89.3	0	0	0	108
16	W	28.9	Very low	32.3	Very low	235 Å²	235	162.7 Å²	162.7	89%	0.89	83%	0.832	S	S	*	*			trans	-132.1	104.8	168.9	-102.3	70.7	0	0	0	108.7	V18	W16-V18 HydrophobicContact CE3-CG2 3.85Å; W16-V18 HydrophobicContact CZ3-CG2 3.95Å
17	P	33.6	Very low	32.4	Very low	108 Å²	108	164.3 Å²	164.3	70%	0.701	83%	0.831	S	S	*	*			trans	-115.3	102	167.5	33.3	-19.8	0	0	0	110.1	R19	P17-R19 PolarHBondContact O-N 3.38Å
18	V	33.5	Very low	32	Very low	124 Å²	124	168 Å²	168	75%	0.752	83%	0.834	S	S	*	*			trans	-83.7	106.6	169.3	180	0	0	0	0	108.5	W16	W16-V18 HydrophobicContact CE3-CG2 3.85Å; W16-V18 HydrophobicContact CZ3-CG2 3.95Å
19	R	30.3	Very low	32	Very low	231 Å²	231	165.7 Å²	165.7	87%	0.872	83%	0.834	S	S	*	*			trans	-82.8	130.2	175.9	-136.5	178.2	-171.8	174.6	0.6	108.7	P17 Q21	P17-R19 PolarHBondContact O-N 3.38Å; R19-Q21 PolarHBondContact O-N 3.34Å
20	A	28.8	Very low	32	Very low	101 Å²	101	165.7 Å²	165.7	84%	0.835	83%	0.834	S	S	*	*			trans	-71	126.1	171.3	0	0	0	0	0	110.3
21	Q	33.2	Very low	31.7	Very low	185 Å²	185	166.4 Å²	166.4	86%	0.864	84%	0.835	S	S	*	*			trans	-138.8	126.3	159.9	-92.5	-175.1	-31.5	0	0	109.3	R19	R19-Q21 PolarHBondContact O-N 3.34Å
22	S	29	Very low	31.4	Very low	122 Å²	122	168.1 Å²	168.1	85%	0.853	84%	0.839	S	S	*	*			trans	-86.8	124.5	178.5	52.3	0	0	0	0	111.2
23	T	33.3	Very low	31.1	Very low	137 Å²	137	164.6 Å²	164.6	84%	0.84	84%	0.837	S	S	*	*			trans	-143	124	158.6	-41.4	0	0	0	0	110.1	A25	T23-A25 PolarHBondContact O-N 3.07Å
24	L	28.7	Very low	30.9	Very low	172 Å²	172	158.2 Å²	158.2	90%	0.901	83%	0.828	S	S	*	*			trans	-70.5	122.4	175.4	-78.5	131.9	0	0	0	110.6
25	A	34.4	Very low	30.7	Very low	92 Å²	92	158.5 Å²	158.5	76%	0.76	82%	0.823	S	S	*	*			trans	-130.4	114.9	160.9	0	0	0	0	0	108.6	T23 I27	T23-A25 PolarHBondContact O-N 3.07Å; A25-I27 PolarHBondContact O-N 3.09Å
26	R	28.5	Very low	30.6	Very low	245 Å²	245	154.3 Å²	154.3	93%	0.925	82%	0.821	S	S	*	*			trans	-76.5	116.8	178.2	-70.3	175.4	175.1	170.1	-2.8	109.5
27	I	34.9	Very low	30.7	Very low	144 Å²	144	151.4 Å²	151.4	74%	0.738	82%	0.819	S	S	*	*			trans	-114	116.1	158.9	-65.7	172.5	0	0	0	106.5	A25 M29	A25-I27 PolarHBondContact O-N 3.09Å; I27-M29 HydrophobicContact CG2-CG 4.04Å
28	R	28.7	Very low	30.9	Very low	241 Å²	241	150.9 Å²	150.9	91%	0.909	82%	0.818	S	S	*	*			trans	-80.1	123.7	160.3	-79.6	-179	171.3	172.6	-4.8	106.6
29	M	33.2	Very low	31.3	Very low	172 Å²	172	149.7 Å²	149.7	85%	0.847	81%	0.813	S	S	*	*			trans	-131.8	140.9	158.9	-88	-172.7	160.9	0	0	107.7	I27	I27-M29 HydrophobicContact CG2-CG 4.04Å
30	D	30.2	Very low	32.5	Very low	151 Å²	151	144.8 Å²	144.8	81%	0.807	81%	0.811	S	S	*	*			trans	-79.7	162.8	-165.3	-62.2	-64.1	0	0	0	113.1	E32	D30-E32 PolarHBondContact O-N 3.12Å
31	T	27.8	Very low	34.4	Very low	137 Å²	137	145.6 Å²	145.6	84%	0.84	80%	0.797	S	S	*	*			trans	-27.1	111.7	174.6	50.7	0	0	0	0	117.3
32	E	30.5	Very low	36.6	Very low	187 Å²	187	139.7 Å²	139.7	87%	0.874	77%	0.771	S	S	*	*			trans	-157.2	138.1	130.5	-113	171.6	-151.7	0	0	108.7	D30 P34	D30-E32 PolarHBondContact O-N 3.12Å; E32-P34 WeakPolarHBondContact O-CD 3.49Å
33	S	28.8	Very low	39.2	Very low	110 Å²	110	135.4 Å²	135.4	77%	0.769	74%	0.741	S	S	*	*			trans	-71.7	123.4	-172.7	51.9	0	0	0	0	111.1	S35	S33-S35 PolarHBondContact O-N 3.35Å
34	P	29.1	Very low	41.5	Very low	110 Å²	110	129.3 Å²	129.3	71%	0.714	70%	0.702	S	S	*	*			trans	-67.5	110.4	171	28	-32.2	0	0	0	108.3	E32 T36	E32-P34 WeakPolarHBondContact O-CD 3.49Å; P34-T36 VanDerWaalsContact C-N 3.33Å; P34-T36 PolarHBondContact O-N 3.33Å
35	S	28.5	Very low	44.2	Very low	107 Å²	107	122.2 Å²	122.2	75%	0.748	66%	0.664	S	S	*	*			trans	-62.1	99.9	164.5	43.5	0	0	0	0	107.5	S33 M37	S33-S35 PolarHBondContact O-N 3.35Å; S35-M37 PolarHBondContact O-N 3.4Å
36	T	29.7	Very low	46.7	Very low	129 Å²	129	122.8 Å²	122.8	79%	0.791	65%	0.651	S	S	*	*			trans	-67.7	85.9	176.6	51.1	0	0	0	0	108.6	P34 S38	P34-T36 VanDerWaalsContact C-N 3.33Å; P34-T36 PolarHBondContact O-N 3.33Å; T36-S38 PolarHBondContact O-N 3.43Å
37	M	29.3	Very low	49.6	Very low	174 Å²	174	111.3 Å²	111.3	86%	0.857	61%	0.608	S	S	*	*			trans	-60.9	103.8	164.5	-70.5	-164.7	74.4	0	0	107.1	S35	S35-M37 PolarHBondContact O-N 3.4Å
38	S	38.8	Very low	52.1	Low	97 Å²	97	104.7 Å²	104.7	68%	0.678	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-55.3	141.5	166	40.6	0	0	0	0	108.6	T36	T36-S38 PolarHBondContact O-N 3.43Å
39	P	42.2	Very low	54.9	Low	100 Å²	100	96 Å²	96	65%	0.649	54%	0.544	S	S	*	.	P	Polyproline II helix	trans	-55.6	139.7	174.2	24.6	-33.5	0	0	0	108.9	E41	P39-E41 PolarHBondContact O-N 3.22Å; P39-E41 VanDerWaalsContact O-N 3.16Å
40	P	56	Low	57.6	Low	128 Å²	128	91.4 Å²	91.4	83%	0.831	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-57.2	124	-174.6	22.8	-33.3	0	0	0	109.9	M42	P40-M42 PolarHBondContact O-N 2.87Å
41	E	68.7	Low	60.5	Low	117 Å²	117	87.2 Å²	87.2	55%	0.547	50%	0.495	S	S	.	.	P	Polyproline II helix	trans	-65.5	130.3	177.3	-67.2	-161.4	170.5	0	0	110.1	P39 R381	P39-E41 PolarHBondContact O-N 3.22Å; P39-E41 VanDerWaalsContact O-N 3.16Å; E41-R381 IonicContact OE2-CZ 2.67Å; E41-R381 IonicContact OE2-NH1 2.99Å; E41-R381 PolarHBondContact OE2-NH1 3.37Å
42	M	78.1	Confident	63.5	Low	61 Å²	61	81.3 Å²	81.3	30%	0.3	46%	0.458	S	S	.	.	P	Polyproline II helix	trans	-51.1	150.5	174.1	-70.8	174.9	-75.2	0	0	111.6	P40 E46 R381 P406	P40-M42 PolarHBondContact O-N 2.87Å; M42-E46 WeakPolarHBondContact CA-OE2 3.5Å; M42-E46 HydrophobicContact CB-CB 4.08Å; M42-R381 PolarHBondContact O-NH1 3.21Å; M42-R381 PolarHBondContact O-NH2 2.93Å; M42-P406 HydrophobicContact CE-CB 4.14Å; M42-P406 HydrophobicContact CE-CG 3.74Å
43	S	83.6	Confident	66.3	Low	32 Å²	32	73.2 Å²	73.2	22%	0.224	43%	0.425	C	S	.	.	P	Polyproline II helix	trans	-59.6	161.9	168.2	113.3	0	0	0	0	110.9	F45 E46 M47 D153	S43-F45 VanDerWaalsContact C-N 3.3Å; S43-F45 PolarHBondContact OG-N 2.87Å; S43-E46 PolarHBondContact N-OE2 3.28Å; S43-E46 PolarHBondContact O-N 3.02Å; S43-E46 WeakPolarHBondContact OG-CG 3.27Å; S43-E46 PolarHBondContact OG-N 3.13Å; S43-M47 VanDerWaalsContact O-CB 3.32Å; S43-M47 WeakPolarHBondContact O-CB 3.42Å; S43-M47 PolarHBondContact O-N 3.16Å; S43-D153 VanDerWaalsContact CB-OD2 3.27Å; S43-D153 WeakPolarHBondContact CB-OD2 3.32Å; S43-D153 PolarHBondContact OG-OD1 2.9Å; S43-D153 PolarHBondContact OG-OD2 3.39Å
44	Y	82.9	Confident	69.3	Low	10 Å²	10	70.5 Å²	70.5	4%	0.039	40%	0.399	C	S	.	.	H	α-helix	trans	-72.4	-32	-179.6	-170	-159.3	0	0	0	111	M47 T48 D153 E154 A157 L158 E380 N401	Y44-M47 HydrophobicContact CD2-SD 4.26Å; Y44-T48 PolarHBondContact O-N 3.3Å; Y44-T48 VanDerWaalsContact O-N 3.15Å; Y44-T48 PolarHBondContact O-OG1 3.4Å; Y44-D153 PolarHBondContact N-OD2 3.09Å; Y44-E154 HydrophobicContact CD1-CG 4.04Å; Y44-A157 HydrophobicContact CD1-CB 3.76Å; Y44-A157 HydrophobicContact CD2-CB 4.21Å; Y44-A157 HydrophobicContact CE1-CB 4.23Å; Y44-A157 HydrophobicContact CG-CB 3.75Å; Y44-A157 WeakPolarHBondContact O-CB 3.35Å; Y44-L158 HydrophobicContact CE1-CD1 4.03Å; Y44-L158 HydrophobicContact CE1-CD2 3.9Å; Y44-L158 HydrophobicContact CE1-CG 3.7Å; Y44-E380 HydrophobicContact CE2-CB 4.38Å; Y44-N401 PolarHBondContact OH-O 3.29Å
45	F	84.5	Confident	72.2	Confident	23 Å²	23	68.6 Å²	68.6	10%	0.101	39%	0.389	C	S	.	.	H	α-helix	trans	-67.7	-45.8	169.9	-170.3	-117	0	0	0	111.6	S43 M47 T48 E49 D153 K156 A157	S43-F45 VanDerWaalsContact C-N 3.3Å; S43-F45 PolarHBondContact OG-N 2.87Å; F45-M47 VanDerWaalsContact C-N 3.34Å; F45-M47 PolarHBondContact O-N 3.24Å; F45-T48 CarbonylContact O-C 3.58Å; F45-T48 WeakPolarHBondContact O-CA 3.4Å; F45-T48 PolarHBondContact O-N 3.12Å; F45-E49 HydrophobicContact CD1-CG 4.11Å; F45-E49 HydrophobicContact CD2-CG 4.48Å; F45-E49 HydrophobicContact CE1-CG 3.67Å; F45-E49 WeakPolarHBondContact CE1-OE2 3.37Å; F45-E49 HydrophobicContact CE2-CG 4.09Å; F45-E49 HydrophobicContact CG-CG 4.49Å; F45-E49 HydrophobicContact CZ-CG 3.65Å; F45-E49 PolarHBondContact O-N 3.02Å; F45-D153 VanDerWaalsContact CB-CG 3.49Å; F45-D153 WeakPolarHBondContact CB-OD1 3.5Å; F45-D153 WeakPolarHBondContact CB-OD2 3.42Å; F45-D153 PolarHBondContact N-OD2 3.35Å; F45-D153 VanDerWaalsContact N-OD2 3.08Å; F45-K156 HydrophobicContact CD2-CB 3.53Å; F45-K156 HydrophobicContact CE2-CB 3.8Å; F45-K156 HydrophobicContact CG-CB 4.11Å; F45-A157 HydrophobicContact CB-CB 4.34Å; F45-A157 HydrophobicContact CD2-CB 4.49Å
46	E	87.6	Confident	75.1	Confident	104 Å²	104	64.2 Å²	64.2	49%	0.486	36%	0.357	S	S	.	.	H	α-helix	trans	-57.9	-43.5	175.8	-71.7	177.3	156.1	0	0	112.5	M42 S43 T48 E49 H50	M42-E46 WeakPolarHBondContact CA-OE2 3.5Å; M42-E46 HydrophobicContact CB-CB 4.08Å; S43-E46 PolarHBondContact N-OE2 3.28Å; S43-E46 PolarHBondContact O-N 3.02Å; S43-E46 WeakPolarHBondContact OG-CG 3.27Å; S43-E46 PolarHBondContact OG-N 3.13Å; E46-T48 VanDerWaalsContact C-N 3.28Å; E46-T48 PolarHBondContact O-N 3.07Å; E46-E49 PolarHBondContact O-N 3.21Å; E46-H50 WeakPolarHBondContact O-CB 3.43Å; E46-H50 PolarHBondContact O-N 2.58Å
47	M	89	Confident	78.1	Confident	4 Å²	4	60.6 Å²	60.6	2%	0.02	34%	0.337	C	S	.	.	H	α-helix	trans	-57.8	-40.9	173	166.7	169.7	174.7	0	0	112	S43 Y44 F45 H50 F51 R381 G402 I404 P406	S43-M47 VanDerWaalsContact O-CB 3.32Å; S43-M47 WeakPolarHBondContact O-CB 3.42Å; S43-M47 PolarHBondContact O-N 3.16Å; Y44-M47 HydrophobicContact CD2-SD 4.26Å; F45-M47 VanDerWaalsContact C-N 3.34Å; F45-M47 PolarHBondContact O-N 3.24Å; M47-H50 WeakPolarHBondContact O-CB 3.25Å; M47-H50 PolarHBondContact O-N 3.24Å; M47-F51 HydrophobicContact CE-CE2 3.91Å; M47-F51 HydrophobicContact CG-CD2 4.37Å; M47-F51 HydrophobicContact CG-CE2 3.99Å; M47-F51 WeakPolarHBondContact O-CD2 3.4Å; M47-F51 PolarHBondContact O-N 3.43Å; M47-R381 HydrophobicContact SD-CG 4.19Å; M47-G402 WeakPolarHBondContact CE-O 3.4Å; M47-I404 WeakPolarHBondContact CE-O 3.18Å; M47-P406 HydrophobicContact CG-CG 4.08Å
48	T	86.2	Confident	81	Confident	4 Å²	4	59.1 Å²	59.1	3%	0.025	33%	0.326	C	S	.	.	H	α-helix	trans	-75.1	-43.1	179	-51.4	0	0	0	0	111.5	Y44 F45 E46 H50 F51 I52 S160 L161	Y44-T48 PolarHBondContact O-N 3.3Å; Y44-T48 VanDerWaalsContact O-N 3.15Å; Y44-T48 PolarHBondContact O-OG1 3.4Å; F45-T48 CarbonylContact O-C 3.58Å; F45-T48 WeakPolarHBondContact O-CA 3.4Å; F45-T48 PolarHBondContact O-N 3.12Å; E46-T48 VanDerWaalsContact C-N 3.28Å; E46-T48 PolarHBondContact O-N 3.07Å; T48-H50 PolarHBondContact O-N 3.04Å; T48-F51 PolarHBondContact O-N 3.35Å; T48-I52 HydrophobicContact CG2-CD1 4.04Å; T48-I52 HydrophobicContact CG2-CG1 4.5Å; T48-I52 VanDerWaalsContact O-CG1 3.28Å; T48-I52 WeakPolarHBondContact O-CG1 3.34Å; T48-I52 PolarHBondContact O-N 3.48Å; T48-S160 WeakPolarHBondContact CG2-OG 3.34Å; T48-L161 HydrophobicContact CG2-CD2 3.77Å; T48-L161 HydrophobicContact CG2-CG 3.83Å
49	E	88.6	Confident	83.6	Confident	59 Å²	59	58.3 Å²	58.3	28%	0.276	31%	0.314	S	S	.	.	H	α-helix	trans	-60.4	-30.1	171.9	-77.5	-156.3	107.6	0	0	112.1	F45 E46 G53	F45-E49 HydrophobicContact CD1-CG 4.11Å; F45-E49 HydrophobicContact CD2-CG 4.48Å; F45-E49 HydrophobicContact CE1-CG 3.67Å; F45-E49 WeakPolarHBondContact CE1-OE2 3.37Å; F45-E49 HydrophobicContact CE2-CG 4.09Å; F45-E49 HydrophobicContact CG-CG 4.49Å; F45-E49 HydrophobicContact CZ-CG 3.65Å; F45-E49 PolarHBondContact O-N 3.02Å; E46-E49 PolarHBondContact O-N 3.21Å; E49-G53 VanDerWaalsContact O-CA 3.32Å; E49-G53 WeakPolarHBondContact O-CA 3.43Å; E49-G53 PolarHBondContact O-N 2.84Å
50	H	90.4	Very high	85.9	Confident	76 Å²	76	55.8 Å²	55.8	35%	0.352	30%	0.295	S	S	.	.	H	α-helix	trans	-64.8	-51.1	172.3	179.4	98.4	0	0	0	111.5	E46 M47 T48 G53 K54 P406	E46-H50 WeakPolarHBondContact O-CB 3.43Å; E46-H50 PolarHBondContact O-N 2.58Å; M47-H50 WeakPolarHBondContact O-CB 3.25Å; M47-H50 PolarHBondContact O-N 3.24Å; T48-H50 PolarHBondContact O-N 3.04Å; H50-G53 WeakPolarHBondContact O-CA 3.46Å; H50-G53 PolarHBondContact O-N 2.92Å; H50-G53 VanDerWaalsContact O-N 3.15Å; H50-K54 WeakPolarHBondContact O-CB 3.48Å; H50-K54 PolarHBondContact O-N 3.01Å; H50-P406 HydrophobicContact CB-CG 4.42Å
51	F	90.9	Very high	87.7	Confident	62 Å²	62	54 Å²	54	27%	0.272	28%	0.278	S	S	.	.	H	α-helix	trans	-64.5	-40.5	178.1	-70.4	-60.1	0	0	0	112.5	M47 T48 G53 S55 P406 D409	M47-F51 HydrophobicContact CE-CE2 3.91Å; M47-F51 HydrophobicContact CG-CD2 4.37Å; M47-F51 HydrophobicContact CG-CE2 3.99Å; M47-F51 WeakPolarHBondContact O-CD2 3.4Å; M47-F51 PolarHBondContact O-N 3.43Å; T48-F51 PolarHBondContact O-N 3.35Å; F51-G53 VanDerWaalsContact C-N 3.33Å; F51-S55 WeakPolarHBondContact O-CB 3.44Å; F51-S55 PolarHBondContact O-N 3.2Å; F51-S55 PolarHBondContact O-OG 3.34Å; F51-P406 HydrophobicContact CE1-CB 4.31Å; F51-P406 HydrophobicContact CE1-CG 4.3Å; F51-P406 HydrophobicContact CE2-CG 3.9Å; F51-P406 HydrophobicContact CZ-CB 4.15Å; F51-P406 HydrophobicContact CZ-CG 3.79Å; F51-D409 HydrophobicContact CE1-CB 4.35Å
52	I	89.4	Confident	88.8	Confident	14 Å²	14	56.7 Å²	56.7	7%	0.072	28%	0.283	C	S	.	.	H	α-helix	trans	-62.5	-44	171.3	-61.6	171.2	0	0	0	109.7	T48 S55 T56 K88 I164	T48-I52 HydrophobicContact CG2-CD1 4.04Å; T48-I52 HydrophobicContact CG2-CG1 4.5Å; T48-I52 VanDerWaalsContact O-CG1 3.28Å; T48-I52 WeakPolarHBondContact O-CG1 3.34Å; T48-I52 PolarHBondContact O-N 3.48Å; I52-S55 CarbonylContact O-C 2.97Å; I52-S55 WeakPolarHBondContact O-CB 3.02Å; I52-S55 PolarHBondContact O-N 3.25Å; I52-S55 VanDerWaalsContact O-N 3.15Å; I52-T56 HydrophobicContact CG2-CG2 4.13Å; I52-T56 WeakPolarHBondContact O-CG2 3.46Å; I52-T56 PolarHBondContact O-N 3.39Å; I52-T56 PolarHBondContact O-OG1 2.88Å; I52-K88 HydrophobicContact CG2-CG 3.76Å; I52-I164 HydrophobicContact CD1-CD1 3.7Å; I52-I164 HydrophobicContact CG1-CD1 3.52Å
53	G	90.3	Very high	89.5	Confident	17 Å²	17	54.4 Å²	54.4	18%	0.175	27%	0.272	C	S	.	.	H	α-helix	trans	-54.9	-53.9	177.7	0	0	0	0	0	112.6	E49 H50 F51 S55 T56 S57	E49-G53 VanDerWaalsContact O-CA 3.32Å; E49-G53 WeakPolarHBondContact O-CA 3.43Å; E49-G53 PolarHBondContact O-N 2.84Å; H50-G53 WeakPolarHBondContact O-CA 3.46Å; H50-G53 PolarHBondContact O-N 2.92Å; H50-G53 VanDerWaalsContact O-N 3.15Å; F51-G53 VanDerWaalsContact C-N 3.33Å; G53-S55 VanDerWaalsContact C-N 3.27Å; G53-S55 PolarHBondContact O-N 3.04Å; G53-T56 WeakPolarHBondContact CA-OG1 3.47Å; G53-T56 PolarHBondContact O-N 3.09Å; G53-T56 VanDerWaalsContact O-N 3.16Å; G53-T56 PolarHBondContact O-OG1 3.15Å; G53-S57 PolarHBondContact O-N 3.02Å
54	K	90.9	Very high	89.9	Confident	53 Å²	53	57.2 Å²	57.2	23%	0.23	28%	0.281	C	S	.	.	H	α-helix	trans	-56.9	-38.6	174.9	-171.9	170.7	-177.8	171.5	0	112.1	H50 S57 F58 D409 E410	H50-K54 WeakPolarHBondContact O-CB 3.48Å; H50-K54 PolarHBondContact O-N 3.01Å; K54-S57 PolarHBondContact O-OG 3.18Å; K54-F58 HydrophobicContact CG-CE2 4.25Å; K54-F58 WeakPolarHBondContact O-CD2 3.43Å; K54-D409 IonicContact NZ-OD2 2.74Å; K54-D409 PolarHBondContact NZ-OD2 3.34Å; K54-E410 IonicContact NZ-OE1 3.55Å; K54-E410 PolarHBondContact NZ-OE1 3.03Å
55	S	90.2	Very high	90.4	Very high	70 Å²	70	63.5 Å²	63.5	49%	0.49	31%	0.309	S	S	.	.	H	α-helix	trans	-70.6	-43.5	175.7	-54.3	0	0	0	0	111.8	F51 I52 G53 S57 F58 I59	F51-S55 WeakPolarHBondContact O-CB 3.44Å; F51-S55 PolarHBondContact O-N 3.2Å; F51-S55 PolarHBondContact O-OG 3.34Å; I52-S55 CarbonylContact O-C 2.97Å; I52-S55 WeakPolarHBondContact O-CB 3.02Å; I52-S55 PolarHBondContact O-N 3.25Å; I52-S55 VanDerWaalsContact O-N 3.15Å; G53-S55 VanDerWaalsContact C-N 3.27Å; G53-S55 PolarHBondContact O-N 3.04Å; S55-S57 PolarHBondContact O-N 3.1Å; S55-F58 PolarHBondContact O-N 3Å; S55-I59 PolarHBondContact O-N 3.18Å
56	T	90.2	Very high	90.8	Very high	14 Å²	14	65 Å²	65	9%	0.086	32%	0.316	C	S	.	.	H	α-helix	trans	-65.7	-33.8	179.2	55.9	0	0	0	0	113	I52 G53 I59 D60 L84 K88	I52-T56 HydrophobicContact CG2-CG2 4.13Å; I52-T56 WeakPolarHBondContact O-CG2 3.46Å; I52-T56 PolarHBondContact O-N 3.39Å; I52-T56 PolarHBondContact O-OG1 2.88Å; G53-T56 WeakPolarHBondContact CA-OG1 3.47Å; G53-T56 PolarHBondContact O-N 3.09Å; G53-T56 VanDerWaalsContact O-N 3.16Å; G53-T56 PolarHBondContact O-OG1 3.15Å; T56-I59 PolarHBondContact O-N 3.32Å; T56-D60 WeakPolarHBondContact O-CB 3.39Å; T56-D60 PolarHBondContact O-N 3.33Å; T56-L84 HydrophobicContact CG2-CB 4.27Å; T56-L84 HydrophobicContact CG2-CD2 4.2Å; T56-K88 WeakPolarHBondContact OG1-CE 3.33Å; T56-K88 PolarHBondContact OG1-NZ 3.39Å
57	S	91.3	Very high	91	Very high	54 Å²	54	64.8 Å²	64.8	38%	0.378	31%	0.312	S	S	.	.	H	α-helix	trans	-68.6	-34.9	178.9	58.9	0	0	0	0	112.8	G53 K54 S55 I59 D60 L61	G53-S57 PolarHBondContact O-N 3.02Å; K54-S57 PolarHBondContact O-OG 3.18Å; S55-S57 PolarHBondContact O-N 3.1Å; S57-I59 VanDerWaalsContact C-N 3.32Å; S57-I59 PolarHBondContact O-N 3.16Å; S57-D60 PolarHBondContact O-N 2.96Å; S57-L61 WeakPolarHBondContact O-CB 3.48Å; S57-L61 VanDerWaalsContact O-CG 3.3Å; S57-L61 WeakPolarHBondContact O-CG 3.31Å; S57-L61 PolarHBondContact O-N 3.39Å
58	F	91.8	Very high	91.2	Very high	142 Å²	142	68.5 Å²	68.5	62%	0.623	34%	0.343	S	S	*	.	H	α-helix	trans	-64.6	-36	170.8	-71.2	-62.7	0	0	0	112.7	K54 S55 R62	K54-F58 HydrophobicContact CG-CE2 4.25Å; K54-F58 WeakPolarHBondContact O-CD2 3.43Å; S55-F58 PolarHBondContact O-N 3Å; F58-R62 PolarHBondContact O-N 3.46Å
59	I	92.2	Very high	91.5	Very high	81 Å²	81	74.1 Å²	74.1	42%	0.415	37%	0.373	S	S	.	.	H	α-helix	trans	-70	-42.6	174.5	-59.8	169.9	0	0	0	110	S55 T56 S57 R62 L63 L84	S55-I59 PolarHBondContact O-N 3.18Å; T56-I59 PolarHBondContact O-N 3.32Å; S57-I59 VanDerWaalsContact C-N 3.32Å; S57-I59 PolarHBondContact O-N 3.16Å; I59-R62 CarbonylContact O-C 3.51Å; I59-R62 WeakPolarHBondContact O-CA 3.4Å; I59-R62 WeakPolarHBondContact O-CB 3.46Å; I59-R62 PolarHBondContact O-N 2.92Å; I59-L63 HydrophobicContact CG2-CD1 4.25Å; I59-L63 HydrophobicContact CG2-CG 4.34Å; I59-L63 WeakPolarHBondContact O-CG 3.34Å; I59-L63 PolarHBondContact O-N 2.89Å; I59-L84 HydrophobicContact CB-CD1 4.26Å; I59-L84 HydrophobicContact CB-CD2 4.5Å; I59-L84 HydrophobicContact CD1-CD2 4.31Å; I59-L84 HydrophobicContact CG2-CD1 3.97Å; I59-L84 HydrophobicContact CG2-CD2 4.13Å
60	D	91.8	Very high	91.6	Very high	47 Å²	47	74.4 Å²	74.4	25%	0.251	39%	0.392	S	S	.	.	H	α-helix	trans	-60.3	-49.1	179.8	-149.2	1.3	0	0	0	111.1	T56 S57 R62 L63 E64 Q81	T56-D60 WeakPolarHBondContact O-CB 3.39Å; T56-D60 PolarHBondContact O-N 3.33Å; S57-D60 PolarHBondContact O-N 2.96Å; D60-R62 PolarHBondContact O-N 3.17Å; D60-R62 VanDerWaalsContact O-N 3.09Å; D60-L63 CarbonylContact O-C 3.55Å; D60-L63 WeakPolarHBondContact O-CA 3.29Å; D60-L63 WeakPolarHBondContact O-CB 3.47Å; D60-L63 PolarHBondContact O-N 2.86Å; D60-E64 WeakPolarHBondContact O-CG 3.34Å; D60-E64 PolarHBondContact O-N 3.35Å; D60-Q81 VanDerWaalsContact OD1-CG 3.23Å; D60-Q81 WeakPolarHBondContact OD1-CG 3.43Å; D60-Q81 PolarHBondContact OD1-NE2 3.25Å
61	L	92.9	Very high	91.6	Very high	90 Å²	90	76.7 Å²	76.7	47%	0.471	41%	0.406	S	S	.	.	H	α-helix	trans	-56.7	-27.4	172.3	-72.2	169.4	0	0	0	113.6	S57 K65	S57-L61 WeakPolarHBondContact O-CB 3.48Å; S57-L61 VanDerWaalsContact O-CG 3.3Å; S57-L61 WeakPolarHBondContact O-CG 3.31Å; S57-L61 PolarHBondContact O-N 3.39Å; L61-K65 WeakPolarHBondContact O-CD 3.49Å; L61-K65 VanDerWaalsContact O-CG 3.27Å; L61-K65 WeakPolarHBondContact O-CG 3.49Å; L61-K65 PolarHBondContact O-N 3.05Å
62	R	92.7	Very high	91.5	Very high	174 Å²	174	74.5 Å²	74.5	66%	0.657	40%	0.397	S	S	*	.	H	α-helix	trans	-79.4	-37.4	174.1	-175	179.8	179.3	177.3	0.8	111.6	F58 I59 D60 K65 Q66	F58-R62 PolarHBondContact O-N 3.46Å; I59-R62 CarbonylContact O-C 3.51Å; I59-R62 WeakPolarHBondContact O-CA 3.4Å; I59-R62 WeakPolarHBondContact O-CB 3.46Å; I59-R62 PolarHBondContact O-N 2.92Å; D60-R62 PolarHBondContact O-N 3.17Å; D60-R62 VanDerWaalsContact O-N 3.09Å; R62-K65 PolarHBondContact O-N 3.39Å; R62-Q66 WeakPolarHBondContact O-CG 3.16Å; R62-Q66 PolarHBondContact O-N 2.76Å
63	L	92.9	Very high	91.7	Very high	12 Å²	12	76.3 Å²	76.3	6%	0.063	41%	0.411	C	S	.	.	H	α-helix	trans	-67.2	-43.1	174.9	-65.6	174.3	0	0	0	111.2	I59 D60 K65 Q66 Y67 L72 L77 R80 L84	I59-L63 HydrophobicContact CG2-CD1 4.25Å; I59-L63 HydrophobicContact CG2-CG 4.34Å; I59-L63 WeakPolarHBondContact O-CG 3.34Å; I59-L63 PolarHBondContact O-N 2.89Å; D60-L63 CarbonylContact O-C 3.55Å; D60-L63 WeakPolarHBondContact O-CA 3.29Å; D60-L63 WeakPolarHBondContact O-CB 3.47Å; D60-L63 PolarHBondContact O-N 2.86Å; L63-K65 VanDerWaalsContact C-N 3.33Å; L63-K65 PolarHBondContact O-N 2.58Å; L63-Q66 WeakPolarHBondContact O-CB 3.42Å; L63-Q66 PolarHBondContact O-N 3.46Å; L63-Q66 VanDerWaalsContact O-N 3.12Å; L63-Y67 PolarHBondContact O-N 2.92Å; L63-L72 HydrophobicContact CD2-CD1 4.07Å; L63-L77 HydrophobicContact CB-CD1 3.68Å; L63-R80 HydrophobicContact CD1-CB 3.73Å; L63-R80 HydrophobicContact CD2-CB 4.34Å; L63-L84 HydrophobicContact CD1-CD1 3.91Å
64	E	92.1	Very high	91.8	Very high	91 Å²	91	80.2 Å²	80.2	43%	0.425	43%	0.425	S	S	.	.	H	α-helix	trans	-59	-42.1	173.8	-70.6	-179.9	156.6	0	0	111.8	D60 Y67 A68	D60-E64 WeakPolarHBondContact O-CG 3.34Å; D60-E64 PolarHBondContact O-N 3.35Å; E64-Y67 PolarHBondContact O-N 3.29Å; E64-A68 WeakPolarHBondContact O-CB 3.47Å; E64-A68 PolarHBondContact O-N 3.41Å
65	K	93	Very high	91.9	Very high	142 Å²	142	83 Å²	83	62%	0.617	45%	0.445	S	S	*	.	H	α-helix	trans	-65.3	-37	173.2	-75.2	174.2	-176.9	-178.4	0	113	L61 R62 L63 N69	L61-K65 WeakPolarHBondContact O-CD 3.49Å; L61-K65 VanDerWaalsContact O-CG 3.27Å; L61-K65 WeakPolarHBondContact O-CG 3.49Å; L61-K65 PolarHBondContact O-N 3.05Å; R62-K65 PolarHBondContact O-N 3.39Å; L63-K65 VanDerWaalsContact C-N 3.33Å; L63-K65 PolarHBondContact O-N 2.58Å; K65-N69 WeakPolarHBondContact O-CB 3.32Å; K65-N69 VanDerWaalsContact O-CG 3.23Å; K65-N69 PolarHBondContact O-N 2.89Å; K65-N69 VanDerWaalsContact O-N 3.09Å
66	Q	92.2	Very high	92	Very high	54 Å²	54	82.7 Å²	82.7	25%	0.252	44%	0.438	S	S	.	.	H	α-helix	trans	-66.6	-40	174.7	-76.9	179.1	-22.5	0	0	111.5	R62 L63 N69 G70 L71 L72	R62-Q66 WeakPolarHBondContact O-CG 3.16Å; R62-Q66 PolarHBondContact O-N 2.76Å; L63-Q66 WeakPolarHBondContact O-CB 3.42Å; L63-Q66 PolarHBondContact O-N 3.46Å; L63-Q66 VanDerWaalsContact O-N 3.12Å; Q66-N69 PolarHBondContact O-N 2.97Å; Q66-G70 PolarHBondContact O-N 3.09Å; Q66-L71 HydrophobicContact CB-CB 4.32Å; Q66-L71 HydrophobicContact CG-CD1 4.47Å; Q66-L71 WeakPolarHBondContact O-CB 3.35Å; Q66-L71 PolarHBondContact O-N 3.34Å; Q66-L72 HydrophobicContact CB-CD1 3.6Å; Q66-L72 HydrophobicContact CB-CG 4Å
67	Y	91.8	Very high	92.1	Very high	101 Å²	101	82.8 Å²	82.8	40%	0.396	44%	0.438	S	S	.	.	H	α-helix	trans	-63	-48	172.9	175.6	-109.3	0	0	0	112.1	L63 E64 N69 G70 L72 E74 L77	L63-Y67 PolarHBondContact O-N 2.92Å; E64-Y67 PolarHBondContact O-N 3.29Å; Y67-N69 PolarHBondContact O-N 3.45Å; Y67-G70 PolarHBondContact O-N 2.88Å; Y67-L72 WeakPolarHBondContact CD2-O 3.36Å; Y67-E74 HydrophobicContact CE2-CB 3.86Å; Y67-E74 HydrophobicContact CE2-CG 4.35Å; Y67-L77 HydrophobicContact CD1-CD2 3.89Å; Y67-L77 HydrophobicContact CD2-CD2 4.26Å; Y67-L77 HydrophobicContact CE1-CD2 4.5Å; Y67-L77 HydrophobicContact CG-CD2 3.76Å
68	A	92.8	Very high	92.3	Very high	81 Å²	81	86 Å²	86	67%	0.669	45%	0.445	S	S	*	.	H	α-helix	trans	-60.1	-29.5	176.9	0	0	0	0	0	113.5	E64 G70	E64-A68 WeakPolarHBondContact O-CB 3.47Å; E64-A68 PolarHBondContact O-N 3.41Å; A68-G70 VanDerWaalsContact C-N 3.32Å
69	N	93.4	Very high	92.4	Very high	122 Å²	122	84.6 Å²	84.6	65%	0.652	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	4.4	175.1	-68.9	-5.7	0	0	0	113.8	K65 Q66 Y67 L71	K65-N69 WeakPolarHBondContact O-CB 3.32Å; K65-N69 VanDerWaalsContact O-CG 3.23Å; K65-N69 PolarHBondContact O-N 2.89Å; K65-N69 VanDerWaalsContact O-N 3.09Å; Q66-N69 PolarHBondContact O-N 2.97Å; Y67-N69 PolarHBondContact O-N 3.45Å; N69-L71 VanDerWaalsContact C-N 3.26Å; N69-L71 HydrophobicContact CB-CD1 4.23Å; N69-L71 HydrophobicContact CB-CG 4.22Å; N69-L71 PolarHBondContact O-N 2.94Å
70	G	90.3	Very high	92.4	Very high	66 Å²	66	85.8 Å²	85.8	68%	0.68	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.9	12.5	-178.4	0	0	0	0	0	115.2	Q66 Y67 A68 L72	Q66-G70 PolarHBondContact O-N 3.09Å; Y67-G70 PolarHBondContact O-N 2.88Å; A68-G70 VanDerWaalsContact C-N 3.32Å; G70-L72 VanDerWaalsContact C-N 3.33Å
71	L	90.7	Very high	92.5	Very high	124 Å²	124	85.3 Å²	85.3	65%	0.649	44%	0.44	S	S	*	.	S	Bend	trans	-84.7	-5.6	179.9	-61.5	171.8	0	0	0	113.4	Q66 N69	Q66-L71 HydrophobicContact CB-CB 4.32Å; Q66-L71 HydrophobicContact CG-CD1 4.47Å; Q66-L71 WeakPolarHBondContact O-CB 3.35Å; Q66-L71 PolarHBondContact O-N 3.34Å; N69-L71 VanDerWaalsContact C-N 3.26Å; N69-L71 HydrophobicContact CB-CD1 4.23Å; N69-L71 HydrophobicContact CB-CG 4.22Å; N69-L71 PolarHBondContact O-N 2.94Å
72	L	89.7	Confident	92.4	Very high	15 Å²	15	82.7 Å²	82.7	8%	0.079	43%	0.434	C	S	.	.	S	Bend	trans	-138.1	143.4	176.8	-70.6	172	0	0	0	109.9	L63 Q66 Y67 G70 D76	L63-L72 HydrophobicContact CD2-CD1 4.07Å; Q66-L72 HydrophobicContact CB-CD1 3.6Å; Q66-L72 HydrophobicContact CB-CG 4Å; Y67-L72 WeakPolarHBondContact CD2-O 3.36Å; G70-L72 VanDerWaalsContact C-N 3.33Å; L72-D76 HydrophobicContact CB-CB 4.36Å; L72-D76 HydrophobicContact CD2-CB 3.83Å
73	S	92.3	Very high	92.4	Very high	52 Å²	52	78.2 Å²	78.2	36%	0.364	43%	0.426	S	S	.	.			trans	-73.6	161.8	163.3	75.2	0	0	0	0	110.7	V75 D76 L77	S73-V75 PolarHBondContact O-N 3.37Å; S73-V75 PolarHBondContact OG-N 3.43Å; S73-D76 WeakPolarHBondContact CB-OD2 3.22Å; S73-D76 PolarHBondContact N-OD2 3.24Å; S73-D76 PolarHBondContact O-N 3.49Å; S73-D76 PolarHBondContact OG-N 3.21Å; S73-D76 PolarHBondContact OG-OD2 3.09Å; S73-L77 PolarHBondContact O-N 2.82Å
74	E	92.6	Very high	92.3	Very high	100 Å²	100	78.6 Å²	78.6	47%	0.467	43%	0.428	S	S	.	.	H	α-helix	trans	-60.7	-31.6	172.9	-164.4	-168.2	158.8	0	0	111.5	Y67 K78	Y67-E74 HydrophobicContact CE2-CB 3.86Å; Y67-E74 HydrophobicContact CE2-CG 4.35Å; E74-K78 HydrophobicContact CG-CD 4.47Å; E74-K78 WeakPolarHBondContact O-CB 3.42Å; E74-K78 WeakPolarHBondContact O-CG 3.41Å; E74-K78 PolarHBondContact O-N 3.33Å; E74-K78 WeakPolarHBondContact OE1-CE 3.3Å; E74-K78 IonicContact OE1-NZ 2.58Å; E74-K78 PolarHBondContact OE1-NZ 3.41Å
75	V	93.6	Very high	92.2	Very high	110 Å²	110	81 Å²	81	67%	0.667	44%	0.437	S	S	*	.	H	α-helix	trans	-66.6	-45.8	176	-177.9	0	0	0	0	110.5	S73 K78 L79	S73-V75 PolarHBondContact O-N 3.37Å; S73-V75 PolarHBondContact OG-N 3.43Å; V75-K78 PolarHBondContact O-N 3.06Å; V75-L79 VanDerWaalsContact O-CB 3.32Å; V75-L79 WeakPolarHBondContact O-CB 3.41Å; V75-L79 PolarHBondContact O-N 3.25Å
76	D	92.6	Very high	92.1	Very high	64 Å²	64	78.8 Å²	78.8	34%	0.342	43%	0.427	S	S	.	.	H	α-helix	trans	-64.3	-40.5	177.4	-63.6	-59.2	0	0	0	112.1	L72 S73 L79 R80	L72-D76 HydrophobicContact CB-CB 4.36Å; L72-D76 HydrophobicContact CD2-CB 3.83Å; S73-D76 WeakPolarHBondContact CB-OD2 3.22Å; S73-D76 PolarHBondContact N-OD2 3.24Å; S73-D76 PolarHBondContact O-N 3.49Å; S73-D76 PolarHBondContact OG-N 3.21Å; S73-D76 PolarHBondContact OG-OD2 3.09Å; D76-L79 PolarHBondContact O-N 3.43Å; D76-R80 WeakPolarHBondContact O-CB 3.37Å; D76-R80 VanDerWaalsContact O-CG 3.22Å; D76-R80 WeakPolarHBondContact O-CG 3.36Å; D76-R80 PolarHBondContact O-N 2.88Å
77	L	92.7	Very high	91.9	Very high	16 Å²	16	81.2 Å²	81.2	8%	0.084	44%	0.44	C	S	.	.	H	α-helix	trans	-59.1	-53.1	175.3	177.4	63.4	0	0	0	110.4	L63 Y67 S73 L79 R80 Q81	L63-L77 HydrophobicContact CB-CD1 3.68Å; Y67-L77 HydrophobicContact CD1-CD2 3.89Å; Y67-L77 HydrophobicContact CD2-CD2 4.26Å; Y67-L77 HydrophobicContact CE1-CD2 4.5Å; Y67-L77 HydrophobicContact CG-CD2 3.76Å; S73-L77 PolarHBondContact O-N 2.82Å; L77-L79 VanDerWaalsContact C-N 3.34Å; L77-L79 PolarHBondContact O-N 2.91Å; L77-R80 PolarHBondContact O-N 2.86Å; L77-Q81 HydrophobicContact CD1-CG 4.32Å; L77-Q81 WeakPolarHBondContact O-CB 3.23Å; L77-Q81 WeakPolarHBondContact O-CG 3.21Å; L77-Q81 PolarHBondContact O-N 3.46Å
78	K	93.5	Very high	91.7	Very high	122 Å²	122	79.1 Å²	79.1	53%	0.53	43%	0.433	S	S	.	.	H	α-helix	trans	-61	-40.3	179	-75.1	173.7	-179.6	171.1	0	112.3	E74 V75 G82	E74-K78 HydrophobicContact CG-CD 4.47Å; E74-K78 WeakPolarHBondContact O-CB 3.42Å; E74-K78 WeakPolarHBondContact O-CG 3.41Å; E74-K78 PolarHBondContact O-N 3.33Å; E74-K78 WeakPolarHBondContact OE1-CE 3.3Å; E74-K78 IonicContact OE1-NZ 2.58Å; E74-K78 PolarHBondContact OE1-NZ 3.41Å; V75-K78 PolarHBondContact O-N 3.06Å; K78-G82 PolarHBondContact O-N 3.32Å
79	L	93.9	Very high	91.5	Very high	113 Å²	113	83.5 Å²	83.5	59%	0.592	43%	0.432	S	S	*	.	H	α-helix	trans	-62.8	-49.4	176.4	-178.3	64.2	0	0	0	111.1	V75 D76 L77 Q81 G82 V83	V75-L79 VanDerWaalsContact O-CB 3.32Å; V75-L79 WeakPolarHBondContact O-CB 3.41Å; V75-L79 PolarHBondContact O-N 3.25Å; D76-L79 PolarHBondContact O-N 3.43Å; L77-L79 VanDerWaalsContact C-N 3.34Å; L77-L79 PolarHBondContact O-N 2.91Å; L79-Q81 PolarHBondContact O-N 3.35Å; L79-G82 CarbonylContact O-C 3.58Å; L79-G82 WeakPolarHBondContact O-CA 2.85Å; L79-G82 PolarHBondContact O-N 3.4Å; L79-G82 VanDerWaalsContact O-N 3.09Å; L79-V83 WeakPolarHBondContact O-CG2 3.05Å; L79-V83 PolarHBondContact O-N 2.88Å
80	R	93.3	Very high	91.5	Very high	106 Å²	106	79.2 Å²	79.2	40%	0.4	41%	0.411	S	S	.	.	H	α-helix	trans	-64.4	-40.5	179.1	-69.6	174.5	-176.7	-159.2	2.5	112.1	L63 D76 L77 G82 V83 L84	L63-R80 HydrophobicContact CD1-CB 3.73Å; L63-R80 HydrophobicContact CD2-CB 4.34Å; D76-R80 WeakPolarHBondContact O-CB 3.37Å; D76-R80 VanDerWaalsContact O-CG 3.22Å; D76-R80 WeakPolarHBondContact O-CG 3.36Å; D76-R80 PolarHBondContact O-N 2.88Å; L77-R80 PolarHBondContact O-N 2.86Å; R80-G82 VanDerWaalsContact C-N 3.3Å; R80-G82 PolarHBondContact O-N 3.22Å; R80-V83 WeakPolarHBondContact O-CB 3.33Å; R80-V83 PolarHBondContact O-N 3.24Å; R80-L84 WeakPolarHBondContact O-CG 3.17Å; R80-L84 PolarHBondContact O-N 2.74Å
81	Q	92.7	Very high	91.6	Very high	37 Å²	37	78.6 Å²	78.6	17%	0.173	39%	0.392	C	S	.	.	H	α-helix	trans	-61.1	-38	170.6	-75.5	178.9	-18.8	0	0	112.3	D60 L77 L79 L84 K85	D60-Q81 VanDerWaalsContact OD1-CG 3.23Å; D60-Q81 WeakPolarHBondContact OD1-CG 3.43Å; D60-Q81 PolarHBondContact OD1-NE2 3.25Å; L77-Q81 HydrophobicContact CD1-CG 4.32Å; L77-Q81 WeakPolarHBondContact O-CB 3.23Å; L77-Q81 WeakPolarHBondContact O-CG 3.21Å; L77-Q81 PolarHBondContact O-N 3.46Å; L79-Q81 PolarHBondContact O-N 3.35Å; Q81-L84 PolarHBondContact O-N 2.75Å; Q81-K85 WeakPolarHBondContact O-CG 3.4Å; Q81-K85 PolarHBondContact O-N 2.9Å
82	G	92.7	Very high	91.8	Very high	35 Å²	35	74 Å²	74	36%	0.361	37%	0.37	S	S	.	.	H	α-helix	trans	-60.2	-44.3	171.2	0	0	0	0	0	112.7	K78 L79 R80 K85 K86	K78-G82 PolarHBondContact O-N 3.32Å; L79-G82 CarbonylContact O-C 3.58Å; L79-G82 WeakPolarHBondContact O-CA 2.85Å; L79-G82 PolarHBondContact O-N 3.4Å; L79-G82 VanDerWaalsContact O-N 3.09Å; R80-G82 VanDerWaalsContact C-N 3.3Å; R80-G82 PolarHBondContact O-N 3.22Å; G82-K85 PolarHBondContact O-N 3.24Å; G82-K86 PolarHBondContact O-N 2.91Å
83	V	91.8	Very high	92	Very high	79 Å²	79	76.4 Å²	76.4	48%	0.479	38%	0.382	S	S	.	.	H	α-helix	trans	-61.1	-46.7	174.2	175	0	0	0	0	111.1	L79 R80 K85 K86 M87	L79-V83 WeakPolarHBondContact O-CG2 3.05Å; L79-V83 PolarHBondContact O-N 2.88Å; R80-V83 WeakPolarHBondContact O-CB 3.33Å; R80-V83 PolarHBondContact O-N 3.24Å; V83-K85 VanDerWaalsContact C-N 3.29Å; V83-K85 PolarHBondContact O-N 2.93Å; V83-K86 PolarHBondContact O-N 3.18Å; V83-M87 HydrophobicContact CG1-CG 4.34Å; V83-M87 HydrophobicContact CG1-SD 4.18Å; V83-M87 WeakPolarHBondContact O-CG 3.22Å; V83-M87 PolarHBondContact O-N 3.5Å
84	L	91.3	Very high	92.1	Very high	20 Å²	20	75 Å²	75	11%	0.105	37%	0.371	C	S	.	.	H	α-helix	trans	-60.3	-36.4	176.4	-64.9	178.1	0	0	0	112.6	T56 I59 L63 R80 Q81 M87	T56-L84 HydrophobicContact CG2-CB 4.27Å; T56-L84 HydrophobicContact CG2-CD2 4.2Å; I59-L84 HydrophobicContact CB-CD1 4.26Å; I59-L84 HydrophobicContact CB-CD2 4.5Å; I59-L84 HydrophobicContact CD1-CD2 4.31Å; I59-L84 HydrophobicContact CG2-CD1 3.97Å; I59-L84 HydrophobicContact CG2-CD2 4.13Å; L63-L84 HydrophobicContact CD1-CD1 3.91Å; R80-L84 WeakPolarHBondContact O-CG 3.17Å; R80-L84 PolarHBondContact O-N 2.74Å; Q81-L84 PolarHBondContact O-N 2.75Å; L84-M87 HydrophobicContact CD2-SD 4.35Å
85	K	90.1	Very high	92.2	Very high	143 Å²	143	75.3 Å²	75.3	62%	0.622	37%	0.373	S	S	*	.	H	α-helix	trans	-67.8	-39.4	172.8	-71.8	169.3	-176.4	173.7	0	111.8	Q81 G82 V83 K88	Q81-K85 WeakPolarHBondContact O-CG 3.4Å; Q81-K85 PolarHBondContact O-N 2.9Å; G82-K85 PolarHBondContact O-N 3.24Å; V83-K85 VanDerWaalsContact C-N 3.29Å; V83-K85 PolarHBondContact O-N 2.93Å; K85-K88 PolarHBondContact O-N 3.47Å
86	K	90.1	Very high	92.2	Very high	95 Å²	95	70.9 Å²	70.9	41%	0.413	35%	0.346	S	S	.	.	H	α-helix	trans	-67.1	-35.9	176.2	178.8	63.9	-159.7	79.5	0	112.5	G82 V83 K88 R89 D91	G82-K86 PolarHBondContact O-N 2.91Å; V83-K86 PolarHBondContact O-N 3.18Å; K86-K88 PolarHBondContact O-N 3Å; K86-R89 PolarHBondContact NZ-O 3.09Å; K86-R89 PolarHBondContact O-N 2.95Å; K86-D91 WeakPolarHBondContact CE-OD1 3.41Å; K86-D91 IonicContact NZ-OD1 3.25Å; K86-D91 PolarHBondContact NZ-OD1 3Å
87	M	88.3	Confident	92.3	Very high	104 Å²	104	70.8 Å²	70.8	51%	0.512	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-17.2	179.2	-74.6	178	72.4	0	0	114.6	V83 L84 H117	V83-M87 HydrophobicContact CG1-CG 4.34Å; V83-M87 HydrophobicContact CG1-SD 4.18Å; V83-M87 WeakPolarHBondContact O-CG 3.22Å; V83-M87 PolarHBondContact O-N 3.5Å; L84-M87 HydrophobicContact CD2-SD 4.35Å; M87-H117 PolarHBondContact O-CE1 2.89Å; M87-H117 PolarHBondContact O-NE2 3.44Å
88	K	87.2	Confident	92.4	Very high	57 Å²	57	70.1 Å²	70.1	25%	0.248	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-27.5	175.5	-68	179.6	-177.1	-176.5	0	113.2	I52 T56 K85 K86	I52-K88 HydrophobicContact CG2-CG 3.76Å; T56-K88 WeakPolarHBondContact OG1-CE 3.33Å; T56-K88 PolarHBondContact OG1-NZ 3.39Å; K85-K88 PolarHBondContact O-N 3.47Å; K86-K88 PolarHBondContact O-N 3Å
89	R	89.1	Confident	92.5	Very high	174 Å²	174	67.2 Å²	67.2	66%	0.657	34%	0.341	S	S	*	.	S	Bend	trans	-109.2	134.1	-170.1	-69	-176.4	176	169.4	-1.9	111.1	K86	K86-R89 PolarHBondContact NZ-O 3.09Å; K86-R89 PolarHBondContact O-N 2.95Å
90	P	92.3	Very high	92.5	Very high	32 Å²	32	62.3 Å²	62.3	21%	0.208	32%	0.315	C	S	.	.			trans	-60.7	146.1	177.6	26.7	-35.2	0	0	0	112.3	S92 C115 H117 K156	P90-S92 VanDerWaalsContact C-N 3.34Å; P90-C115 WeakPolarHBondContact CB-SG 3.41Å; P90-H117 CarbonylContact C-O 3.15Å; P90-H117 VanDerWaalsContact CA-O 3.31Å; P90-H117 WeakPolarHBondContact CA-O 3.41Å; P90-H117 HydrophobicContact CB-CB 4.44Å; P90-K156 HydrophobicContact CG-CG 4.3Å
91	D	93.7	Very high	92.6	Very high	52 Å²	52	60.6 Å²	60.6	28%	0.278	32%	0.317	S	S	.	.	S	Bend	trans	-65.8	-35.7	174.9	-74.8	-13.1	0	0	0	112.5	K86 Q116 H117 S118 R119	K86-D91 WeakPolarHBondContact CE-OD1 3.41Å; K86-D91 IonicContact NZ-OD1 3.25Å; K86-D91 PolarHBondContact NZ-OD1 3Å; D91-Q116 PolarHBondContact N-O 3.23Å; D91-Q116 VanDerWaalsContact N-O 3.12Å; D91-H117 PolarHBondContact N-O 2.74Å; D91-S118 WeakPolarHBondContact OD2-CA 3.33Å; D91-R119 WeakPolarHBondContact OD2-CB 3.36Å; D91-R119 WeakPolarHBondContact OD2-CG 3.38Å; D91-R119 PolarHBondContact OD2-N 3.14Å
92	S	94.6	Very high	92.7	Very high	28 Å²	28	60.1 Å²	60.1	20%	0.196	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.6	148.5	175.2	60.7	0	0	0	0	112.6	P90 Q116 R119 F208	P90-S92 VanDerWaalsContact C-N 3.34Å; S92-Q116 PolarHBondContact N-O 3.45Å; S92-Q116 VanDerWaalsContact N-O 3.11Å; S92-Q116 PolarHBondContact O-N 3.42Å; S92-R119 PolarHBondContact OG-NH2 3.39Å; S92-F208 WeakPolarHBondContact OG-CZ 3.43Å
93	I	93.9	Very high	92.8	Very high	65 Å²	65	62.5 Å²	62.5	33%	0.333	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	136.7	162.9	-174.3	168.3	0	0	0	108.6	R114 C115 K156	I93-R114 WeakPolarHBondContact CA-O 3.42Å; I93-C115 HydrophobicContact CB-CB 4.43Å; I93-C115 HydrophobicContact CD1-CB 4.43Å; I93-C115 HydrophobicContact CG1-CB 4.26Å; I93-K156 HydrophobicContact CD1-CG 4.16Å
94	V	94.1	Very high	92.8	Very high	22 Å²	22	62.6 Å²	62.6	13%	0.133	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	136.9	166.6	66.3	0	0	0	0	108.6	V96 W113 R114 M206 F208	V94-V96 HydrophobicContact CG2-CG2 3.81Å; V94-W113 CarbonylContact O-C 3.41Å; V94-W113 VanDerWaalsContact O-CA 3.25Å; V94-W113 WeakPolarHBondContact O-CA 3.04Å; V94-R114 HydrophobicContact CG1-CB 3.88Å; V94-R114 PolarHBondContact N-O 3.48Å; V94-R114 PolarHBondContact O-N 2.9Å; V94-M206 HydrophobicContact CG2-CG 4.39Å; V94-F208 HydrophobicContact CB-CD2 4.1Å; V94-F208 HydrophobicContact CB-CE1 4.44Å; V94-F208 HydrophobicContact CB-CE2 3.65Å; V94-F208 HydrophobicContact CB-CZ 3.82Å; V94-F208 HydrophobicContact CG1-CB 4.5Å; V94-F208 HydrophobicContact CG1-CD1 3.95Å; V94-F208 HydrophobicContact CG1-CD2 3.58Å; V94-F208 HydrophobicContact CG1-CE1 3.95Å; V94-F208 HydrophobicContact CG1-CE2 3.61Å; V94-F208 HydrophobicContact CG1-CG 3.75Å; V94-F208 HydrophobicContact CG1-CZ 3.77Å; V94-F208 HydrophobicContact CG2-CE2 4.48Å
95	Q	95.1	Very high	92.9	Very high	107 Å²	107	64.1 Å²	64.1	50%	0.5	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	134.2	161.7	179.3	169.3	-20.3	0	0	107.4	S112 W113	Q95-S112 CarbonylContact C-O 3.49Å; Q95-S112 VanDerWaalsContact CA-O 3.29Å; Q95-S112 WeakPolarHBondContact CA-O 3.17Å; Q95-W113 HydrophobicContact CG-CZ2 4.25Å
96	V	93.1	Very high	93.1	Very high	17 Å²	17	63.8 Å²	63.8	10%	0.103	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	119.9	172.9	-171.8	0	0	0	0	108.4	V94 F98 S112 E202	V94-V96 HydrophobicContact CG2-CG2 3.81Å; V96-F98 HydrophobicContact CG1-CD1 4.13Å; V96-S112 PolarHBondContact N-O 3.46Å; V96-S112 PolarHBondContact O-N 3.45Å; V96-S112 PolarHBondContact O-OG 2.98Å; V96-E202 HydrophobicContact CG1-CB 3.86Å; V96-E202 HydrophobicContact CG1-CG 4.02Å
97	S	95	Very high	93.4	Very high	63 Å²	63	63.7 Å²	63.7	44%	0.441	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	124	168.6	-45.7	0	0	0	0	107.7	I110 D111	S97-I110 WeakPolarHBondContact CA-O 3.3Å; S97-D111 WeakPolarHBondContact CB-OD1 3.39Å; S97-D111 PolarHBondContact OG-OD1 3.16Å
98	F	94.3	Very high	93.7	Very high	1 Å²	1	62 Å²	62	0%	0.004	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	140.4	-176.6	57.1	-92.8	0	0	0	112.4	V96 V100 I110 I195 R198 L199	V96-F98 HydrophobicContact CG1-CD1 4.13Å; F98-V100 HydrophobicContact CD2-CG2 3.7Å; F98-V100 HydrophobicContact CE2-CG2 3.69Å; F98-I110 HydrophobicContact CE1-CG2 4.49Å; F98-I110 HydrophobicContact CE2-CB 4.24Å; F98-I110 HydrophobicContact CE2-CG2 4.39Å; F98-I110 HydrophobicContact CZ-CB 4.33Å; F98-I110 HydrophobicContact CZ-CG2 4.03Å; F98-I110 PolarHBondContact N-O 2.78Å; F98-I110 PolarHBondContact O-N 3.07Å; F98-I195 HydrophobicContact CE2-CG2 4.2Å; F98-I195 HydrophobicContact CZ-CG2 4.13Å; F98-R198 HydrophobicContact CB-CG 4.18Å; F98-R198 HydrophobicContact CD2-CB 4.02Å; F98-R198 HydrophobicContact CD2-CG 3.39Å; F98-R198 HydrophobicContact CE2-CB 4.03Å; F98-R198 HydrophobicContact CE2-CG 3.92Å; F98-R198 HydrophobicContact CG-CG 3.88Å; F98-L199 HydrophobicContact CE1-CB 4.37Å; F98-L199 HydrophobicContact CE1-CD1 3.69Å; F98-L199 HydrophobicContact CZ-CB 4.11Å; F98-L199 HydrophobicContact CZ-CD1 4.06Å
99	P	96.5	Very high	94.1	Very high	62 Å²	62	63.7 Å²	63.7	40%	0.403	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	140.9	177	30.6	-34.2	0	0	0	111.4	V107 E108 R198	P99-V107 HydrophobicContact CB-CG1 3.73Å; P99-E108 CarbonylContact C-O 3.57Å; P99-E108 VanDerWaalsContact CA-O 3.32Å; P99-E108 WeakPolarHBondContact CA-O 3.44Å; P99-R198 PolarHBondContact O-NH1 3.02Å
100	V	93.9	Very high	94.3	Very high	9 Å²	9	55.5 Å²	55.5	6%	0.055	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	128.5	169.8	-178.1	0	0	0	0	108.5	F98 E108 I110 R194 I195	F98-V100 HydrophobicContact CD2-CG2 3.7Å; F98-V100 HydrophobicContact CE2-CG2 3.69Å; V100-E108 PolarHBondContact N-O 2.9Å; V100-E108 PolarHBondContact O-N 3.36Å; V100-I110 HydrophobicContact CB-CD1 4.31Å; V100-I110 HydrophobicContact CG2-CD1 4.12Å; V100-R194 HydrophobicContact CG1-CB 4.02Å; V100-I195 HydrophobicContact CB-CG1 4.42Å; V100-I195 HydrophobicContact CG1-CG1 4.07Å; V100-I195 HydrophobicContact CG2-CG1 4.06Å
101	T	94.8	Very high	94.4	Very high	71 Å²	71	55.9 Å²	55.9	44%	0.436	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	126.7	168.3	-48.9	0	0	0	0	108.7	E106 R194	T101-E106 CarbonylContact C-O 3.59Å; T101-E106 WeakPolarHBondContact CA-O 3.35Å; T101-R194 PolarHBondContact O-NE 3.15Å; T101-R194 PolarHBondContact O-NH1 3.05Å; T101-R194 PolarHBondContact O-NH2 2.84Å
102	L	94.5	Very high	94.4	Very high	26 Å²	26	53.4 Å²	53.4	14%	0.136	31%	0.314	C	S	.	.			trans	-77.1	171.7	175.6	-58.7	-175.3	0	0	0	111.2	S104 G105 E106 E108 Y187 E191	L102-S104 PolarHBondContact O-N 2.74Å; L102-G105 PolarHBondContact O-N 2.78Å; L102-G105 VanDerWaalsContact O-N 3.11Å; L102-E106 PolarHBondContact N-O 2.99Å; L102-E108 HydrophobicContact CD1-CB 4.3Å; L102-E108 HydrophobicContact CD2-CB 4.27Å; L102-E108 HydrophobicContact CG-CB 4.31Å; L102-Y187 HydrophobicContact CD2-CD1 4.17Å; L102-Y187 HydrophobicContact CD2-CE1 3.87Å; L102-E191 WeakPolarHBondContact CB-OE1 3.48Å; L102-E191 HydrophobicContact CD2-CG 4.41Å
103	D	94.3	Very high	94.4	Very high	85 Å²	85	52.5 Å²	52.5	46%	0.455	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-18.8	172.6	-72.3	-23.5	0	0	0	112	G105 S188 S190 E191 R194	D103-G105 PolarHBondContact O-N 2.67Å; D103-S188 VanDerWaalsContact OD2-CB 3.28Å; D103-S188 WeakPolarHBondContact OD2-CB 3.46Å; D103-S188 PolarHBondContact OD2-OG 2.91Å; D103-S190 PolarHBondContact OD2-OG 3.29Å; D103-E191 PolarHBondContact N-OE1 2.99Å; D103-R194 IonicContact OD1-CZ 3.22Å; D103-R194 IonicContact OD1-NH1 3.98Å; D103-R194 IonicContact OD1-NH2 2.72Å; D103-R194 PolarHBondContact OD1-NH2 3.27Å; D103-R194 IonicContact OD2-NH2 3.36Å
104	S	93.5	Very high	94.4	Very high	82 Å²	82	49.4 Å²	49.4	57%	0.573	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-14.3	168.1	63.3	0	0	0	0	114	L102 E106	L102-S104 PolarHBondContact O-N 2.74Å; S104-E106 VanDerWaalsContact C-N 3.3Å; S104-E106 PolarHBondContact OG-N 2.8Å
105	G	93.3	Very high	94.4	Very high	51 Å²	51	48.4 Å²	48.4	53%	0.526	28%	0.284	S	S	.	.	S	Bend	trans	86.1	-9.5	-171	0	0	0	0	0	114.7	L102 D103	L102-G105 PolarHBondContact O-N 2.78Å; L102-G105 VanDerWaalsContact O-N 3.11Å; D103-G105 PolarHBondContact O-N 2.67Å
106	E	94.3	Very high	94.4	Very high	137 Å²	137	43.5 Å²	43.5	64%	0.64	26%	0.262	S	S	*	.			trans	-67.2	155.5	172	-64.3	-176.5	147.2	0	0	111.2	T101 L102 S104	T101-E106 CarbonylContact C-O 3.59Å; T101-E106 WeakPolarHBondContact CA-O 3.35Å; L102-E106 PolarHBondContact N-O 2.99Å; S104-E106 VanDerWaalsContact C-N 3.3Å; S104-E106 PolarHBondContact OG-N 2.8Å
107	V	94.7	Very high	94.4	Very high	93 Å²	93	42.9 Å²	42.9	56%	0.564	26%	0.258	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.1	113.3	177.2	179.2	0	0	0	0	109.5	P99	P99-V107 HydrophobicContact CB-CG1 3.73Å
108	E	94.9	Very high	94.3	Very high	68 Å²	68	41 Å²	41	32%	0.318	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	142.9	173.8	-168.8	179.4	-172	0	0	110.3	P99 V100 L102 I110 Y187	P99-E108 CarbonylContact C-O 3.57Å; P99-E108 VanDerWaalsContact CA-O 3.32Å; P99-E108 WeakPolarHBondContact CA-O 3.44Å; V100-E108 PolarHBondContact N-O 2.9Å; V100-E108 PolarHBondContact O-N 3.36Å; L102-E108 HydrophobicContact CD1-CB 4.3Å; L102-E108 HydrophobicContact CD2-CB 4.27Å; L102-E108 HydrophobicContact CG-CB 4.31Å; E108-I110 HydrophobicContact CG-CG1 4.31Å; E108-Y187 PolarHBondContact OE1-OH 3.05Å; E108-Y187 WeakPolarHBondContact OE2-CE1 3.46Å; E108-Y187 PolarHBondContact OE2-OH 3.42Å
109	V	95.8	Very high	94.2	Very high	92 Å²	92	46 Å²	46	56%	0.558	26%	0.263	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.9	114.7	172.3	179.6	0	0	0	0	109
110	I	93.9	Very high	93.9	Very high	2 Å²	2	48.4 Å²	48.4	1%	0.01	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	126.3	-174.9	-69.2	166.3	0	0	0	110.1	S97 F98 V100 E108 V180 I182 I195	S97-I110 WeakPolarHBondContact CA-O 3.3Å; F98-I110 HydrophobicContact CE1-CG2 4.49Å; F98-I110 HydrophobicContact CE2-CB 4.24Å; F98-I110 HydrophobicContact CE2-CG2 4.39Å; F98-I110 HydrophobicContact CZ-CB 4.33Å; F98-I110 HydrophobicContact CZ-CG2 4.03Å; F98-I110 PolarHBondContact N-O 2.78Å; F98-I110 PolarHBondContact O-N 3.07Å; V100-I110 HydrophobicContact CB-CD1 4.31Å; V100-I110 HydrophobicContact CG2-CD1 4.12Å; E108-I110 HydrophobicContact CG-CG1 4.31Å; I110-V180 HydrophobicContact CG2-CG1 3.31Å; I110-I182 HydrophobicContact CD1-CG2 4.09Å; I110-I182 HydrophobicContact CG1-CG2 4.08Å; I110-I182 HydrophobicContact CG2-CG2 3.92Å; I110-I195 HydrophobicContact CD1-CD1 3.58Å; I110-I195 HydrophobicContact CD1-CG1 3.55Å; I110-I195 HydrophobicContact CD1-CG2 4.18Å
111	D	94.5	Very high	93.7	Very high	41 Å²	41	51.2 Å²	51.2	22%	0.219	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	138.8	173.4	-81.5	-30.7	0	0	0	112.2	S97 W113 V180 R181	S97-D111 WeakPolarHBondContact CB-OD1 3.39Å; S97-D111 PolarHBondContact OG-OD1 3.16Å; D111-W113 HydrophobicContact CB-CH2 3.43Å; D111-W113 VanDerWaalsContact CB-CH2 3.43Å; D111-W113 HydrophobicContact CB-CZ2 4.09Å; D111-W113 HydrophobicContact CB-CZ3 3.95Å; D111-V180 WeakPolarHBondContact O-CA 3.17Å; D111-R181 HydrophobicContact CB-CB 4.42Å; D111-R181 PolarHBondContact O-N 2.92Å; D111-R181 IonicContact OD2-NH1 2.93Å; D111-R181 PolarHBondContact OD2-NH1 3Å
112	S	93.6	Very high	93.4	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	153.9	172.7	68.6	0	0	0	0	112.5	Q95 V96 G179 L199	Q95-S112 CarbonylContact C-O 3.49Å; Q95-S112 VanDerWaalsContact CA-O 3.29Å; Q95-S112 WeakPolarHBondContact CA-O 3.17Å; V96-S112 PolarHBondContact N-O 3.46Å; V96-S112 PolarHBondContact O-N 3.45Å; V96-S112 PolarHBondContact O-OG 2.98Å; S112-G179 CarbonylContact C-O 3.55Å; S112-G179 VanDerWaalsContact CA-O 3.25Å; S112-G179 WeakPolarHBondContact CA-O 3.36Å; S112-G179 WeakPolarHBondContact CB-O 3.21Å; S112-L199 VanDerWaalsContact CB-CD1 3.47Å; S112-L199 WeakPolarHBondContact OG-CD1 3.21Å
113	W	94.6	Very high	93.4	Very high	9 Å²	9	51 Å²	51	3%	0.034	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	145.7	172.1	-59.8	-93.2	0	0	0	111.1	V94 Q95 D111 V150 V155 G178 G179 R181 W203	V94-W113 CarbonylContact O-C 3.41Å; V94-W113 VanDerWaalsContact O-CA 3.25Å; V94-W113 WeakPolarHBondContact O-CA 3.04Å; Q95-W113 HydrophobicContact CG-CZ2 4.25Å; D111-W113 HydrophobicContact CB-CH2 3.43Å; D111-W113 VanDerWaalsContact CB-CH2 3.43Å; D111-W113 HydrophobicContact CB-CZ2 4.09Å; D111-W113 HydrophobicContact CB-CZ3 3.95Å; W113-V150 HydrophobicContact CE3-CG1 3.66Å; W113-V150 HydrophobicContact CZ3-CG1 3.88Å; W113-V155 HydrophobicContact CB-CG1 4.29Å; W113-V155 HydrophobicContact CB-CG2 4.44Å; W113-G178 CarbonylContact O-C 3.55Å; W113-G178 WeakPolarHBondContact O-CA 3.41Å; W113-G179 PolarHBondContact N-O 2.99Å; W113-G179 PolarHBondContact O-N 3.46Å; W113-R181 HydrophobicContact CH2-CB 4.44Å; W113-R181 HydrophobicContact CZ3-CB 4.07Å; W113-W203 WeakPolarHBondContact O-CZ2 3.14Å
114	R	94.2	Very high	93.2	Very high	0 Å²	0	47 Å²	47	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	126.7	161.5	-171.2	84.5	178.7	168.2	0.5	108.7	I93 V94 K177 W203 F208 D214	I93-R114 WeakPolarHBondContact CA-O 3.42Å; V94-R114 HydrophobicContact CG1-CB 3.88Å; V94-R114 PolarHBondContact N-O 3.48Å; V94-R114 PolarHBondContact O-N 2.9Å; R114-K177 CarbonylContact C-O 3.6Å; R114-K177 WeakPolarHBondContact CA-O 3.45Å; R114-K177 WeakPolarHBondContact CD-O 3.49Å; R114-W203 HydrophobicContact CB-CD2 4.22Å; R114-W203 HydrophobicContact CB-CH2 4.46Å; R114-W203 HydrophobicContact CB-CZ2 4.02Å; R114-F208 HydrophobicContact CB-CB 4.35Å; R114-F208 HydrophobicContact CB-CD1 3.82Å; R114-F208 HydrophobicContact CB-CE1 4.47Å; R114-F208 HydrophobicContact CB-CG 4.3Å; R114-F208 HydrophobicContact CG-CB 4.05Å; R114-F208 HydrophobicContact CG-CD1 3.51Å; R114-F208 HydrophobicContact CG-CE1 4.38Å; R114-F208 HydrophobicContact CG-CG 4.16Å; R114-D214 IonicContact CZ-OD1 3.95Å; R114-D214 IonicContact CZ-OD2 2.6Å; R114-D214 IonicContact NE-OD1 2.9Å; R114-D214 IonicContact NE-OD2 2.94Å; R114-D214 PolarHBondContact NE-OD2 2.84Å; R114-D214 IonicContact NH2-OD1 3.19Å; R114-D214 PolarHBondContact NH2-OD1 2.89Å; R114-D214 IonicContact NH2-OD2 3.14Å
115	C	94.2	Very high	92.9	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	128.9	174	-174.4	0	0	0	0	109.5	P90 I93 V155 A159 A176 K177	P90-C115 WeakPolarHBondContact CB-SG 3.41Å; I93-C115 HydrophobicContact CB-CB 4.43Å; I93-C115 HydrophobicContact CD1-CB 4.43Å; I93-C115 HydrophobicContact CG1-CB 4.26Å; C115-V155 HydrophobicContact CB-CG1 3.74Å; C115-A159 HydrophobicContact CB-CB 3.95Å; C115-A176 CarbonylContact O-C 3.22Å; C115-A176 WeakPolarHBondContact O-CA 3.39Å; C115-A176 VanDerWaalsContact O-CB 3.31Å; C115-A176 WeakPolarHBondContact O-CB 3.49Å; C115-K177 PolarHBondContact N-O 3.04Å; C115-K177 PolarHBondContact O-N 2.92Å
116	Q	94.7	Very high	91.3	Very high	5 Å²	5	40.7 Å²	40.7	2%	0.023	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	111.5	166	-73	173	4.8	0	0	106.8	D91 S92 R119 C124 A176 F208 D214	D91-Q116 PolarHBondContact N-O 3.23Å; D91-Q116 VanDerWaalsContact N-O 3.12Å; S92-Q116 PolarHBondContact N-O 3.45Å; S92-Q116 VanDerWaalsContact N-O 3.11Å; S92-Q116 PolarHBondContact O-N 3.42Å; Q116-R119 VanDerWaalsContact OE1-CZ 3.23Å; Q116-C124 HydrophobicContact CG-CB 4.14Å; Q116-A176 HydrophobicContact CG-CB 4.2Å; Q116-F208 HydrophobicContact CB-CE1 4.24Å; Q116-F208 HydrophobicContact CG-CD1 3.78Å; Q116-F208 HydrophobicContact CG-CE1 3.76Å; Q116-F208 VanDerWaalsContact NE2-CD1 3.27Å; Q116-D214 WeakPolarHBondContact CG-OD2 3.36Å; Q116-D214 VanDerWaalsContact NE2-CB 3.33Å; Q116-D214 PolarHBondContact NE2-OD2 3.15Å
117	H	93.5	Very high	89	Confident	4 Å²	4	34.2 Å²	34.2	2%	0.019	18%	0.176	C	C	.	.			trans	-78.8	-45.9	-174.1	176.2	-100.7	0	0	0	112.3	M87 P90 D91 A159 S160 T163 G175	M87-H117 PolarHBondContact O-CE1 2.89Å; M87-H117 PolarHBondContact O-NE2 3.44Å; P90-H117 CarbonylContact C-O 3.15Å; P90-H117 VanDerWaalsContact CA-O 3.31Å; P90-H117 WeakPolarHBondContact CA-O 3.41Å; P90-H117 HydrophobicContact CB-CB 4.44Å; D91-H117 PolarHBondContact N-O 2.74Å; H117-A159 HydrophobicContact CB-CB 3.9Å; H117-A159 WeakPolarHBondContact CB-O 3.4Å; H117-S160 WeakPolarHBondContact CD2-CB 3.47Å; H117-S160 VanDerWaalsContact CG-CA 3.45Å; H117-S160 VanDerWaalsContact NE2-CB 3.31Å; H117-S160 WeakPolarHBondContact NE2-CB 3.49Å; H117-T163 WeakPolarHBondContact ND1-CB 3.44Å; H117-T163 PolarHBondContact ND1-OG1 2.81Å; H117-G175 PolarHBondContact N-O 3.18Å
118	S	92.6	Very high	86	Confident	22 Å²	22	30 Å²	30	15%	0.154	15%	0.15	C	C	.	.			trans	-147.1	134.8	177.9	-177.9	0	0	0	0	110.7	D91 Y120 G174	D91-S118 WeakPolarHBondContact OD2-CA 3.33Å; S118-Y120 VanDerWaalsContact OG-CD1 3.25Å; S118-Y120 WeakPolarHBondContact OG-CD1 3.32Å; S118-Y120 PolarHBondContact OG-N 3.39Å; S118-G174 WeakPolarHBondContact O-CA 3.47Å
119	R	91.4	Very high	82.9	Confident	107 Å²	107	28.2 Å²	28.2	40%	0.404	14%	0.14	S	C	.	.			trans	-102	14.9	174.4	-61	-178.5	-178.7	110	-2.9	113.3	D91 S92 Q116 L121	D91-R119 WeakPolarHBondContact OD2-CB 3.36Å; D91-R119 WeakPolarHBondContact OD2-CG 3.38Å; D91-R119 PolarHBondContact OD2-N 3.14Å; S92-R119 PolarHBondContact OG-NH2 3.39Å; Q116-R119 VanDerWaalsContact OE1-CZ 3.23Å; R119-L121 PolarHBondContact O-N 3.42Å; R119-L121 VanDerWaalsContact O-N 3.1Å
120	Y	90	Very high	79.8	Confident	113 Å²	113	26.5 Å²	26.5	44%	0.443	12%	0.124	S	C	.	.	S	Bend	trans	-55.1	-28.2	178	84.4	-65.2	0	0	0	113.1	S118 T163	S118-Y120 VanDerWaalsContact OG-CD1 3.25Å; S118-Y120 WeakPolarHBondContact OG-CD1 3.32Å; S118-Y120 PolarHBondContact OG-N 3.39Å; Y120-T163 HydrophobicContact CD1-CG2 4.42Å; Y120-T163 HydrophobicContact CE1-CG2 3.92Å
121	L	89.9	Confident	76.7	Confident	68 Å²	68	31.7 Å²	31.7	36%	0.356	14%	0.143	S	C	.	.	S	Bend	trans	-130.8	144.4	165.4	-65.4	174.5	0	0	0	108.6	R119 P172 G174	R119-L121 PolarHBondContact O-N 3.42Å; R119-L121 VanDerWaalsContact O-N 3.1Å; L121-P172 HydrophobicContact CD1-CB 4.29Å; L121-G174 WeakPolarHBondContact O-CA 3.48Å; L121-G174 PolarHBondContact O-N 3.44Å
122	T	89.3	Confident	73.6	Confident	90 Å²	90	34.2 Å²	34.2	55%	0.552	15%	0.152	S	C	*	.	S	Bend	trans	-125.4	140.9	-178	51.8	0	0	0	0	110.4
123	P	93.8	Very high	70.6	Confident	3 Å²	3	41.3 Å²	41.3	2%	0.019	20%	0.195	C	C	.	.	S	Bend	cis	-73.7	159.6	4.9	31.7	-38.2	0	0	0	113.4	F173 G174 P211 R213 V215 W437	P123-F173 HydrophobicContact CG-CD1 3.72Å; P123-F173 HydrophobicContact CG-CE1 3.54Å; P123-F173 WeakPolarHBondContact O-CA 3.37Å; P123-F173 WeakPolarHBondContact O-CD1 3.17Å; P123-G174 PolarHBondContact O-N 3.38Å; P123-P211 WeakPolarHBondContact CG-O 3.5Å; P123-R213 WeakPolarHBondContact CA-O 3.44Å; P123-V215 HydrophobicContact CB-CG2 3.83Å; P123-V215 HydrophobicContact CG-CG2 3.82Å; P123-W437 HydrophobicContact CG-CZ2 4.01Å
124	C	91.3	Very high	67.6	Low	1 Å²	1	42.5 Å²	42.5	1%	0.007	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	150.9	160.4	-62.3	0	0	0	0	110	Q116 G174 A176 R213 D214 V215	Q116-C124 HydrophobicContact CG-CB 4.14Å; C124-G174 CarbonylContact C-O 3.39Å; C124-G174 WeakPolarHBondContact CA-O 3.43Å; C124-A176 HydrophobicContact CB-CB 3.8Å; C124-R213 PolarHBondContact N-O 2.84Å; C124-D214 HydrophobicContact CB-CB 4.23Å; C124-D214 CarbonylContact O-C 3.51Å; C124-D214 WeakPolarHBondContact O-CA 3.33Å; C124-V215 PolarHBondContact O-N 2.88Å
125	K	86.7	Confident	64.8	Low	0 Å²	0	52.4 Å²	52.4	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	128.3	-176.7	-166.5	79.7	-166.2	73.7	0	111.1	M162 F173 G174 A176 V215 P216 T250 V430	K125-M162 HydrophobicContact CG-CE 4.43Å; K125-M162 WeakPolarHBondContact O-CE 3.37Å; K125-F173 HydrophobicContact CB-CB 3.58Å; K125-F173 HydrophobicContact CB-CD1 4.49Å; K125-F173 HydrophobicContact CB-CD2 3.49Å; K125-F173 VanDerWaalsContact CB-CD2 3.49Å; K125-F173 HydrophobicContact CB-CE2 4.25Å; K125-F173 HydrophobicContact CB-CG 3.64Å; K125-F173 HydrophobicContact CD-CD2 3.7Å; K125-F173 HydrophobicContact CD-CE2 3.55Å; K125-F173 HydrophobicContact CD-CG 4.35Å; K125-F173 HydrophobicContact CD-CZ 4.06Å; K125-F173 HydrophobicContact CG-CD2 3.51Å; K125-F173 HydrophobicContact CG-CE2 3.86Å; K125-F173 HydrophobicContact CG-CG 4.18Å; K125-G174 PolarHBondContact N-O 3.3Å; K125-A176 PolarHBondContact O-N 2.79Å; K125-V215 HydrophobicContact CD-CB 3.99Å; K125-V215 HydrophobicContact CD-CG1 4.04Å; K125-V215 WeakPolarHBondContact CD-O 3.27Å; K125-V215 WeakPolarHBondContact CE-O 3.18Å; K125-V215 PolarHBondContact NZ-O 2.86Å; K125-P216 PolarHBondContact NZ-O 3.45Å; K125-T250 WeakPolarHBondContact CE-OG1 3.32Å; K125-T250 PolarHBondContact NZ-OG1 2.92Å; K125-V430 HydrophobicContact CG-CG2 4.21Å
126	G	58.8	Low	61.9	Low	0 Å²	0	53.2 Å²	53.2	0%	0	25%	0.252	C	S	.	.			trans	-135.3	123.9	160.9	0	0	0	0	0	109.9	V142 A176 P216 A217	G126-V142 CarbonylContact C-O 3.25Å; G126-V142 WeakPolarHBondContact CA-O 3.49Å; G126-A176 WeakPolarHBondContact CA-O 3.43Å; G126-P216 CarbonylContact O-C 3.24Å; G126-P216 VanDerWaalsContact O-CA 3.22Å; G126-P216 WeakPolarHBondContact O-CA 3.26Å; G126-A217 PolarHBondContact O-N 2.84Å
127	G	47.3	Very low	58.9	Low	1 Å²	1	53.8 Å²	53.8	1%	0.01	26%	0.257	C	S	.	.			trans	162.5	145.3	155.8	0	0	0	0	0	119.7	V142 R262	G127-V142 VanDerWaalsContact CA-C 3.43Å; G127-V142 WeakPolarHBondContact CA-O 3.49Å; G127-V142 PolarHBondContact N-O 3.4Å; G127-R262 PolarHBondContact O-NH2 2.8Å
128	K	31.1	Very low	56	Low	4 Å²	4	54 Å²	54	2%	0.017	26%	0.258	C	S	.	.			trans	-150.5	128.2	179.3	-94.7	-172.3	-177.3	-176.5	0	109.7	F141 V142 P218 D219 T266 N426	K128-F141 WeakPolarHBondContact O-CD1 3.16Å; K128-V142 HydrophobicContact CB-CG2 4.22Å; K128-V142 HydrophobicContact CD-CG2 3.83Å; K128-V142 HydrophobicContact CG-CG2 4.03Å; K128-P218 CarbonylContact C-O 3.45Å; K128-P218 VanDerWaalsContact C-O 3.25Å; K128-P218 PolarHBondContact N-O 2.98Å; K128-P218 CarbonylContact O-C 3.55Å; K128-D219 WeakPolarHBondContact O-CA 3.12Å; K128-D219 PolarHBondContact O-N 3.03Å; K128-T266 HydrophobicContact CD-CG2 4.4Å; K128-N426 WeakPolarHBondContact CE-O 3.4Å; K128-N426 VanDerWaalsContact NZ-CB 3.3Å; K128-N426 PolarHBondContact NZ-O 3.11Å; K128-N426 PolarHBondContact NZ-OD1 2.89Å
129	R	29.7	Very low	53.3	Low	31 Å²	31	57.4 Å²	57.4	12%	0.117	27%	0.268	C	S	.	.			trans	-78.7	129.4	-165.9	178.1	173.7	163.5	163	3.1	115.4	P218 E224	R129-P218 HydrophobicContact CB-CB 4.47Å; R129-P218 HydrophobicContact CB-CG 3.85Å; R129-P218 HydrophobicContact CG-CG 4.03Å; R129-E224 VanDerWaalsContact CZ-CG 3.44Å; R129-E224 IonicContact CZ-OE1 3.15Å; R129-E224 IonicContact CZ-OE2 2.81Å; R129-E224 IonicContact NH1-OE1 2.73Å; R129-E224 PolarHBondContact NH1-OE1 3.29Å; R129-E224 IonicContact NH1-OE2 3.82Å; R129-E224 IonicContact NH2-OE1 2.7Å; R129-E224 PolarHBondContact NH2-OE1 3.3Å; R129-E224 IonicContact NH2-OE2 3.73Å; R129-E224 PolarHBondContact NH2-OE2 2.91Å
130	R	30.5	Very low	50.3	Low	56 Å²	56	52.5 Å²	52.5	21%	0.211	25%	0.25	C	C	.	.			trans	-91.2	149.3	154.4	-163.2	170.1	-177.7	-174.9	-3.2	110	D136 F141 D219	R130-D136 PolarHBondContact NH2-O 3.2Å; R130-F141 HydrophobicContact CB-CD1 4.28Å; R130-F141 HydrophobicContact CB-CE1 3.51Å; R130-F141 HydrophobicContact CB-CE2 4.24Å; R130-F141 HydrophobicContact CB-CZ 3.49Å; R130-F141 VanDerWaalsContact CB-CZ 3.49Å; R130-F141 HydrophobicContact CG-CE1 4.07Å; R130-F141 HydrophobicContact CG-CE2 4.3Å; R130-F141 HydrophobicContact CG-CZ 3.56Å; R130-D219 VanDerWaalsContact CB-O 3.26Å; R130-D219 WeakPolarHBondContact CB-O 3.47Å
131	W	28.8	Very low	47.6	Very low	110 Å²	110	47.3 Å²	47.3	42%	0.417	23%	0.229	S	C	.	.			trans	-163.2	114	165.3	-110.6	93.1	0	0	0	107	E224 N305	W131-E224 HydrophobicContact CZ2-CB 4.04Å; W131-E224 VanDerWaalsContact NE1-N 3.11Å; W131-E224 PolarHBondContact NE1-OE2 3.37Å; W131-N305 PolarHBondContact N-ND2 2.84Å; W131-N305 PolarHBondContact O-ND2 2.94Å; W131-N305 PolarHBondContact O-OD1 3.45Å
132	F	29.7	Very low	45.1	Very low	95 Å²	95	44.1 Å²	44.1	42%	0.417	21%	0.213	S	C	.	.			trans	-171.2	132.8	155.9	-102.8	-63	0	0	0	107.6	G134 L343 Q347	F132-G134 PolarHBondContact O-N 3.05Å; F132-L343 HydrophobicContact CZ-CD1 4.25Å; F132-Q347 HydrophobicContact CE1-CG 3.72Å; F132-Q347 HydrophobicContact CZ-CG 4.06Å
133	V	30	Very low	43.7	Very low	148 Å²	148	39.8 Å²	39.8	90%	0.897	19%	0.186	S	C	*	.	S	Bend	trans	-88.8	85	165.8	-178.9	0	0	0	0	105.9
134	G	32.5	Very low	43	Very low	35 Å²	35	39.8 Å²	39.8	36%	0.361	19%	0.186	S	C	.	.	S	Bend	trans	-177.8	155.3	-172.3	0	0	0	0	0	108.9	F132 D136	F132-G134 PolarHBondContact O-N 3.05Å; G134-D136 PolarHBondContact O-N 3.31Å; G134-D136 VanDerWaalsContact O-N 3.11Å
135	R	33.8	Very low	42.7	Very low	207 Å²	207	39.8 Å²	39.8	78%	0.781	19%	0.186	S	C	*	.	S	Bend	trans	-71.2	-8.4	-164.8	-80.4	-176.5	169.4	-178	-2.6	115.1	Y327	R135-Y327 WeakPolarHBondContact CB-OH 3.26Å
136	D	35.3	Very low	42.7	Very low	17 Å²	17	40 Å²	40	9%	0.091	19%	0.186	C	C	.	.			trans	-89.2	140.6	-154.2	-48	-46.9	0	0	0	116.5	R130 G134 Y327 K346	R130-D136 PolarHBondContact NH2-O 3.2Å; G134-D136 PolarHBondContact O-N 3.31Å; G134-D136 VanDerWaalsContact O-N 3.11Å; D136-Y327 HydrophobicContact CB-CE1 3.86Å; D136-Y327 WeakPolarHBondContact OD1-CE1 3.48Å; D136-Y327 PolarHBondContact OD1-OH 3.36Å; D136-K346 VanDerWaalsContact CB-CE 3.42Å; D136-K346 WeakPolarHBondContact OD2-CE 3.1Å; D136-K346 IonicContact OD2-NZ 3.64Å
137	S	31.5	Very low	44	Very low	17 Å²	17	40.2 Å²	40.2	12%	0.119	19%	0.189	C	C	.	.			trans	-117.6	59.8	-156	68	0	0	0	0	115.3	R139 Y327	S137-R139 WeakPolarHBondContact O-CG 3.42Å; S137-R139 PolarHBondContact O-N 3.34Å; S137-Y327 WeakPolarHBondContact OG-CD1 3.19Å
138	T	30.9	Very low	46	Very low	8 Å²	8	44 Å²	44	5%	0.049	21%	0.213	C	C	.	.			trans	-69.1	121.6	154	43.2	0	0	0	0	110	F141 G302 G304	T138-F141 WeakPolarHBondContact O-CE2 3.49Å; T138-F141 WeakPolarHBondContact O-CZ 3.35Å; T138-G302 VanDerWaalsContact CG2-O 3.3Å; T138-G302 WeakPolarHBondContact CG2-O 3.49Å; T138-G304 WeakPolarHBondContact OG1-CA 3.34Å
139	R	36.3	Very low	48.6	Very low	94 Å²	94	47.9 Å²	47.9	36%	0.355	23%	0.234	S	C	.	.			trans	-106.3	33.9	-167.5	-61	-165.2	-172.5	172.2	-2.3	114.6	S137 R145 M220 A378 T379	S137-R139 WeakPolarHBondContact O-CG 3.42Å; S137-R139 PolarHBondContact O-N 3.34Å; R139-R145 PolarHBondContact O-NH2 2.82Å; R139-M220 HydrophobicContact CB-CE 3.7Å; R139-M220 HydrophobicContact CB-SD 4.27Å; R139-M220 HydrophobicContact CG-CE 3.9Å; R139-M220 HydrophobicContact CG-SD 3.87Å; R139-A378 CarbonylContact C-O 3.43Å; R139-A378 WeakPolarHBondContact CA-O 3.25Å; R139-A378 WeakPolarHBondContact CB-O 3.48Å; R139-A378 PolarHBondContact N-O 3.14Å; R139-T379 HydrophobicContact CB-CG2 4.02Å; R139-T379 HydrophobicContact CG-CG2 3.89Å
140	L	29.1	Very low	51.3	Low	4 Å²	4	46.4 Å²	46.4	2%	0.021	23%	0.228	C	C	.	.			trans	-109.2	107.1	-175.6	-144.6	83.8	0	0	0	122.2	A399 A400 N401	L140-A399 WeakPolarHBondContact CD2-O 3.26Å; L140-A400 HydrophobicContact CD1-CB 3.85Å; L140-A400 VanDerWaalsContact CD2-C 3.41Å; L140-N401 HydrophobicContact CD1-CB 3.7Å; L140-N401 HydrophobicContact CD2-CB 4.26Å; L140-N401 VanDerWaalsContact CD2-CG 3.47Å; L140-N401 VanDerWaalsContact CD2-OD1 3.27Å; L140-N401 WeakPolarHBondContact CD2-OD1 3.38Å; L140-N401 HydrophobicContact CG-CB 4.27Å
141	F	33.4	Very low	54.1	Low	5 Å²	5	46.7 Å²	46.7	2%	0.022	24%	0.236	C	C	.	.			trans	-158.3	148	-156.8	-56.7	-54.1	0	0	0	111.1	K128 R130 T138 K177 D219 M220	K128-F141 WeakPolarHBondContact O-CD1 3.16Å; R130-F141 HydrophobicContact CB-CD1 4.28Å; R130-F141 HydrophobicContact CB-CE1 3.51Å; R130-F141 HydrophobicContact CB-CE2 4.24Å; R130-F141 HydrophobicContact CB-CZ 3.49Å; R130-F141 VanDerWaalsContact CB-CZ 3.49Å; R130-F141 HydrophobicContact CG-CE1 4.07Å; R130-F141 HydrophobicContact CG-CE2 4.3Å; R130-F141 HydrophobicContact CG-CZ 3.56Å; T138-F141 WeakPolarHBondContact O-CE2 3.49Å; T138-F141 WeakPolarHBondContact O-CZ 3.35Å; F141-K177 PolarHBondContact O-NZ 3.31Å; F141-D219 HydrophobicContact CB-CB 3.88Å; F141-D219 WeakPolarHBondContact CB-OD1 3.33Å; F141-D219 WeakPolarHBondContact CB-OD2 3.47Å; F141-D219 VanDerWaalsContact CG-C 3.48Å; F141-M220 VanDerWaalsContact CD2-CA 3.48Å; F141-M220 HydrophobicContact CD2-CB 3.52Å; F141-M220 HydrophobicContact CD2-CG 3.92Å; F141-M220 HydrophobicContact CE2-CB 3.92Å; F141-M220 HydrophobicContact CE2-CG 3.83Å; F141-M220 HydrophobicContact CG-CB 4.41Å
142	V	38.3	Very low	57	Low	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.231	C	C	.	.			trans	-139.8	28.8	-177.2	-126.1	0	0	0	0	115.1	G126 G127 K128 L158 M162 K177 D219	G126-V142 CarbonylContact C-O 3.25Å; G126-V142 WeakPolarHBondContact CA-O 3.49Å; G127-V142 VanDerWaalsContact CA-C 3.43Å; G127-V142 WeakPolarHBondContact CA-O 3.49Å; G127-V142 PolarHBondContact N-O 3.4Å; K128-V142 HydrophobicContact CB-CG2 4.22Å; K128-V142 HydrophobicContact CD-CG2 3.83Å; K128-V142 HydrophobicContact CG-CG2 4.03Å; V142-L158 HydrophobicContact CG1-CB 3.97Å; V142-L158 HydrophobicContact CG1-CD2 4.02Å; V142-M162 HydrophobicContact CB-CG 3.83Å; V142-M162 HydrophobicContact CB-SD 3.54Å; V142-M162 VanDerWaalsContact CB-SD 3.54Å; V142-M162 HydrophobicContact CG1-CG 3.39Å; V142-M162 HydrophobicContact CG1-SD 3.66Å; V142-M162 HydrophobicContact CG2-SD 3.72Å; V142-K177 VanDerWaalsContact C-CD 3.43Å; V142-K177 HydrophobicContact CG1-CD 4.26Å; V142-D219 VanDerWaalsContact CA-OD2 3.3Å; V142-D219 WeakPolarHBondContact CA-OD2 3.49Å; V142-D219 PolarHBondContact N-OD2 2.93Å
143	G	58.6	Low	59.9	Low	0 Å²	0	41 Å²	41	0%	0	22%	0.222	C	C	.	.	S	Bend	trans	-116.8	-121	-169.3	0	0	0	0	0	114.5	K177 G178 A217 P218 D219	G143-K177 WeakPolarHBondContact O-CD 3.38Å; G143-G178 CarbonylContact O-C 3.38Å; G143-G178 PolarHBondContact O-N 3.4Å; G143-A217 VanDerWaalsContact CA-O 3.26Å; G143-A217 WeakPolarHBondContact CA-O 3.49Å; G143-P218 WeakPolarHBondContact CA-O 3.43Å; G143-D219 PolarHBondContact N-OD2 3.34Å
144	I	80.4	Confident	62.5	Low	2 Å²	2	34.6 Å²	34.6	1%	0.01	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	97.9	173.5	-53.4	-177.9	0	0	0	109.3	F146 V180 L199 W203 P216 A217 D219 T222 M227 I230	I144-F146 HydrophobicContact CG2-CD1 4.02Å; I144-F146 HydrophobicContact CG2-CE1 3.59Å; I144-V180 HydrophobicContact CG2-CG2 4.32Å; I144-L199 HydrophobicContact CG2-CD2 3.88Å; I144-W203 HydrophobicContact CB-CH2 4.45Å; I144-W203 HydrophobicContact CD1-CE3 4.44Å; I144-W203 HydrophobicContact CD1-CH2 4.11Å; I144-W203 HydrophobicContact CD1-CZ3 3.51Å; I144-W203 HydrophobicContact CG1-CH2 3.9Å; I144-W203 HydrophobicContact CG1-CZ3 3.65Å; I144-W203 HydrophobicContact CG2-CH2 3.98Å; I144-W203 HydrophobicContact CG2-CZ3 4.44Å; I144-P216 HydrophobicContact CD1-CB 3.75Å; I144-P216 HydrophobicContact CD1-CG 4.22Å; I144-P216 HydrophobicContact CG1-CB 3.84Å; I144-A217 PolarHBondContact N-O 2.94Å; I144-A217 VanDerWaalsContact N-O 3.15Å; I144-D219 WeakPolarHBondContact O-CB 3.18Å; I144-T222 WeakPolarHBondContact O-CG2 3.49Å; I144-T222 PolarHBondContact O-OG1 3.46Å; I144-M227 HydrophobicContact CD1-CE 4.36Å; I144-I230 HydrophobicContact CD1-CD1 3.32Å
145	R	83.2	Confident	65.2	Low	2 Å²	2	32.9 Å²	32.9	1%	0.008	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	122.2	179.5	-174.5	164.1	-76.9	-160	-11.3	111.1	R139 A147 V150 E154 G178 G179 V180 D219 M220	R139-R145 PolarHBondContact O-NH2 2.82Å; R145-A147 HydrophobicContact CG-CB 4.02Å; R145-V150 HydrophobicContact CB-CG2 4.15Å; R145-V150 HydrophobicContact CG-CG2 3.76Å; R145-E154 VanDerWaalsContact CD-OE1 3.26Å; R145-E154 WeakPolarHBondContact CD-OE1 3.09Å; R145-E154 IonicContact CZ-OE1 2.65Å; R145-E154 VanDerWaalsContact CZ-OE1 3.22Å; R145-E154 IonicContact NE-OE1 3.68Å; R145-E154 PolarHBondContact NE-OE1 2.82Å; R145-E154 IonicContact NH1-OE1 2.9Å; R145-E154 PolarHBondContact NH1-OE1 3.32Å; R145-E154 IonicContact NH1-OE2 2.64Å; R145-G178 PolarHBondContact N-O 3.25Å; R145-G179 CarbonylContact O-C 3.08Å; R145-G179 WeakPolarHBondContact O-CA 3.31Å; R145-V180 PolarHBondContact O-N 2.9Å; R145-D219 HydrophobicContact CB-CB 4.24Å; R145-D219 VanDerWaalsContact CB-OD1 3.26Å; R145-D219 WeakPolarHBondContact CB-OD1 3.14Å; R145-D219 WeakPolarHBondContact CG-OD1 3.37Å; R145-D219 IonicContact CZ-OD1 3.22Å; R145-D219 IonicContact NE-OD1 2.74Å; R145-D219 PolarHBondContact NE-OD1 3.33Å; R145-D219 IonicContact NH2-OD1 2.8Å; R145-M220 HydrophobicContact CG-CB 4.16Å; R145-M220 VanDerWaalsContact CZ-CE 3.4Å
146	F	87.8	Confident	68	Low	3 Å²	3	25.5 Å²	25.5	1%	0.013	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	101.8	165	-71.5	4.4	0	0	0	107.1	I144 V180 I182 P184 L192 T196 L199 M220 T222 E226	I144-F146 HydrophobicContact CG2-CD1 4.02Å; I144-F146 HydrophobicContact CG2-CE1 3.59Å; F146-V180 HydrophobicContact CD1-CB 3.69Å; F146-V180 HydrophobicContact CD1-CG2 3.77Å; F146-V180 HydrophobicContact CE1-CB 3.87Å; F146-V180 HydrophobicContact CE1-CG2 3.5Å; F146-V180 VanDerWaalsContact CE1-CG2 3.5Å; F146-I182 CarbonylContact C-O 3.54Å; F146-I182 HydrophobicContact CB-CD1 4.24Å; F146-I182 HydrophobicContact CB-CG1 4.02Å; F146-I182 HydrophobicContact CD1-CD1 4.38Å; F146-I182 HydrophobicContact CD2-CD1 3.69Å; F146-I182 HydrophobicContact CD2-CG1 4.39Å; F146-I182 HydrophobicContact CE2-CD1 4.07Å; F146-I182 HydrophobicContact CG-CD1 3.86Å; F146-I182 HydrophobicContact CG-CG1 4.09Å; F146-P184 HydrophobicContact CB-CB 4.31Å; F146-P184 HydrophobicContact CB-CG 4.12Å; F146-P184 HydrophobicContact CD2-CB 4.37Å; F146-P184 WeakPolarHBondContact O-CD 3.49Å; F146-L192 HydrophobicContact CD2-CD2 4.25Å; F146-L192 HydrophobicContact CE2-CD2 4.27Å; F146-T196 WeakPolarHBondContact CZ-OG1 3.45Å; F146-L199 HydrophobicContact CE1-CD2 4.33Å; F146-M220 PolarHBondContact N-O 3.22Å; F146-T222 HydrophobicContact CB-CG2 4.16Å; F146-T222 HydrophobicContact CD1-CG2 3.58Å; F146-T222 HydrophobicContact CD2-CG2 3.55Å; F146-T222 HydrophobicContact CE1-CG2 3.76Å; F146-T222 HydrophobicContact CE2-CG2 3.75Å; F146-T222 HydrophobicContact CG-CG2 3.47Å; F146-T222 VanDerWaalsContact CG-CG2 3.47Å; F146-T222 HydrophobicContact CZ-CG2 3.85Å; F146-E226 HydrophobicContact CE2-CG 4.21Å
147	A	86.7	Confident	70.5	Confident	6 Å²	6	24.7 Å²	24.7	5%	0.05	13%	0.134	C	C	.	.			trans	-155.8	148.9	175	0	0	0	0	0	110.8	R145 D149 V150 V180 R181 I182	R145-A147 HydrophobicContact CG-CB 4.02Å; A147-D149 VanDerWaalsContact C-N 3.26Å; A147-D149 WeakPolarHBondContact CB-OD1 3.37Å; A147-D149 PolarHBondContact O-N 2.8Å; A147-V150 HydrophobicContact CB-CG2 4.17Å; A147-V150 VanDerWaalsContact O-CG2 3.27Å; A147-V150 WeakPolarHBondContact O-CG2 3.24Å; A147-V150 PolarHBondContact O-N 2.77Å; A147-V180 PolarHBondContact N-O 2.81Å; A147-R181 WeakPolarHBondContact O-CA 3.01Å; A147-I182 CarbonylContact C-O 3.54Å; A147-I182 WeakPolarHBondContact CA-O 3.34Å; A147-I182 PolarHBondContact N-O 3.16Å; A147-I182 PolarHBondContact O-N 3.19Å
148	P	88.4	Confident	73.1	Confident	80 Å²	80	24 Å²	24	52%	0.519	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-17.8	-176	30	-36.4	0	0	0	113.6	R181 D183	P148-R181 WeakPolarHBondContact O-CG 3.48Å; P148-D183 HydrophobicContact CG-CB 4.39Å
149	D	85.8	Confident	76	Confident	85 Å²	85	23.6 Å²	23.6	46%	0.455	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	1.6	179.2	57.9	-18.6	0	0	0	113.8	A147 T151	A147-D149 VanDerWaalsContact C-N 3.26Å; A147-D149 WeakPolarHBondContact CB-OD1 3.37Å; A147-D149 PolarHBondContact O-N 2.8Å; D149-T151 PolarHBondContact O-N 2.81Å
150	V	85.6	Confident	78.7	Confident	0 Å²	0	19.1 Å²	19.1	0%	0	11%	0.11	C	C	.	.			trans	-58.8	126.1	179.9	170.5	0	0	0	0	111.5	W113 R145 A147 V155 R181	W113-V150 HydrophobicContact CE3-CG1 3.66Å; W113-V150 HydrophobicContact CZ3-CG1 3.88Å; R145-V150 HydrophobicContact CB-CG2 4.15Å; R145-V150 HydrophobicContact CG-CG2 3.76Å; A147-V150 HydrophobicContact CB-CG2 4.17Å; A147-V150 VanDerWaalsContact O-CG2 3.27Å; A147-V150 WeakPolarHBondContact O-CG2 3.24Å; A147-V150 PolarHBondContact O-N 2.77Å; V150-V155 HydrophobicContact CG1-CG2 4.14Å; V150-R181 PolarHBondContact O-NE 2.84Å; V150-R181 PolarHBondContact O-NH2 2.77Å; V150-R181 VanDerWaalsContact O-NH2 3.07Å
151	T	89.7	Confident	81.5	Confident	62 Å²	62	19.6 Å²	19.6	38%	0.38	11%	0.112	S	C	.	.			trans	-127	158.7	175.1	62.3	0	0	0	0	112.1	D149 D153 E154 V155	D149-T151 PolarHBondContact O-N 2.81Å; T151-D153 PolarHBondContact O-N 3.2Å; T151-E154 PolarHBondContact OG1-N 3.36Å; T151-V155 WeakPolarHBondContact O-CG2 3.35Å; T151-V155 PolarHBondContact O-N 3.35Å
152	S	90.7	Very high	84.2	Confident	43 Å²	43	19.4 Å²	19.4	30%	0.301	11%	0.111	S	C	.	.	H	α-helix	trans	-63.1	-25.9	174.9	76.6	0	0	0	0	113.1	K156	S152-K156 WeakPolarHBondContact O-CD 3.47Å; S152-K156 WeakPolarHBondContact O-CG 3.24Å; S152-K156 PolarHBondContact O-N 3.49Å; S152-K156 VanDerWaalsContact O-N 3.15Å
153	D	89.8	Confident	86.8	Confident	44 Å²	44	20 Å²	20	24%	0.235	12%	0.115	C	C	.	.	H	α-helix	trans	-71	-51.3	179.4	-163.4	69	0	0	0	111.8	S43 Y44 F45 T151 V155 K156 A157	S43-D153 VanDerWaalsContact CB-OD2 3.27Å; S43-D153 WeakPolarHBondContact CB-OD2 3.32Å; S43-D153 PolarHBondContact OG-OD1 2.9Å; S43-D153 PolarHBondContact OG-OD2 3.39Å; Y44-D153 PolarHBondContact N-OD2 3.09Å; F45-D153 VanDerWaalsContact CB-CG 3.49Å; F45-D153 WeakPolarHBondContact CB-OD1 3.5Å; F45-D153 WeakPolarHBondContact CB-OD2 3.42Å; F45-D153 PolarHBondContact N-OD2 3.35Å; F45-D153 VanDerWaalsContact N-OD2 3.08Å; T151-D153 PolarHBondContact O-N 3.2Å; D153-V155 VanDerWaalsContact C-N 3.29Å; D153-V155 PolarHBondContact O-N 3.09Å; D153-K156 WeakPolarHBondContact O-CB 3.49Å; D153-K156 PolarHBondContact O-N 3.08Å; D153-K156 VanDerWaalsContact O-N 3.08Å; D153-A157 PolarHBondContact O-N 2.94Å
154	E	85.5	Confident	88.3	Confident	12 Å²	12	22.5 Å²	22.5	6%	0.056	13%	0.128	C	C	.	.	H	α-helix	trans	-56.7	-43.6	175.5	-171	-129.1	137.4	0	0	111.4	Y44 R145 T151 K156 A157 L158	Y44-E154 HydrophobicContact CD1-CG 4.04Å; R145-E154 VanDerWaalsContact CD-OE1 3.26Å; R145-E154 WeakPolarHBondContact CD-OE1 3.09Å; R145-E154 IonicContact CZ-OE1 2.65Å; R145-E154 VanDerWaalsContact CZ-OE1 3.22Å; R145-E154 IonicContact NE-OE1 3.68Å; R145-E154 PolarHBondContact NE-OE1 2.82Å; R145-E154 IonicContact NH1-OE1 2.9Å; R145-E154 PolarHBondContact NH1-OE1 3.32Å; R145-E154 IonicContact NH1-OE2 2.64Å; T151-E154 PolarHBondContact OG1-N 3.36Å; E154-K156 VanDerWaalsContact C-N 3.34Å; E154-K156 PolarHBondContact O-N 3.23Å; E154-A157 PolarHBondContact O-N 2.91Å; E154-L158 HydrophobicContact CG-CD1 3.88Å; E154-L158 WeakPolarHBondContact O-CD1 3.46Å; E154-L158 WeakPolarHBondContact O-CG 3.45Å; E154-L158 PolarHBondContact O-N 2.98Å; E154-L158 WeakPolarHBondContact OE1-CD1 3.41Å
155	V	89.5	Confident	88.9	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-66	-34	177.9	174.9	0	0	0	0	112	W113 C115 V150 T151 D153 A159 K177	W113-V155 HydrophobicContact CB-CG1 4.29Å; W113-V155 HydrophobicContact CB-CG2 4.44Å; C115-V155 HydrophobicContact CB-CG1 3.74Å; V150-V155 HydrophobicContact CG1-CG2 4.14Å; T151-V155 WeakPolarHBondContact O-CG2 3.35Å; T151-V155 PolarHBondContact O-N 3.35Å; D153-V155 VanDerWaalsContact C-N 3.29Å; D153-V155 PolarHBondContact O-N 3.09Å; V155-A159 WeakPolarHBondContact O-CB 3.28Å; V155-A159 PolarHBondContact O-N 3.18Å; V155-K177 HydrophobicContact CB-CG 4.41Å; V155-K177 HydrophobicContact CG1-CB 4.21Å; V155-K177 HydrophobicContact CG1-CG 4.05Å; V155-K177 WeakPolarHBondContact CG1-O 3.34Å; V155-K177 HydrophobicContact CG2-CG 4.47Å; V155-K177 WeakPolarHBondContact O-CB 3.26Å
156	K	91.8	Very high	89.3	Confident	52 Å²	52	22.3 Å²	22.3	23%	0.226	13%	0.127	C	C	.	.	H	α-helix	trans	-69	-45.9	172.6	-69.2	161	-172.8	165.1	0	112	F45 P90 I93 S152 D153 E154 L158 A159 S160	F45-K156 HydrophobicContact CD2-CB 3.53Å; F45-K156 HydrophobicContact CE2-CB 3.8Å; F45-K156 HydrophobicContact CG-CB 4.11Å; P90-K156 HydrophobicContact CG-CG 4.3Å; I93-K156 HydrophobicContact CD1-CG 4.16Å; S152-K156 WeakPolarHBondContact O-CD 3.47Å; S152-K156 WeakPolarHBondContact O-CG 3.24Å; S152-K156 PolarHBondContact O-N 3.49Å; S152-K156 VanDerWaalsContact O-N 3.15Å; D153-K156 WeakPolarHBondContact O-CB 3.49Å; D153-K156 PolarHBondContact O-N 3.08Å; D153-K156 VanDerWaalsContact O-N 3.08Å; E154-K156 VanDerWaalsContact C-N 3.34Å; E154-K156 PolarHBondContact O-N 3.23Å; K156-L158 PolarHBondContact O-N 3.39Å; K156-A159 PolarHBondContact O-N 2.89Å; K156-S160 PolarHBondContact O-N 3.26Å; K156-S160 PolarHBondContact O-OG 2.95Å
157	A	88.4	Confident	89.6	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-56.1	-49.9	179.3	0	0	0	0	0	111.5	Y44 F45 D153 E154 A159 S160 L161	Y44-A157 HydrophobicContact CD1-CB 3.76Å; Y44-A157 HydrophobicContact CD2-CB 4.21Å; Y44-A157 HydrophobicContact CE1-CB 4.23Å; Y44-A157 HydrophobicContact CG-CB 3.75Å; Y44-A157 WeakPolarHBondContact O-CB 3.35Å; F45-A157 HydrophobicContact CB-CB 4.34Å; F45-A157 HydrophobicContact CD2-CB 4.49Å; D153-A157 PolarHBondContact O-N 2.94Å; E154-A157 PolarHBondContact O-N 2.91Å; A157-A159 PolarHBondContact O-N 3.06Å; A157-S160 PolarHBondContact O-N 3.32Å; A157-S160 PolarHBondContact O-OG 3.25Å; A157-L161 WeakPolarHBondContact O-CG 3.47Å; A157-L161 PolarHBondContact O-N 3.48Å
158	L	86.3	Confident	89.8	Confident	2 Å²	2	28.2 Å²	28.2	1%	0.01	17%	0.165	C	C	.	.	H	α-helix	trans	-71.7	-29.3	-178.1	-71	158.7	0	0	0	112.7	Y44 V142 E154 K156 L161 M162 K177 N401	Y44-L158 HydrophobicContact CE1-CD1 4.03Å; Y44-L158 HydrophobicContact CE1-CD2 3.9Å; Y44-L158 HydrophobicContact CE1-CG 3.7Å; V142-L158 HydrophobicContact CG1-CB 3.97Å; V142-L158 HydrophobicContact CG1-CD2 4.02Å; E154-L158 HydrophobicContact CG-CD1 3.88Å; E154-L158 WeakPolarHBondContact O-CD1 3.46Å; E154-L158 WeakPolarHBondContact O-CG 3.45Å; E154-L158 PolarHBondContact O-N 2.98Å; E154-L158 WeakPolarHBondContact OE1-CD1 3.41Å; K156-L158 PolarHBondContact O-N 3.39Å; L158-L161 HydrophobicContact CD2-CD1 4.4Å; L158-M162 WeakPolarHBondContact O-CG 3.3Å; L158-M162 PolarHBondContact O-N 3.12Å; L158-M162 VanDerWaalsContact O-N 3.07Å; L158-K177 HydrophobicContact CB-CB 4.15Å; L158-K177 HydrophobicContact CB-CD 3.81Å; L158-K177 HydrophobicContact CB-CG 3.74Å; L158-K177 HydrophobicContact CD1-CD 4.21Å; L158-K177 HydrophobicContact CD1-CG 4.5Å; L158-N401 HydrophobicContact CD2-CB 4.34Å
159	A	91.4	Very high	90	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-69.1	-37.9	172.5	0	0	0	0	0	112.6	C115 H117 V155 K156 A157 M162 T163 G175 K177	C115-A159 HydrophobicContact CB-CB 3.95Å; H117-A159 HydrophobicContact CB-CB 3.9Å; H117-A159 WeakPolarHBondContact CB-O 3.4Å; V155-A159 WeakPolarHBondContact O-CB 3.28Å; V155-A159 PolarHBondContact O-N 3.18Å; K156-A159 PolarHBondContact O-N 2.89Å; A157-A159 PolarHBondContact O-N 3.06Å; A159-M162 PolarHBondContact O-N 3.3Å; A159-T163 PolarHBondContact O-N 2.72Å; A159-T163 PolarHBondContact O-OG1 3.14Å; A159-G175 CarbonylContact O-C 3.52Å; A159-G175 WeakPolarHBondContact O-CA 3.29Å; A159-K177 HydrophobicContact CB-CB 3.96Å
160	S	91.4	Very high	90.3	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-69.9	-43.3	176.1	64.8	0	0	0	0	111.7	T48 H117 K156 A157 M162 T163 I164	T48-S160 WeakPolarHBondContact CG2-OG 3.34Å; H117-S160 WeakPolarHBondContact CD2-CB 3.47Å; H117-S160 VanDerWaalsContact CG-CA 3.45Å; H117-S160 VanDerWaalsContact NE2-CB 3.31Å; H117-S160 WeakPolarHBondContact NE2-CB 3.49Å; K156-S160 PolarHBondContact O-N 3.26Å; K156-S160 PolarHBondContact O-OG 2.95Å; A157-S160 PolarHBondContact O-N 3.32Å; A157-S160 PolarHBondContact O-OG 3.25Å; S160-M162 VanDerWaalsContact C-N 3.27Å; S160-M162 PolarHBondContact O-N 2.87Å; S160-T163 WeakPolarHBondContact O-CB 3.21Å; S160-T163 PolarHBondContact O-N 3.15Å; S160-I164 PolarHBondContact O-N 3.42Å
161	L	89.1	Confident	90.6	Very high	13 Å²	13	31.2 Å²	31.2	7%	0.068	17%	0.171	C	C	.	.	H	α-helix	trans	-54.4	-41.3	169.9	-70.7	176.1	0	0	0	112.1	T48 A157 L158 T163 I164 K165 N401 V423	T48-L161 HydrophobicContact CG2-CD2 3.77Å; T48-L161 HydrophobicContact CG2-CG 3.83Å; A157-L161 WeakPolarHBondContact O-CG 3.47Å; A157-L161 PolarHBondContact O-N 3.48Å; L158-L161 HydrophobicContact CD2-CD1 4.4Å; L161-T163 VanDerWaalsContact C-N 3.32Å; L161-T163 PolarHBondContact O-N 3.31Å; L161-I164 PolarHBondContact O-N 2.94Å; L161-K165 WeakPolarHBondContact O-CB 3.5Å; L161-K165 PolarHBondContact O-N 3.29Å; L161-N401 HydrophobicContact CD1-CB 4.19Å; L161-V423 HydrophobicContact CD2-CG1 3.96Å
162	M	89.5	Confident	90.8	Very high	1 Å²	1	30.5 Å²	30.5	1%	0.005	17%	0.168	C	C	.	.	H	α-helix	trans	-62.6	-34.9	176.8	-79.9	-58	-61.1	0	0	113.9	K125 V142 L158 A159 S160 K165 C166 V430	K125-M162 HydrophobicContact CG-CE 4.43Å; K125-M162 WeakPolarHBondContact O-CE 3.37Å; V142-M162 HydrophobicContact CB-CG 3.83Å; V142-M162 HydrophobicContact CB-SD 3.54Å; V142-M162 VanDerWaalsContact CB-SD 3.54Å; V142-M162 HydrophobicContact CG1-CG 3.39Å; V142-M162 HydrophobicContact CG1-SD 3.66Å; V142-M162 HydrophobicContact CG2-SD 3.72Å; L158-M162 WeakPolarHBondContact O-CG 3.3Å; L158-M162 PolarHBondContact O-N 3.12Å; L158-M162 VanDerWaalsContact O-N 3.07Å; A159-M162 PolarHBondContact O-N 3.3Å; S160-M162 VanDerWaalsContact C-N 3.27Å; S160-M162 PolarHBondContact O-N 2.87Å; M162-K165 HydrophobicContact SD-CD 4.28Å; M162-C166 WeakPolarHBondContact O-CB 3.16Å; M162-C166 PolarHBondContact O-N 3.4Å; M162-C166 PolarHBondContact O-SG 2.97Å; M162-V430 HydrophobicContact CE-CB 4.14Å; M162-V430 HydrophobicContact CE-CG2 3.8Å
163	T	92.3	Very high	90.9	Very high	12 Å²	12	28.4 Å²	28.4	7%	0.074	15%	0.154	C	C	.	.	H	α-helix	trans	-64.6	-47.7	178.5	-56.9	0	0	0	0	110.1	H117 Y120 A159 S160 L161 C166 A167 G175	H117-T163 WeakPolarHBondContact ND1-CB 3.44Å; H117-T163 PolarHBondContact ND1-OG1 2.81Å; Y120-T163 HydrophobicContact CD1-CG2 4.42Å; Y120-T163 HydrophobicContact CE1-CG2 3.92Å; A159-T163 PolarHBondContact O-N 2.72Å; A159-T163 PolarHBondContact O-OG1 3.14Å; S160-T163 WeakPolarHBondContact O-CB 3.21Å; S160-T163 PolarHBondContact O-N 3.15Å; L161-T163 VanDerWaalsContact C-N 3.32Å; L161-T163 PolarHBondContact O-N 3.31Å; T163-C166 PolarHBondContact O-N 3.21Å; T163-A167 WeakPolarHBondContact O-CB 3.35Å; T163-A167 PolarHBondContact O-N 3.2Å; T163-G175 WeakPolarHBondContact OG1-CA 3.29Å; T163-G175 PolarHBondContact OG1-N 2.79Å; T163-G175 VanDerWaalsContact OG1-N 3.1Å
164	I	92	Very high	91	Very high	54 Å²	54	26.3 Å²	26.3	28%	0.277	14%	0.142	S	C	.	.	H	α-helix	trans	-68.4	-41.9	-178.1	-61.1	162.2	0	0	0	110.4	I52 S160 L161 C166 A167 I168 V423	I52-I164 HydrophobicContact CD1-CD1 3.7Å; I52-I164 HydrophobicContact CG1-CD1 3.52Å; S160-I164 PolarHBondContact O-N 3.42Å; L161-I164 PolarHBondContact O-N 2.94Å; I164-C166 PolarHBondContact O-N 3.2Å; I164-A167 PolarHBondContact O-N 3.41Å; I164-I168 HydrophobicContact CG2-CD1 3.77Å; I164-I168 HydrophobicContact CG2-CG1 4.39Å; I164-I168 WeakPolarHBondContact O-CB 3.37Å; I164-I168 WeakPolarHBondContact O-CG1 3.31Å; I164-I168 PolarHBondContact O-N 3.48Å; I164-V423 HydrophobicContact CB-CG1 4.29Å; I164-V423 HydrophobicContact CG2-CB 4.18Å; I164-V423 HydrophobicContact CG2-CG1 3.95Å; I164-V423 HydrophobicContact CG2-CG2 4.43Å
165	K	91.9	Very high	91.3	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-56.4	-49.2	174.8	-169.6	154.8	-70	169.8	0	111.9	L161 M162 I168 V169 N401 D422 N426 A427 V430	L161-K165 WeakPolarHBondContact O-CB 3.5Å; L161-K165 PolarHBondContact O-N 3.29Å; M162-K165 HydrophobicContact SD-CD 4.28Å; K165-I168 PolarHBondContact O-N 3.05Å; K165-V169 WeakPolarHBondContact O-CG2 3.37Å; K165-V169 PolarHBondContact O-N 3.07Å; K165-N401 PolarHBondContact NZ-OD1 2.98Å; K165-D422 WeakPolarHBondContact CE-O 3.41Å; K165-D422 PolarHBondContact NZ-O 3.11Å; K165-D422 IonicContact NZ-OD2 3.7Å; K165-D422 PolarHBondContact NZ-OD2 3.39Å; K165-N426 VanDerWaalsContact CE-OD1 3.22Å; K165-N426 WeakPolarHBondContact CE-OD1 3.4Å; K165-N426 PolarHBondContact NZ-OD1 2.87Å; K165-A427 HydrophobicContact CG-CB 3.98Å; K165-V430 HydrophobicContact CG-CG1 4.03Å
166	C	92.3	Very high	91.5	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-65.3	-42.3	178.3	-62.6	0	0	0	0	111.8	M162 T163 I164 I168 V169 E170 I171 F173	M162-C166 WeakPolarHBondContact O-CB 3.16Å; M162-C166 PolarHBondContact O-N 3.4Å; M162-C166 PolarHBondContact O-SG 2.97Å; T163-C166 PolarHBondContact O-N 3.21Å; I164-C166 PolarHBondContact O-N 3.2Å; C166-I168 PolarHBondContact O-N 3.1Å; C166-V169 PolarHBondContact O-N 3.45Å; C166-E170 PolarHBondContact O-N 3.49Å; C166-E170 VanDerWaalsContact O-N 3.14Å; C166-I171 HydrophobicContact CB-CB 4.23Å; C166-I171 HydrophobicContact CB-CG2 4.49Å; C166-I171 PolarHBondContact O-N 2.94Å; C166-F173 HydrophobicContact CB-CB 4.37Å; C166-F173 WeakPolarHBondContact CB-O 3.39Å
167	A	93	Very high	91.4	Very high	53 Å²	53	23.3 Å²	23.3	44%	0.438	13%	0.129	S	C	.	.	H	α-helix	trans	-61.8	-39.4	177	0	0	0	0	0	113.4	T163 I164 E170	T163-A167 WeakPolarHBondContact O-CB 3.35Å; T163-A167 PolarHBondContact O-N 3.2Å; I164-A167 PolarHBondContact O-N 3.41Å; A167-E170 PolarHBondContact O-N 2.92Å
168	I	92	Very high	91.6	Very high	80 Å²	80	23.3 Å²	23.3	41%	0.41	13%	0.129	S	C	.	.	H	α-helix	trans	-67.9	-33.5	-179.1	-77.1	173.5	0	0	0	112.9	I164 K165 C166 V423 Y424	I164-I168 HydrophobicContact CG2-CD1 3.77Å; I164-I168 HydrophobicContact CG2-CG1 4.39Å; I164-I168 WeakPolarHBondContact O-CB 3.37Å; I164-I168 WeakPolarHBondContact O-CG1 3.31Å; I164-I168 PolarHBondContact O-N 3.48Å; K165-I168 PolarHBondContact O-N 3.05Å; C166-I168 PolarHBondContact O-N 3.1Å; I168-V423 HydrophobicContact CD1-CB 3.83Å; I168-V423 HydrophobicContact CD1-CG2 3.49Å; I168-V423 VanDerWaalsContact CD1-CG2 3.49Å; I168-Y424 HydrophobicContact CG2-CD2 3.8Å; I168-Y424 HydrophobicContact CG2-CG 4.48Å
169	V	92.1	Very high	91.9	Very high	41 Å²	41	23.2 Å²	23.2	25%	0.248	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.3	22.4	177	-61.8	0	0	0	0	113.3	K165 C166 I171 A427	K165-V169 WeakPolarHBondContact O-CG2 3.37Å; K165-V169 PolarHBondContact O-N 3.07Å; C166-V169 PolarHBondContact O-N 3.45Å; V169-I171 HydrophobicContact CG2-CB 4.47Å; V169-I171 HydrophobicContact CG2-CD1 3.43Å; V169-I171 VanDerWaalsContact CG2-CD1 3.43Å; V169-I171 HydrophobicContact CG2-CG1 3.79Å; V169-I171 PolarHBondContact O-N 2.88Å; V169-A427 HydrophobicContact CB-CB 4.48Å; V169-A427 HydrophobicContact CG1-CB 3.63Å; V169-A427 HydrophobicContact CG2-CB 4.01Å
170	E	93	Very high	92	Very high	181 Å²	181	23.2 Å²	23.2	85%	0.846	13%	0.128	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.9	28.9	175.1	-56.6	-173.8	152.7	0	0	114.7	C166 A167	C166-E170 PolarHBondContact O-N 3.49Å; C166-E170 VanDerWaalsContact O-N 3.14Å; A167-E170 PolarHBondContact O-N 2.92Å
171	I	92	Very high	92.1	Very high	5 Å²	5	27.8 Å²	27.8	3%	0.026	15%	0.146	C	C	.	.			trans	-82.9	127.8	175.3	-67.9	169.7	0	0	0	108.6	C166 V169 F173 V430 T431 Y434	C166-I171 HydrophobicContact CB-CB 4.23Å; C166-I171 HydrophobicContact CB-CG2 4.49Å; C166-I171 PolarHBondContact O-N 2.94Å; V169-I171 HydrophobicContact CG2-CB 4.47Å; V169-I171 HydrophobicContact CG2-CD1 3.43Å; V169-I171 VanDerWaalsContact CG2-CD1 3.43Å; V169-I171 HydrophobicContact CG2-CG1 3.79Å; V169-I171 PolarHBondContact O-N 2.88Å; I171-F173 HydrophobicContact CG2-CB 4.2Å; I171-F173 HydrophobicContact CG2-CD2 3.23Å; I171-F173 HydrophobicContact CG2-CE2 3.74Å; I171-F173 HydrophobicContact CG2-CG 3.81Å; I171-F173 PolarHBondContact O-N 3.29Å; I171-V430 HydrophobicContact CD1-CB 4.32Å; I171-V430 HydrophobicContact CD1-CG1 3.79Å; I171-V430 HydrophobicContact CD1-CG2 4.04Å; I171-T431 VanDerWaalsContact CD1-CA 3.46Å; I171-T431 HydrophobicContact CD1-CG2 4.5Å; I171-Y434 HydrophobicContact CG1-CD1 4.32Å; I171-Y434 HydrophobicContact CG2-CD1 4.44Å; I171-Y434 HydrophobicContact CG2-CD2 4.32Å; I171-Y434 HydrophobicContact CG2-CG 4.01Å
172	P	93.1	Very high	92.2	Very high	47 Å²	47	27.3 Å²	27.3	31%	0.305	14%	0.143	S	C	.	.			trans	-81	55.7	-171.3	34	-38	0	0	0	113.1	L121 Y434	L121-P172 HydrophobicContact CD1-CB 4.29Å; P172-Y434 HydrophobicContact CG-CE2 3.78Å
173	F	92.5	Very high	92.3	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.157	C	C	.	.			trans	-128.1	138.8	-179.4	-65.3	-35	0	0	0	112.4	P123 K125 C166 I171 Y434 W437	P123-F173 HydrophobicContact CG-CD1 3.72Å; P123-F173 HydrophobicContact CG-CE1 3.54Å; P123-F173 WeakPolarHBondContact O-CA 3.37Å; P123-F173 WeakPolarHBondContact O-CD1 3.17Å; K125-F173 HydrophobicContact CB-CB 3.58Å; K125-F173 HydrophobicContact CB-CD1 4.49Å; K125-F173 HydrophobicContact CB-CD2 3.49Å; K125-F173 VanDerWaalsContact CB-CD2 3.49Å; K125-F173 HydrophobicContact CB-CE2 4.25Å; K125-F173 HydrophobicContact CB-CG 3.64Å; K125-F173 HydrophobicContact CD-CD2 3.7Å; K125-F173 HydrophobicContact CD-CE2 3.55Å; K125-F173 HydrophobicContact CD-CG 4.35Å; K125-F173 HydrophobicContact CD-CZ 4.06Å; K125-F173 HydrophobicContact CG-CD2 3.51Å; K125-F173 HydrophobicContact CG-CE2 3.86Å; K125-F173 HydrophobicContact CG-CG 4.18Å; C166-F173 HydrophobicContact CB-CB 4.37Å; C166-F173 WeakPolarHBondContact CB-O 3.39Å; I171-F173 HydrophobicContact CG2-CB 4.2Å; I171-F173 HydrophobicContact CG2-CD2 3.23Å; I171-F173 HydrophobicContact CG2-CE2 3.74Å; I171-F173 HydrophobicContact CG2-CG 3.81Å; I171-F173 PolarHBondContact O-N 3.29Å; F173-Y434 HydrophobicContact CE1-CD2 4.24Å; F173-Y434 AromaticContact CE2-CD2 3.81Å; F173-Y434 HydrophobicContact CE2-CD2 3.81Å; F173-Y434 HydrophobicContact CE2-CG 4.2Å; F173-Y434 AromaticContact CZ-CD2 3.55Å; F173-Y434 HydrophobicContact CZ-CD2 3.55Å; F173-Y434 HydrophobicContact CZ-CE2 4.39Å; F173-Y434 HydrophobicContact CZ-CG 4.37Å; F173-W437 HydrophobicContact CE1-CD2 4.05Å; F173-W437 HydrophobicContact CE1-CE3 4.02Å; F173-W437 HydrophobicContact CE1-CZ3 4.31Å; F173-W437 HydrophobicContact CZ-CB 4.18Å; F173-W437 AromaticContact CZ-CD2 3.95Å; F173-W437 HydrophobicContact CZ-CD2 3.95Å; F173-W437 AromaticContact CZ-CE3 3.97Å; F173-W437 HydrophobicContact CZ-CE3 3.97Å; F173-W437 HydrophobicContact CZ-CG 4.06Å
174	G	92.2	Very high	92.2	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	156.4	161.3	0	0	0	0	0	111.7	S118 L121 P123 C124 K125	S118-G174 WeakPolarHBondContact O-CA 3.47Å; L121-G174 WeakPolarHBondContact O-CA 3.48Å; L121-G174 PolarHBondContact O-N 3.44Å; P123-G174 PolarHBondContact O-N 3.38Å; C124-G174 CarbonylContact C-O 3.39Å; C124-G174 WeakPolarHBondContact CA-O 3.43Å; K125-G174 PolarHBondContact N-O 3.3Å
175	G	92.3	Very high	92	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	134.9	175.5	0	0	0	0	0	113.1	H117 A159 T163	H117-G175 PolarHBondContact N-O 3.18Å; A159-G175 CarbonylContact O-C 3.52Å; A159-G175 WeakPolarHBondContact O-CA 3.29Å; T163-G175 WeakPolarHBondContact OG1-CA 3.29Å; T163-G175 PolarHBondContact OG1-N 2.79Å; T163-G175 VanDerWaalsContact OG1-N 3.1Å
176	A	92.6	Very high	92	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	163.2	168.8	0	0	0	0	0	112.1	C115 Q116 C124 K125 G126	C115-A176 CarbonylContact O-C 3.22Å; C115-A176 WeakPolarHBondContact O-CA 3.39Å; C115-A176 VanDerWaalsContact O-CB 3.31Å; C115-A176 WeakPolarHBondContact O-CB 3.49Å; Q116-A176 HydrophobicContact CG-CB 4.2Å; C124-A176 HydrophobicContact CB-CB 3.8Å; K125-A176 PolarHBondContact O-N 2.79Å; G126-A176 WeakPolarHBondContact CA-O 3.43Å
177	K	91.1	Very high	92	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	150.3	173.3	175	76.3	-174.5	-150.1	0	108.4	R114 C115 F141 V142 G143 V155 L158 A159 D219	R114-K177 CarbonylContact C-O 3.6Å; R114-K177 WeakPolarHBondContact CA-O 3.45Å; R114-K177 WeakPolarHBondContact CD-O 3.49Å; C115-K177 PolarHBondContact N-O 3.04Å; C115-K177 PolarHBondContact O-N 2.92Å; F141-K177 PolarHBondContact O-NZ 3.31Å; V142-K177 VanDerWaalsContact C-CD 3.43Å; V142-K177 HydrophobicContact CG1-CD 4.26Å; G143-K177 WeakPolarHBondContact O-CD 3.38Å; V155-K177 HydrophobicContact CB-CG 4.41Å; V155-K177 HydrophobicContact CG1-CB 4.21Å; V155-K177 HydrophobicContact CG1-CG 4.05Å; V155-K177 WeakPolarHBondContact CG1-O 3.34Å; V155-K177 HydrophobicContact CG2-CG 4.47Å; V155-K177 WeakPolarHBondContact O-CB 3.26Å; L158-K177 HydrophobicContact CB-CB 4.15Å; L158-K177 HydrophobicContact CB-CD 3.81Å; L158-K177 HydrophobicContact CB-CG 3.74Å; L158-K177 HydrophobicContact CD1-CD 4.21Å; L158-K177 HydrophobicContact CD1-CG 4.5Å; A159-K177 HydrophobicContact CB-CB 3.96Å; K177-D219 VanDerWaalsContact NZ-CG 3.28Å; K177-D219 IonicContact NZ-OD1 3.27Å; K177-D219 PolarHBondContact NZ-OD1 3.21Å; K177-D219 IonicContact NZ-OD2 2.92Å; K177-D219 PolarHBondContact NZ-OD2 3.09Å
178	G	91.8	Very high	92	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	166	165.5	0	0	0	0	0	113	W113 G143 R145	W113-G178 CarbonylContact O-C 3.55Å; W113-G178 WeakPolarHBondContact O-CA 3.41Å; G143-G178 CarbonylContact O-C 3.38Å; G143-G178 PolarHBondContact O-N 3.4Å; R145-G178 PolarHBondContact N-O 3.25Å
179	G	92.4	Very high	92.1	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	156.7	174.6	0	0	0	0	0	111.5	S112 W113 R145	S112-G179 CarbonylContact C-O 3.55Å; S112-G179 VanDerWaalsContact CA-O 3.25Å; S112-G179 WeakPolarHBondContact CA-O 3.36Å; S112-G179 WeakPolarHBondContact CB-O 3.21Å; W113-G179 PolarHBondContact N-O 2.99Å; W113-G179 PolarHBondContact O-N 3.46Å; R145-G179 CarbonylContact O-C 3.08Å; R145-G179 WeakPolarHBondContact O-CA 3.31Å
180	V	93.2	Very high	92.2	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	129	177.9	-171.8	0	0	0	0	106.8	I110 D111 I144 R145 F146 A147 I182 I195 L199	I110-V180 HydrophobicContact CG2-CG1 3.31Å; D111-V180 WeakPolarHBondContact O-CA 3.17Å; I144-V180 HydrophobicContact CG2-CG2 4.32Å; R145-V180 PolarHBondContact O-N 2.9Å; F146-V180 HydrophobicContact CD1-CB 3.69Å; F146-V180 HydrophobicContact CD1-CG2 3.77Å; F146-V180 HydrophobicContact CE1-CB 3.87Å; F146-V180 HydrophobicContact CE1-CG2 3.5Å; F146-V180 VanDerWaalsContact CE1-CG2 3.5Å; A147-V180 PolarHBondContact N-O 2.81Å; V180-I182 HydrophobicContact CB-CG1 4.36Å; V180-I182 HydrophobicContact CG1-CD1 4.28Å; V180-I182 HydrophobicContact CG1-CG1 4.03Å; V180-I182 HydrophobicContact CG1-CG2 4.44Å; V180-I182 PolarHBondContact O-N 2.96Å; V180-I195 HydrophobicContact CG1-CG2 4.45Å; V180-L199 HydrophobicContact CG2-CD1 3.77Å; V180-L199 HydrophobicContact CG2-CD2 3.65Å; V180-L199 HydrophobicContact CG2-CG 4.36Å
181	R	93.6	Very high	92.3	Very high	96 Å²	96	34.5 Å²	34.5	36%	0.362	19%	0.185	S	C	.	.			trans	-83.2	80.7	-175.2	-172.8	-178	-69.5	145.9	-3	110.8	D111 W113 A147 P148 V150	D111-R181 HydrophobicContact CB-CB 4.42Å; D111-R181 PolarHBondContact O-N 2.92Å; D111-R181 IonicContact OD2-NH1 2.93Å; D111-R181 PolarHBondContact OD2-NH1 3Å; W113-R181 HydrophobicContact CH2-CB 4.44Å; W113-R181 HydrophobicContact CZ3-CB 4.07Å; A147-R181 WeakPolarHBondContact O-CA 3.01Å; P148-R181 WeakPolarHBondContact O-CG 3.48Å; V150-R181 PolarHBondContact O-NE 2.84Å; V150-R181 PolarHBondContact O-NH2 2.77Å; V150-R181 VanDerWaalsContact O-NH2 3.07Å
182	I	92.1	Very high	92.4	Very high	4 Å²	4	34.5 Å²	34.5	2%	0.021	19%	0.185	C	C	.	.			trans	-146.5	146.6	176.5	53.2	168	0	0	0	110.2	I110 F146 A147 V180 P184 Y187 L192 I195	I110-I182 HydrophobicContact CD1-CG2 4.09Å; I110-I182 HydrophobicContact CG1-CG2 4.08Å; I110-I182 HydrophobicContact CG2-CG2 3.92Å; F146-I182 CarbonylContact C-O 3.54Å; F146-I182 HydrophobicContact CB-CD1 4.24Å; F146-I182 HydrophobicContact CB-CG1 4.02Å; F146-I182 HydrophobicContact CD1-CD1 4.38Å; F146-I182 HydrophobicContact CD2-CD1 3.69Å; F146-I182 HydrophobicContact CD2-CG1 4.39Å; F146-I182 HydrophobicContact CE2-CD1 4.07Å; F146-I182 HydrophobicContact CG-CD1 3.86Å; F146-I182 HydrophobicContact CG-CG1 4.09Å; A147-I182 CarbonylContact C-O 3.54Å; A147-I182 WeakPolarHBondContact CA-O 3.34Å; A147-I182 PolarHBondContact N-O 3.16Å; A147-I182 PolarHBondContact O-N 3.19Å; V180-I182 HydrophobicContact CB-CG1 4.36Å; V180-I182 HydrophobicContact CG1-CD1 4.28Å; V180-I182 HydrophobicContact CG1-CG1 4.03Å; V180-I182 HydrophobicContact CG1-CG2 4.44Å; V180-I182 PolarHBondContact O-N 2.96Å; I182-P184 WeakPolarHBondContact O-CD 3.25Å; I182-Y187 HydrophobicContact CB-CD2 4.32Å; I182-Y187 HydrophobicContact CB-CE2 3.62Å; I182-Y187 HydrophobicContact CG2-CE2 3.72Å; I182-L192 HydrophobicContact CD1-CD2 4.1Å; I182-I195 HydrophobicContact CD1-CD1 4.21Å; I182-I195 HydrophobicContact CD1-CG2 4.16Å
183	D	91.5	Very high	92.6	Very high	54 Å²	54	35.1 Å²	35.1	29%	0.289	18%	0.183	S	C	.	.			trans	-85.8	111.5	159.4	-176.3	-7.8	0	0	0	108.3	P148 K185 T186 Y187	P148-D183 HydrophobicContact CG-CB 4.39Å; D183-K185 PolarHBondContact O-N 3.1Å; D183-K185 WeakPolarHBondContact OD1-CB 3.35Å; D183-K185 WeakPolarHBondContact OD1-CG 3.16Å; D183-K185 PolarHBondContact OD1-N 3.39Å; D183-T186 HydrophobicContact CB-CG2 4.32Å; D183-T186 PolarHBondContact O-N 3.33Å; D183-T186 PolarHBondContact O-OG1 3.18Å; D183-Y187 VanDerWaalsContact O-CD2 3.24Å; D183-Y187 WeakPolarHBondContact O-CD2 3.35Å
184	P	89	Confident	92.7	Very high	29 Å²	29	39.2 Å²	39.2	19%	0.188	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-4.8	-179	28.1	-36.5	0	0	0	114.4	F146 I182 L192	F146-P184 HydrophobicContact CB-CB 4.31Å; F146-P184 HydrophobicContact CB-CG 4.12Å; F146-P184 HydrophobicContact CD2-CB 4.37Å; F146-P184 WeakPolarHBondContact O-CD 3.49Å; I182-P184 WeakPolarHBondContact O-CD 3.25Å; P184-L192 HydrophobicContact CB-CD1 4.39Å; P184-L192 HydrophobicContact CB-CD2 4.04Å
185	K	89.4	Confident	92.8	Very high	170 Å²	170	39.2 Å²	39.2	74%	0.739	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-22.9	172.5	-62.2	172.2	-178.3	172.7	0	114.2	D183 Y187	D183-K185 PolarHBondContact O-N 3.1Å; D183-K185 WeakPolarHBondContact OD1-CB 3.35Å; D183-K185 WeakPolarHBondContact OD1-CG 3.16Å; D183-K185 PolarHBondContact OD1-N 3.39Å; K185-Y187 VanDerWaalsContact C-N 3.31Å
186	T	91.6	Very high	92.9	Very high	99 Å²	99	39.2 Å²	39.2	61%	0.607	20%	0.199	S	C	*	.	S	Bend	trans	-84.1	-9.9	-179	55.2	0	0	0	0	112.8	D183	D183-T186 HydrophobicContact CB-CG2 4.32Å; D183-T186 PolarHBondContact O-N 3.33Å; D183-T186 PolarHBondContact O-OG1 3.18Å
187	Y	92	Very high	93.1	Very high	31 Å²	31	42.3 Å²	42.3	12%	0.122	21%	0.211	C	C	.	.	S	Bend	trans	-108.3	146.6	-177	-62.6	-84.7	0	0	0	112.3	L102 E108 I182 D183 K185 E191 L192 I195	L102-Y187 HydrophobicContact CD2-CD1 4.17Å; L102-Y187 HydrophobicContact CD2-CE1 3.87Å; E108-Y187 PolarHBondContact OE1-OH 3.05Å; E108-Y187 WeakPolarHBondContact OE2-CE1 3.46Å; E108-Y187 PolarHBondContact OE2-OH 3.42Å; I182-Y187 HydrophobicContact CB-CD2 4.32Å; I182-Y187 HydrophobicContact CB-CE2 3.62Å; I182-Y187 HydrophobicContact CG2-CE2 3.72Å; D183-Y187 VanDerWaalsContact O-CD2 3.24Å; D183-Y187 WeakPolarHBondContact O-CD2 3.35Å; K185-Y187 VanDerWaalsContact C-N 3.31Å; Y187-E191 WeakPolarHBondContact CA-OE2 3.35Å; Y187-E191 HydrophobicContact CD1-CB 4.03Å; Y187-E191 HydrophobicContact CG-CB 4.45Å; Y187-L192 HydrophobicContact CG-CD2 4.43Å; Y187-I195 HydrophobicContact CD1-CD1 3.86Å; Y187-I195 HydrophobicContact CE1-CD1 4.07Å; Y187-I195 HydrophobicContact CG-CD1 4.16Å
188	S	93.8	Very high	93.3	Very high	36 Å²	36	46.3 Å²	46.3	25%	0.252	23%	0.226	S	C	.	.			trans	-67.3	166.5	169	83.5	0	0	0	0	111.6	D103 S190 E191 L192	D103-S188 VanDerWaalsContact OD2-CB 3.28Å; D103-S188 WeakPolarHBondContact OD2-CB 3.46Å; D103-S188 PolarHBondContact OD2-OG 2.91Å; S188-S190 VanDerWaalsContact C-N 3.3Å; S188-S190 PolarHBondContact O-N 2.8Å; S188-S190 PolarHBondContact OG-N 3.06Å; S188-S190 PolarHBondContact OG-OG 2.98Å; S188-E191 PolarHBondContact N-OE2 3.1Å; S188-E191 PolarHBondContact O-N 3.21Å; S188-E191 WeakPolarHBondContact OG-CB 3.48Å; S188-E191 WeakPolarHBondContact OG-CG 3.32Å; S188-E191 PolarHBondContact OG-N 3.37Å; S188-L192 WeakPolarHBondContact O-CG 3.2Å; S188-L192 PolarHBondContact O-N 3.27Å
189	T	93.5	Very high	93.4	Very high	77 Å²	77	46.4 Å²	46.4	47%	0.472	23%	0.226	S	C	.	.	H	α-helix	trans	-67.9	-31	175.4	-65.7	0	0	0	0	112.1	E193 R225 W229	T189-E193 WeakPolarHBondContact O-CB 3.31Å; T189-E193 PolarHBondContact O-N 2.94Å; T189-R225 PolarHBondContact OG1-NH1 2.95Å; T189-W229 HydrophobicContact CG2-CH2 4.05Å; T189-W229 HydrophobicContact CG2-CZ2 4.06Å
190	S	94.5	Very high	93.5	Very high	59 Å²	59	46.5 Å²	46.5	41%	0.413	23%	0.227	S	C	.	.	H	α-helix	trans	-68.5	-39.6	173.6	23	0	0	0	0	112.5	D103 S188 E193 R194	D103-S190 PolarHBondContact OD2-OG 3.29Å; S188-S190 VanDerWaalsContact C-N 3.3Å; S188-S190 PolarHBondContact O-N 2.8Å; S188-S190 PolarHBondContact OG-N 3.06Å; S188-S190 PolarHBondContact OG-OG 2.98Å; S190-E193 PolarHBondContact O-N 2.88Å; S190-R194 WeakPolarHBondContact O-CG 3.34Å; S190-R194 PolarHBondContact O-N 3.02Å; S190-R194 VanDerWaalsContact O-N 3.07Å
191	E	94.4	Very high	93.6	Very high	18 Å²	18	48.9 Å²	48.9	8%	0.084	24%	0.239	C	C	.	.	H	α-helix	trans	-63.7	-52	172.5	-73.3	166.4	165.2	0	0	111.2	L102 D103 Y187 S188 E193 R194 I195	L102-E191 WeakPolarHBondContact CB-OE1 3.48Å; L102-E191 HydrophobicContact CD2-CG 4.41Å; D103-E191 PolarHBondContact N-OE1 2.99Å; Y187-E191 WeakPolarHBondContact CA-OE2 3.35Å; Y187-E191 HydrophobicContact CD1-CB 4.03Å; Y187-E191 HydrophobicContact CG-CB 4.45Å; S188-E191 PolarHBondContact N-OE2 3.1Å; S188-E191 PolarHBondContact O-N 3.21Å; S188-E191 WeakPolarHBondContact OG-CB 3.48Å; S188-E191 WeakPolarHBondContact OG-CG 3.32Å; S188-E191 PolarHBondContact OG-N 3.37Å; E191-E193 PolarHBondContact O-N 2.98Å; E191-R194 PolarHBondContact O-N 3.05Å; E191-I195 WeakPolarHBondContact O-CG1 3.04Å; E191-I195 PolarHBondContact O-N 2.98Å
192	L	94.7	Very high	93.6	Very high	5 Å²	5	45.2 Å²	45.2	3%	0.026	23%	0.226	C	C	.	.	H	α-helix	trans	-57.5	-35.8	177	-69.2	174.8	0	0	0	112.7	F146 I182 P184 Y187 S188 T196 W229	F146-L192 HydrophobicContact CD2-CD2 4.25Å; F146-L192 HydrophobicContact CE2-CD2 4.27Å; I182-L192 HydrophobicContact CD1-CD2 4.1Å; P184-L192 HydrophobicContact CB-CD1 4.39Å; P184-L192 HydrophobicContact CB-CD2 4.04Å; Y187-L192 HydrophobicContact CG-CD2 4.43Å; S188-L192 WeakPolarHBondContact O-CG 3.2Å; S188-L192 PolarHBondContact O-N 3.27Å; L192-T196 WeakPolarHBondContact O-CB 3.45Å; L192-T196 PolarHBondContact O-N 3.3Å; L192-T196 PolarHBondContact O-OG1 3.49Å; L192-W229 HydrophobicContact CB-CH2 4.18Å; L192-W229 HydrophobicContact CB-CZ3 4.02Å
193	E	95.6	Very high	93.7	Very high	59 Å²	59	45.1 Å²	45.1	28%	0.276	23%	0.225	S	C	.	.	H	α-helix	trans	-63.3	-52.3	172.5	-176.1	159.5	175.4	0	0	111.4	T189 S190 E191 I195 T196 R197 W229	T189-E193 WeakPolarHBondContact O-CB 3.31Å; T189-E193 PolarHBondContact O-N 2.94Å; S190-E193 PolarHBondContact O-N 2.88Å; E191-E193 PolarHBondContact O-N 2.98Å; E193-I195 VanDerWaalsContact C-N 3.34Å; E193-I195 PolarHBondContact O-N 3.4Å; E193-T196 PolarHBondContact O-N 2.9Å; E193-R197 HydrophobicContact CG-CG 4.18Å; E193-R197 WeakPolarHBondContact O-CB 3.46Å; E193-R197 VanDerWaalsContact O-CG 3.28Å; E193-R197 WeakPolarHBondContact O-CG 3.34Å; E193-R197 PolarHBondContact O-N 2.94Å; E193-R197 IonicContact OE1-CZ 3.62Å; E193-R197 IonicContact OE1-NE 3.6Å; E193-R197 PolarHBondContact OE1-NE 3.24Å; E193-R197 IonicContact OE1-NH2 3.01Å; E193-R197 PolarHBondContact OE1-NH2 3.05Å; E193-W229 HydrophobicContact CB-CD2 4.04Å; E193-W229 HydrophobicContact CB-CE3 4.27Å; E193-W229 HydrophobicContact CB-CH2 3.86Å; E193-W229 HydrophobicContact CB-CZ2 3.57Å; E193-W229 HydrophobicContact CB-CZ3 4.21Å; E193-W229 HydrophobicContact CG-CD2 3.91Å; E193-W229 HydrophobicContact CG-CG 4.03Å; E193-W229 HydrophobicContact CG-CZ2 4.08Å; E193-W229 PolarHBondContact OE1-NE1 3.06Å; E193-W229 PolarHBondContact OE2-NE1 3.32Å
194	R	95.2	Very high	93.8	Very high	87 Å²	87	43 Å²	43	33%	0.328	22%	0.215	S	C	.	.	H	α-helix	trans	-56.9	-46	178.4	-73.8	-178.5	-66.3	-164.6	-3.9	111.8	V100 T101 D103 S190 E191 R198	V100-R194 HydrophobicContact CG1-CB 4.02Å; T101-R194 PolarHBondContact O-NE 3.15Å; T101-R194 PolarHBondContact O-NH1 3.05Å; T101-R194 PolarHBondContact O-NH2 2.84Å; D103-R194 IonicContact OD1-CZ 3.22Å; D103-R194 IonicContact OD1-NH1 3.98Å; D103-R194 IonicContact OD1-NH2 2.72Å; D103-R194 PolarHBondContact OD1-NH2 3.27Å; D103-R194 IonicContact OD2-NH2 3.36Å; S190-R194 WeakPolarHBondContact O-CG 3.34Å; S190-R194 PolarHBondContact O-N 3.02Å; S190-R194 VanDerWaalsContact O-N 3.07Å; E191-R194 PolarHBondContact O-N 3.05Å; R194-R198 VanDerWaalsContact O-CB 3.26Å; R194-R198 WeakPolarHBondContact O-CB 3.45Å; R194-R198 PolarHBondContact O-N 2.87Å
195	I	94.9	Very high	94	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-58.8	-52.4	176.8	-62.9	164.5	0	0	0	110.2	F98 V100 I110 V180 I182 Y187 E191 E193 R197 R198 L199	F98-I195 HydrophobicContact CE2-CG2 4.2Å; F98-I195 HydrophobicContact CZ-CG2 4.13Å; V100-I195 HydrophobicContact CB-CG1 4.42Å; V100-I195 HydrophobicContact CG1-CG1 4.07Å; V100-I195 HydrophobicContact CG2-CG1 4.06Å; I110-I195 HydrophobicContact CD1-CD1 3.58Å; I110-I195 HydrophobicContact CD1-CG1 3.55Å; I110-I195 HydrophobicContact CD1-CG2 4.18Å; V180-I195 HydrophobicContact CG1-CG2 4.45Å; I182-I195 HydrophobicContact CD1-CD1 4.21Å; I182-I195 HydrophobicContact CD1-CG2 4.16Å; Y187-I195 HydrophobicContact CD1-CD1 3.86Å; Y187-I195 HydrophobicContact CE1-CD1 4.07Å; Y187-I195 HydrophobicContact CG-CD1 4.16Å; E191-I195 WeakPolarHBondContact O-CG1 3.04Å; E191-I195 PolarHBondContact O-N 2.98Å; E193-I195 VanDerWaalsContact C-N 3.34Å; E193-I195 PolarHBondContact O-N 3.4Å; I195-R197 PolarHBondContact O-N 3.09Å; I195-R198 PolarHBondContact O-N 3.3Å; I195-L199 VanDerWaalsContact O-CB 3.32Å; I195-L199 WeakPolarHBondContact O-CB 3.1Å; I195-L199 PolarHBondContact O-N 3.39Å
196	T	95.1	Very high	94.2	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-63.9	-41.6	-176.4	-59.3	0	0	0	0	112.3	F146 L192 E193 A200 E226 W229 I230	F146-T196 WeakPolarHBondContact CZ-OG1 3.45Å; L192-T196 WeakPolarHBondContact O-CB 3.45Å; L192-T196 PolarHBondContact O-N 3.3Å; L192-T196 PolarHBondContact O-OG1 3.49Å; E193-T196 PolarHBondContact O-N 2.9Å; T196-A200 PolarHBondContact O-N 3.25Å; T196-E226 HydrophobicContact CG2-CB 4.07Å; T196-W229 HydrophobicContact CG2-CB 3.98Å; T196-W229 HydrophobicContact CG2-CE3 4.06Å; T196-I230 HydrophobicContact CG2-CD1 4.03Å; T196-I230 HydrophobicContact CG2-CG1 3.6Å
197	R	95.4	Very high	94.2	Very high	65 Å²	65	40.7 Å²	40.7	25%	0.245	20%	0.2	C	C	.	.	H	α-helix	trans	-69.4	-40.7	177.6	-67.2	-170.3	178.6	-102.6	19	111.8	E193 I195 A200 I201 W229 N232 T233	E193-R197 HydrophobicContact CG-CG 4.18Å; E193-R197 WeakPolarHBondContact O-CB 3.46Å; E193-R197 VanDerWaalsContact O-CG 3.28Å; E193-R197 WeakPolarHBondContact O-CG 3.34Å; E193-R197 PolarHBondContact O-N 2.94Å; E193-R197 IonicContact OE1-CZ 3.62Å; E193-R197 IonicContact OE1-NE 3.6Å; E193-R197 PolarHBondContact OE1-NE 3.24Å; E193-R197 IonicContact OE1-NH2 3.01Å; E193-R197 PolarHBondContact OE1-NH2 3.05Å; I195-R197 PolarHBondContact O-N 3.09Å; R197-A200 PolarHBondContact O-N 3.24Å; R197-I201 WeakPolarHBondContact O-CG1 3.48Å; R197-I201 PolarHBondContact O-N 2.89Å; R197-I201 VanDerWaalsContact O-N 3.14Å; R197-W229 HydrophobicContact CG-CB 4.21Å; R197-N232 PolarHBondContact NH1-ND2 3.12Å; R197-N232 PolarHBondContact NH2-ND2 3.13Å; R197-T233 HydrophobicContact CB-CG2 4.39Å; R197-T233 WeakPolarHBondContact CD-OG1 3.42Å; R197-T233 WeakPolarHBondContact CG-OG1 3.45Å; R197-T233 PolarHBondContact NH1-OG1 3.24Å
198	R	94.7	Very high	94.2	Very high	84 Å²	84	39.9 Å²	39.9	32%	0.317	20%	0.197	S	C	.	.	H	α-helix	trans	-63	-45.8	176.1	-176.5	62.1	-171.6	-85	4.2	111.2	F98 P99 R194 I195 A200 I201 E202	F98-R198 HydrophobicContact CB-CG 4.18Å; F98-R198 HydrophobicContact CD2-CB 4.02Å; F98-R198 HydrophobicContact CD2-CG 3.39Å; F98-R198 HydrophobicContact CE2-CB 4.03Å; F98-R198 HydrophobicContact CE2-CG 3.92Å; F98-R198 HydrophobicContact CG-CG 3.88Å; P99-R198 PolarHBondContact O-NH1 3.02Å; R194-R198 VanDerWaalsContact O-CB 3.26Å; R194-R198 WeakPolarHBondContact O-CB 3.45Å; R194-R198 PolarHBondContact O-N 2.87Å; I195-R198 PolarHBondContact O-N 3.3Å; R198-A200 VanDerWaalsContact C-N 3.33Å; R198-A200 PolarHBondContact O-N 3.02Å; R198-I201 PolarHBondContact O-N 3.29Å; R198-E202 IonicContact CZ-OE1 3.97Å; R198-E202 IonicContact NE-OE1 3.7Å; R198-E202 PolarHBondContact NE-OE1 3.29Å; R198-E202 IonicContact NH2-OE1 2.64Å; R198-E202 PolarHBondContact NH2-OE1 2.9Å; R198-E202 PolarHBondContact O-N 2.77Å
199	L	94.2	Very high	94.2	Very high	1 Å²	1	38.3 Å²	38.3	1%	0.005	19%	0.186	C	C	.	.	H	α-helix	trans	-54	-47.5	173.5	-173.5	78.8	0	0	0	111.9	F98 S112 I144 F146 V180 I195 I201 E202 W203	F98-L199 HydrophobicContact CE1-CB 4.37Å; F98-L199 HydrophobicContact CE1-CD1 3.69Å; F98-L199 HydrophobicContact CZ-CB 4.11Å; F98-L199 HydrophobicContact CZ-CD1 4.06Å; S112-L199 VanDerWaalsContact CB-CD1 3.47Å; S112-L199 WeakPolarHBondContact OG-CD1 3.21Å; I144-L199 HydrophobicContact CG2-CD2 3.88Å; F146-L199 HydrophobicContact CE1-CD2 4.33Å; V180-L199 HydrophobicContact CG2-CD1 3.77Å; V180-L199 HydrophobicContact CG2-CD2 3.65Å; V180-L199 HydrophobicContact CG2-CG 4.36Å; I195-L199 VanDerWaalsContact O-CB 3.32Å; I195-L199 WeakPolarHBondContact O-CB 3.1Å; I195-L199 PolarHBondContact O-N 3.39Å; L199-I201 VanDerWaalsContact C-N 3.32Å; L199-I201 PolarHBondContact O-N 3.29Å; L199-E202 PolarHBondContact O-N 3.1Å; L199-W203 HydrophobicContact CD1-CD2 4.26Å; L199-W203 HydrophobicContact CD1-CH2 4.46Å; L199-W203 HydrophobicContact CD1-CZ2 3.69Å; L199-W203 HydrophobicContact CD2-CH2 3.93Å; L199-W203 HydrophobicContact CD2-CZ2 4Å; L199-W203 HydrophobicContact CD2-CZ3 4.2Å; L199-W203 HydrophobicContact CG-CD2 4.07Å; L199-W203 HydrophobicContact CG-CE3 4.42Å; L199-W203 HydrophobicContact CG-CH2 4.36Å; L199-W203 HydrophobicContact CG-CZ2 4.01Å; L199-W203 WeakPolarHBondContact O-CB 3.45Å; L199-W203 PolarHBondContact O-N 3.05Å
200	A	94.3	Very high	94.2	Very high	2 Å²	2	34.7 Å²	34.7	2%	0.017	16%	0.164	C	C	.	.	H	α-helix	trans	-59.2	-41.6	178.7	0	0	0	0	0	112.2	T196 R197 R198 S204 L209 I230 T233	T196-A200 PolarHBondContact O-N 3.25Å; R197-A200 PolarHBondContact O-N 3.24Å; R198-A200 VanDerWaalsContact C-N 3.33Å; R198-A200 PolarHBondContact O-N 3.02Å; A200-S204 VanDerWaalsContact O-CB 3.26Å; A200-S204 WeakPolarHBondContact O-CB 3.43Å; A200-S204 PolarHBondContact O-N 3.41Å; A200-S204 PolarHBondContact O-OG 3.02Å; A200-L209 HydrophobicContact CB-CD2 4.04Å; A200-I230 HydrophobicContact CB-CB 4.48Å; A200-I230 HydrophobicContact CB-CG1 4.24Å; A200-I230 HydrophobicContact CB-CG2 4.29Å; A200-T233 HydrophobicContact CB-CG2 4.08Å
201	I	95.5	Very high	94.1	Very high	51 Å²	51	32.2 Å²	32.2	26%	0.262	15%	0.147	S	C	.	.	H	α-helix	trans	-64.4	-50	176.5	-68.3	168.2	0	0	0	111	R197 R198 L199 S204 K205 T233	R197-I201 WeakPolarHBondContact O-CG1 3.48Å; R197-I201 PolarHBondContact O-N 2.89Å; R197-I201 VanDerWaalsContact O-N 3.14Å; R198-I201 PolarHBondContact O-N 3.29Å; L199-I201 VanDerWaalsContact C-N 3.32Å; L199-I201 PolarHBondContact O-N 3.29Å; I201-S204 PolarHBondContact O-N 3.02Å; I201-K205 HydrophobicContact CG2-CD 4.3Å; I201-K205 WeakPolarHBondContact O-CG 3.32Å; I201-K205 PolarHBondContact O-N 3.41Å; I201-T233 HydrophobicContact CD1-CG2 4.09Å; I201-T233 HydrophobicContact CG1-CG2 3.64Å
202	E	94.6	Very high	94	Very high	18 Å²	18	33.7 Å²	33.7	8%	0.084	17%	0.167	C	C	.	.	H	α-helix	trans	-66.4	-42.6	-176.6	-59	-54.9	165.6	0	0	112.4	V96 R198 L199 S204 K205 M206	V96-E202 HydrophobicContact CG1-CB 3.86Å; V96-E202 HydrophobicContact CG1-CG 4.02Å; R198-E202 IonicContact CZ-OE1 3.97Å; R198-E202 IonicContact NE-OE1 3.7Å; R198-E202 PolarHBondContact NE-OE1 3.29Å; R198-E202 IonicContact NH2-OE1 2.64Å; R198-E202 PolarHBondContact NH2-OE1 2.9Å; R198-E202 PolarHBondContact O-N 2.77Å; L199-E202 PolarHBondContact O-N 3.1Å; E202-S204 VanDerWaalsContact C-N 3.33Å; E202-S204 PolarHBondContact O-N 2.93Å; E202-K205 PolarHBondContact O-N 2.64Å; E202-K205 IonicContact OE1-NZ 3.75Å; E202-K205 PolarHBondContact OE1-NZ 2.79Å; E202-K205 WeakPolarHBondContact OE2-CD 3.2Å; E202-K205 IonicContact OE2-NZ 3.48Å; E202-K205 PolarHBondContact OE2-NZ 2.97Å; E202-M206 WeakPolarHBondContact O-CG 3.23Å; E202-M206 PolarHBondContact O-N 3.23Å; E202-M206 VanDerWaalsContact O-N 3.16Å
203	W	93.8	Very high	93.9	Very high	2 Å²	2	41.3 Å²	41.3	1%	0.008	20%	0.195	C	C	.	.	H	α-helix	trans	-65.2	-35.7	174.7	-71.4	3.7	0	0	0	112.3	W113 R114 I144 L199 M206 G207 F208 L209	W113-W203 WeakPolarHBondContact O-CZ2 3.14Å; R114-W203 HydrophobicContact CB-CD2 4.22Å; R114-W203 HydrophobicContact CB-CH2 4.46Å; R114-W203 HydrophobicContact CB-CZ2 4.02Å; I144-W203 HydrophobicContact CB-CH2 4.45Å; I144-W203 HydrophobicContact CD1-CE3 4.44Å; I144-W203 HydrophobicContact CD1-CH2 4.11Å; I144-W203 HydrophobicContact CD1-CZ3 3.51Å; I144-W203 HydrophobicContact CG1-CH2 3.9Å; I144-W203 HydrophobicContact CG1-CZ3 3.65Å; I144-W203 HydrophobicContact CG2-CH2 3.98Å; I144-W203 HydrophobicContact CG2-CZ3 4.44Å; L199-W203 HydrophobicContact CD1-CD2 4.26Å; L199-W203 HydrophobicContact CD1-CH2 4.46Å; L199-W203 HydrophobicContact CD1-CZ2 3.69Å; L199-W203 HydrophobicContact CD2-CH2 3.93Å; L199-W203 HydrophobicContact CD2-CZ2 4Å; L199-W203 HydrophobicContact CD2-CZ3 4.2Å; L199-W203 HydrophobicContact CG-CD2 4.07Å; L199-W203 HydrophobicContact CG-CE3 4.42Å; L199-W203 HydrophobicContact CG-CH2 4.36Å; L199-W203 HydrophobicContact CG-CZ2 4.01Å; L199-W203 WeakPolarHBondContact O-CB 3.45Å; L199-W203 PolarHBondContact O-N 3.05Å; W203-M206 PolarHBondContact O-N 3.31Å; W203-G207 PolarHBondContact O-N 2.8Å; W203-G207 VanDerWaalsContact O-N 3.16Å; W203-F208 HydrophobicContact CB-CB 4.06Å; W203-F208 HydrophobicContact CG-CB 4.41Å; W203-F208 CarbonylContact O-C 3.47Å; W203-F208 WeakPolarHBondContact O-CA 3.42Å; W203-F208 PolarHBondContact O-N 2.91Å; W203-L209 HydrophobicContact CB-CB 4.25Å; W203-L209 PolarHBondContact O-N 2.9Å
204	S	93.2	Very high	93.8	Very high	11 Å²	11	38.5 Å²	38.5	8%	0.077	18%	0.182	C	C	.	.	H	α-helix	trans	-63.9	-46.5	175.7	-60.7	0	0	0	0	112.1	A200 I201 E202 M206 G207 L209 Y234	A200-S204 VanDerWaalsContact O-CB 3.26Å; A200-S204 WeakPolarHBondContact O-CB 3.43Å; A200-S204 PolarHBondContact O-N 3.41Å; A200-S204 PolarHBondContact O-OG 3.02Å; I201-S204 PolarHBondContact O-N 3.02Å; E202-S204 VanDerWaalsContact C-N 3.33Å; E202-S204 PolarHBondContact O-N 2.93Å; S204-M206 VanDerWaalsContact C-N 3.25Å; S204-M206 PolarHBondContact O-N 3.49Å; S204-G207 PolarHBondContact O-N 2.75Å; S204-L209 WeakPolarHBondContact OG-CD2 3.28Å; S204-Y234 WeakPolarHBondContact OG-CD2 3.25Å
205	K	93.9	Very high	93.8	Very high	125 Å²	125	34.3 Å²	34.3	54%	0.543	17%	0.166	S	C	.	.	H	α-helix	trans	-56.6	-40.3	175.8	-71.3	170.9	-174	165.6	0	112	I201 E202 G207 I238	I201-K205 HydrophobicContact CG2-CD 4.3Å; I201-K205 WeakPolarHBondContact O-CG 3.32Å; I201-K205 PolarHBondContact O-N 3.41Å; E202-K205 PolarHBondContact O-N 2.64Å; E202-K205 IonicContact OE1-NZ 3.75Å; E202-K205 PolarHBondContact OE1-NZ 2.79Å; E202-K205 WeakPolarHBondContact OE2-CD 3.2Å; E202-K205 IonicContact OE2-NZ 3.48Å; E202-K205 PolarHBondContact OE2-NZ 2.97Å; K205-G207 VanDerWaalsContact C-N 3.29Å; K205-G207 PolarHBondContact O-N 3.4Å; K205-I238 HydrophobicContact CG-CD1 4.25Å
206	M	92.5	Very high	93.6	Very high	111 Å²	111	34.3 Å²	34.3	55%	0.547	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-0.6	-179.7	-59.5	-60.6	178.1	0	0	113.7	V94 E202 W203 S204 F208	V94-M206 HydrophobicContact CG2-CG 4.39Å; E202-M206 WeakPolarHBondContact O-CG 3.23Å; E202-M206 PolarHBondContact O-N 3.23Å; E202-M206 VanDerWaalsContact O-N 3.16Å; W203-M206 PolarHBondContact O-N 3.31Å; S204-M206 VanDerWaalsContact C-N 3.25Å; S204-M206 PolarHBondContact O-N 3.49Å; M206-F208 HydrophobicContact CB-CD2 3.79Å; M206-F208 HydrophobicContact CB-CE2 4.37Å; M206-F208 VanDerWaalsContact O-CD2 3.26Å; M206-F208 WeakPolarHBondContact O-CD2 3.28Å
207	G	91.8	Very high	93.3	Very high	12 Å²	12	34.3 Å²	34.3	12%	0.124	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.3	15.9	-179	0	0	0	0	0	115.4	W203 S204 K205	W203-G207 PolarHBondContact O-N 2.8Å; W203-G207 VanDerWaalsContact O-N 3.16Å; S204-G207 PolarHBondContact O-N 2.75Å; K205-G207 VanDerWaalsContact C-N 3.29Å; K205-G207 PolarHBondContact O-N 3.4Å
208	F	93.3	Very high	92.5	Very high	15 Å²	15	31.2 Å²	31.2	7%	0.066	15%	0.154	C	C	.	.			trans	-98.5	10.5	179	-76.3	-91.8	0	0	0	113.9	S92 V94 R114 Q116 W203 M206	S92-F208 WeakPolarHBondContact OG-CZ 3.43Å; V94-F208 HydrophobicContact CB-CD2 4.1Å; V94-F208 HydrophobicContact CB-CE1 4.44Å; V94-F208 HydrophobicContact CB-CE2 3.65Å; V94-F208 HydrophobicContact CB-CZ 3.82Å; V94-F208 HydrophobicContact CG1-CB 4.5Å; V94-F208 HydrophobicContact CG1-CD1 3.95Å; V94-F208 HydrophobicContact CG1-CD2 3.58Å; V94-F208 HydrophobicContact CG1-CE1 3.95Å; V94-F208 HydrophobicContact CG1-CE2 3.61Å; V94-F208 HydrophobicContact CG1-CG 3.75Å; V94-F208 HydrophobicContact CG1-CZ 3.77Å; V94-F208 HydrophobicContact CG2-CE2 4.48Å; R114-F208 HydrophobicContact CB-CB 4.35Å; R114-F208 HydrophobicContact CB-CD1 3.82Å; R114-F208 HydrophobicContact CB-CE1 4.47Å; R114-F208 HydrophobicContact CB-CG 4.3Å; R114-F208 HydrophobicContact CG-CB 4.05Å; R114-F208 HydrophobicContact CG-CD1 3.51Å; R114-F208 HydrophobicContact CG-CE1 4.38Å; R114-F208 HydrophobicContact CG-CG 4.16Å; Q116-F208 HydrophobicContact CB-CE1 4.24Å; Q116-F208 HydrophobicContact CG-CD1 3.78Å; Q116-F208 HydrophobicContact CG-CE1 3.76Å; Q116-F208 VanDerWaalsContact NE2-CD1 3.27Å; W203-F208 HydrophobicContact CB-CB 4.06Å; W203-F208 HydrophobicContact CG-CB 4.41Å; W203-F208 CarbonylContact O-C 3.47Å; W203-F208 WeakPolarHBondContact O-CA 3.42Å; W203-F208 PolarHBondContact O-N 2.91Å; M206-F208 HydrophobicContact CB-CD2 3.79Å; M206-F208 HydrophobicContact CB-CE2 4.37Å; M206-F208 VanDerWaalsContact O-CD2 3.26Å; M206-F208 WeakPolarHBondContact O-CD2 3.28Å
209	L	93.1	Very high	91.5	Very high	3 Å²	3	27.2 Å²	27.2	2%	0.016	14%	0.139	C	C	.	.	S	Bend	trans	-144.8	133.1	168.5	178.9	60.2	0	0	0	110.1	A200 W203 S204 D214 P216 I230 Y234 C248	A200-L209 HydrophobicContact CB-CD2 4.04Å; W203-L209 HydrophobicContact CB-CB 4.25Å; W203-L209 PolarHBondContact O-N 2.9Å; S204-L209 WeakPolarHBondContact OG-CD2 3.28Å; L209-D214 WeakPolarHBondContact CA-O 3.42Å; L209-P216 HydrophobicContact CD1-CG 3.76Å; L209-I230 HydrophobicContact CD1-CG2 4.19Å; L209-I230 HydrophobicContact CD2-CG2 3.69Å; L209-Y234 HydrophobicContact CD2-CD2 3.93Å; L209-Y234 HydrophobicContact CG-CD2 3.81Å; L209-Y234 HydrophobicContact CG-CE2 4.21Å; L209-C248 HydrophobicContact CD1-CB 4.22Å; L209-C248 VanDerWaalsContact CD1-O 3.29Å; L209-C248 WeakPolarHBondContact CD1-O 3.37Å
210	G	93	Very high	90.4	Very high	1 Å²	1	28 Å²	28	1%	0.01	14%	0.143	C	C	.	.	B	Isolated β-bridge	trans	156.2	150.7	171.2	0	0	0	0	0	113	G212 R213 D214 Y234	G210-G212 VanDerWaalsContact C-N 3.29Å; G210-G212 PolarHBondContact O-N 2.77Å; G210-R213 PolarHBondContact O-N 3.39Å; G210-D214 PolarHBondContact N-O 3.39Å; G210-D214 CarbonylContact O-C 3.59Å; G210-D214 PolarHBondContact O-N 3.47Å; G210-D214 VanDerWaalsContact O-O 3.1Å; G210-Y234 WeakPolarHBondContact CA-OH 3.41Å
211	P	93.4	Very high	89.5	Confident	7 Å²	7	28.8 Å²	28.8	5%	0.045	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-32.6	-166.4	23.8	-33.1	0	0	0	114	P123 V215 Y234 D242 D244 A247 W437	P123-P211 WeakPolarHBondContact CG-O 3.5Å; P211-V215 WeakPolarHBondContact O-CG2 3.42Å; P211-Y234 WeakPolarHBondContact CD-OH 2.98Å; P211-D242 WeakPolarHBondContact CG-OD2 3.33Å; P211-D244 HydrophobicContact CB-CB 4.27Å; P211-D244 HydrophobicContact CG-CB 4.27Å; P211-A247 HydrophobicContact CB-CB 3.88Å; P211-W437 PolarHBondContact O-NE1 3.39Å; P211-W437 VanDerWaalsContact O-NE1 3.14Å
212	G	93	Very high	88.8	Confident	49 Å²	49	26.6 Å²	26.6	51%	0.505	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.1	3.6	173.9	0	0	0	0	0	115.5	G210	G210-G212 VanDerWaalsContact C-N 3.29Å; G210-G212 PolarHBondContact O-N 2.77Å
213	R	91.8	Very high	88.2	Confident	164 Å²	164	26 Å²	26	62%	0.619	14%	0.14	S	C	*	.	T	Hydrogen-bonded Turn	trans	-117.1	-62.7	-175.8	-65.5	-171.5	-176.5	-157.5	3.4	113.1	P123 C124 G210	P123-R213 WeakPolarHBondContact CA-O 3.44Å; C124-R213 PolarHBondContact N-O 2.84Å; G210-R213 PolarHBondContact O-N 3.39Å
214	D	93.6	Very high	87.9	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	122.8	-178.9	-170.9	-9.7	0	0	0	108.5	R114 Q116 C124 L209 G210 P216	R114-D214 IonicContact CZ-OD1 3.95Å; R114-D214 IonicContact CZ-OD2 2.6Å; R114-D214 IonicContact NE-OD1 2.9Å; R114-D214 IonicContact NE-OD2 2.94Å; R114-D214 PolarHBondContact NE-OD2 2.84Å; R114-D214 IonicContact NH2-OD1 3.19Å; R114-D214 PolarHBondContact NH2-OD1 2.89Å; R114-D214 IonicContact NH2-OD2 3.14Å; Q116-D214 WeakPolarHBondContact CG-OD2 3.36Å; Q116-D214 VanDerWaalsContact NE2-CB 3.33Å; Q116-D214 PolarHBondContact NE2-OD2 3.15Å; C124-D214 HydrophobicContact CB-CB 4.23Å; C124-D214 CarbonylContact O-C 3.51Å; C124-D214 WeakPolarHBondContact O-CA 3.33Å; L209-D214 WeakPolarHBondContact CA-O 3.42Å; G210-D214 PolarHBondContact N-O 3.39Å; G210-D214 CarbonylContact O-C 3.59Å; G210-D214 PolarHBondContact O-N 3.47Å; G210-D214 VanDerWaalsContact O-O 3.1Å; D214-P216 WeakPolarHBondContact O-CD 3.43Å
215	V	94.2	Very high	87.8	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	101	-173.5	175.4	0	0	0	0	108.6	P123 C124 K125 P211 A247 C248 T250	P123-V215 HydrophobicContact CB-CG2 3.83Å; P123-V215 HydrophobicContact CG-CG2 3.82Å; C124-V215 PolarHBondContact O-N 2.88Å; K125-V215 HydrophobicContact CD-CB 3.99Å; K125-V215 HydrophobicContact CD-CG1 4.04Å; K125-V215 WeakPolarHBondContact CD-O 3.27Å; K125-V215 WeakPolarHBondContact CE-O 3.18Å; K125-V215 PolarHBondContact NZ-O 2.86Å; P211-V215 WeakPolarHBondContact O-CG2 3.42Å; V215-A247 WeakPolarHBondContact CG1-O 3.47Å; V215-A247 WeakPolarHBondContact CG2-O 3.42Å; V215-C248 WeakPolarHBondContact CA-O 3.22Å; V215-T250 HydrophobicContact CG1-CG2 3.83Å
216	P	92.3	Very high	87.7	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.136	C	C	.	.			trans	-67.7	177	173.7	-20.3	33.7	0	0	0	113.1	K125 G126 I144 L209 D214 C248 V249 T250	K125-P216 PolarHBondContact NZ-O 3.45Å; G126-P216 CarbonylContact O-C 3.24Å; G126-P216 VanDerWaalsContact O-CA 3.22Å; G126-P216 WeakPolarHBondContact O-CA 3.26Å; I144-P216 HydrophobicContact CD1-CB 3.75Å; I144-P216 HydrophobicContact CD1-CG 4.22Å; I144-P216 HydrophobicContact CG1-CB 3.84Å; L209-P216 HydrophobicContact CD1-CG 3.76Å; D214-P216 WeakPolarHBondContact O-CD 3.43Å; P216-C248 WeakPolarHBondContact CD-O 3.4Å; P216-V249 HydrophobicContact CB-CG2 4.14Å; P216-T250 PolarHBondContact O-N 3.05Å; P216-T250 PolarHBondContact O-OG1 3.2Å
217	A	87.1	Confident	87.8	Confident	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.11	C	C	.	.			trans	-154.5	179.2	162.5	0	0	0	0	0	106.8	G126 G143 I144 M227 T250	G126-A217 PolarHBondContact O-N 2.84Å; G143-A217 VanDerWaalsContact CA-O 3.26Å; G143-A217 WeakPolarHBondContact CA-O 3.49Å; I144-A217 PolarHBondContact N-O 2.94Å; I144-A217 VanDerWaalsContact N-O 3.15Å; A217-M227 VanDerWaalsContact CA-SD 3.6Å; A217-T250 VanDerWaalsContact CA-O 3.25Å; A217-T250 WeakPolarHBondContact CA-O 3.37Å; A217-T250 WeakPolarHBondContact CB-O 3.38Å; A217-T250 WeakPolarHBondContact CB-OG1 3.47Å
218	P	78.9	Confident	87.9	Confident	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.11	C	C	.	.			trans	-69.3	175.3	-176.2	3.3	6.6	0	0	0	112	K128 R129 G143 T222 M227 T250	K128-P218 CarbonylContact C-O 3.45Å; K128-P218 VanDerWaalsContact C-O 3.25Å; K128-P218 PolarHBondContact N-O 2.98Å; K128-P218 CarbonylContact O-C 3.55Å; R129-P218 HydrophobicContact CB-CB 4.47Å; R129-P218 HydrophobicContact CB-CG 3.85Å; R129-P218 HydrophobicContact CG-CG 4.03Å; G143-P218 WeakPolarHBondContact CA-O 3.43Å; P218-T222 WeakPolarHBondContact CA-OG1 3.37Å; P218-T222 WeakPolarHBondContact CB-O 3.48Å; P218-M227 HydrophobicContact CB-CE 4.08Å; P218-M227 HydrophobicContact CB-CG 4.16Å; P218-M227 HydrophobicContact CB-SD 4.33Å; P218-M227 HydrophobicContact CG-CG 3.58Å; P218-M227 HydrophobicContact CG-SD 4.16Å; P218-M227 VanDerWaalsContact N-SD 3.38Å; P218-T250 WeakPolarHBondContact CD-O 3.07Å
219	D	75.1	Confident	88	Confident	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.112	C	C	.	.			trans	-151.2	-157.1	178.4	-156.3	-85.8	0	0	0	112.4	K128 R130 F141 V142 G143 I144 R145 K177 G221 T222	K128-D219 WeakPolarHBondContact O-CA 3.12Å; K128-D219 PolarHBondContact O-N 3.03Å; R130-D219 VanDerWaalsContact CB-O 3.26Å; R130-D219 WeakPolarHBondContact CB-O 3.47Å; F141-D219 HydrophobicContact CB-CB 3.88Å; F141-D219 WeakPolarHBondContact CB-OD1 3.33Å; F141-D219 WeakPolarHBondContact CB-OD2 3.47Å; F141-D219 VanDerWaalsContact CG-C 3.48Å; V142-D219 VanDerWaalsContact CA-OD2 3.3Å; V142-D219 WeakPolarHBondContact CA-OD2 3.49Å; V142-D219 PolarHBondContact N-OD2 2.93Å; G143-D219 PolarHBondContact N-OD2 3.34Å; I144-D219 WeakPolarHBondContact O-CB 3.18Å; R145-D219 HydrophobicContact CB-CB 4.24Å; R145-D219 VanDerWaalsContact CB-OD1 3.26Å; R145-D219 WeakPolarHBondContact CB-OD1 3.14Å; R145-D219 WeakPolarHBondContact CG-OD1 3.37Å; R145-D219 IonicContact CZ-OD1 3.22Å; R145-D219 IonicContact NE-OD1 2.74Å; R145-D219 PolarHBondContact NE-OD1 3.33Å; R145-D219 IonicContact NH2-OD1 2.8Å; K177-D219 VanDerWaalsContact NZ-CG 3.28Å; K177-D219 IonicContact NZ-OD1 3.27Å; K177-D219 PolarHBondContact NZ-OD1 3.21Å; K177-D219 IonicContact NZ-OD2 2.92Å; K177-D219 PolarHBondContact NZ-OD2 3.09Å; D219-G221 PolarHBondContact O-N 3.1Å; D219-T222 PolarHBondContact N-OG1 3.39Å; D219-T222 PolarHBondContact O-N 3.33Å
220	M	69.5	Low	88.1	Confident	16 Å²	16	21.3 Å²	21.3	8%	0.079	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	132.5	162.3	-146.8	-177.1	-33.3	0	0	109.1	R139 F141 R145 F146 T222	R139-M220 HydrophobicContact CB-CE 3.7Å; R139-M220 HydrophobicContact CB-SD 4.27Å; R139-M220 HydrophobicContact CG-CE 3.9Å; R139-M220 HydrophobicContact CG-SD 3.87Å; F141-M220 VanDerWaalsContact CD2-CA 3.48Å; F141-M220 HydrophobicContact CD2-CB 3.52Å; F141-M220 HydrophobicContact CD2-CG 3.92Å; F141-M220 HydrophobicContact CE2-CB 3.92Å; F141-M220 HydrophobicContact CE2-CG 3.83Å; F141-M220 HydrophobicContact CG-CB 4.41Å; R145-M220 HydrophobicContact CG-CB 4.16Å; R145-M220 VanDerWaalsContact CZ-CE 3.4Å; F146-M220 PolarHBondContact N-O 3.22Å; M220-T222 PolarHBondContact O-N 3.01Å
221	G	75.4	Confident	88.2	Confident	20 Å²	20	21.2 Å²	21.2	21%	0.206	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.3	-2.9	178.5	0	0	0	0	0	115.2	D219	D219-G221 PolarHBondContact O-N 3.1Å
222	T	81.1	Confident	88.4	Confident	4 Å²	4	23.7 Å²	23.7	3%	0.025	12%	0.124	C	C	.	.			trans	-132.5	146.4	176.4	64.8	0	0	0	0	112.1	I144 F146 P218 D219 M220 E226	I144-T222 WeakPolarHBondContact O-CG2 3.49Å; I144-T222 PolarHBondContact O-OG1 3.46Å; F146-T222 HydrophobicContact CB-CG2 4.16Å; F146-T222 HydrophobicContact CD1-CG2 3.58Å; F146-T222 HydrophobicContact CD2-CG2 3.55Å; F146-T222 HydrophobicContact CE1-CG2 3.76Å; F146-T222 HydrophobicContact CE2-CG2 3.75Å; F146-T222 HydrophobicContact CG-CG2 3.47Å; F146-T222 VanDerWaalsContact CG-CG2 3.47Å; F146-T222 HydrophobicContact CZ-CG2 3.85Å; P218-T222 WeakPolarHBondContact CA-OG1 3.37Å; P218-T222 WeakPolarHBondContact CB-O 3.48Å; D219-T222 PolarHBondContact N-OG1 3.39Å; D219-T222 PolarHBondContact O-N 3.33Å; M220-T222 PolarHBondContact O-N 3.01Å; T222-E226 HydrophobicContact CG2-CB 4.25Å; T222-E226 HydrophobicContact CG2-CG 4.02Å
223	G	82.9	Confident	88.5	Confident	7 Å²	7	21.8 Å²	21.8	7%	0.072	10%	0.102	C	C	.	.			trans	-139.2	-153.8	-177.8	0	0	0	0	0	111.9	R225 E226 M227	G223-R225 VanDerWaalsContact C-N 3.26Å; G223-R225 PolarHBondContact O-N 3.07Å; G223-E226 PolarHBondContact N-OE2 3.4Å; G223-E226 PolarHBondContact O-N 3.06Å; G223-M227 WeakPolarHBondContact O-CG 3.22Å; G223-M227 PolarHBondContact O-N 3.43Å
224	E	87.1	Confident	88.7	Confident	30 Å²	30	14.9 Å²	14.9	14%	0.14	8%	0.077	C	C	.	.	H	α-helix	trans	-63.6	-32.9	179.8	-82.3	174.8	153.6	0	0	112.7	R129 W131 M227 A228 G251 P253	R129-E224 VanDerWaalsContact CZ-CG 3.44Å; R129-E224 IonicContact CZ-OE1 3.15Å; R129-E224 IonicContact CZ-OE2 2.81Å; R129-E224 IonicContact NH1-OE1 2.73Å; R129-E224 PolarHBondContact NH1-OE1 3.29Å; R129-E224 IonicContact NH1-OE2 3.82Å; R129-E224 IonicContact NH2-OE1 2.7Å; R129-E224 PolarHBondContact NH2-OE1 3.3Å; R129-E224 IonicContact NH2-OE2 3.73Å; R129-E224 PolarHBondContact NH2-OE2 2.91Å; W131-E224 HydrophobicContact CZ2-CB 4.04Å; W131-E224 VanDerWaalsContact NE1-N 3.11Å; W131-E224 PolarHBondContact NE1-OE2 3.37Å; E224-M227 PolarHBondContact O-N 2.87Å; E224-A228 VanDerWaalsContact O-CB 3.32Å; E224-A228 WeakPolarHBondContact O-CB 3.46Å; E224-A228 PolarHBondContact O-N 3.32Å; E224-G251 WeakPolarHBondContact CG-O 3.43Å; E224-P253 HydrophobicContact CB-CG 3.94Å; E224-P253 HydrophobicContact CG-CG 4.43Å; E224-P253 WeakPolarHBondContact O-CD 3.4Å; E224-P253 WeakPolarHBondContact OE1-CA 3.48Å
225	R	91.1	Very high	88.9	Confident	97 Å²	97	15.6 Å²	15.6	37%	0.366	8%	0.082	S	C	.	.	H	α-helix	trans	-60.1	-50	-179.8	-179.2	-179.5	65.3	174.2	3.5	110.8	T189 G223 M227 A228 W229	T189-R225 PolarHBondContact OG1-NH1 2.95Å; G223-R225 VanDerWaalsContact C-N 3.26Å; G223-R225 PolarHBondContact O-N 3.07Å; R225-M227 PolarHBondContact O-N 3.05Å; R225-A228 WeakPolarHBondContact O-CB 3.35Å; R225-A228 PolarHBondContact O-N 3.25Å; R225-W229 VanDerWaalsContact CD-CH2 3.43Å; R225-W229 HydrophobicContact CG-CD2 4.14Å; R225-W229 HydrophobicContact CG-CE3 4.22Å; R225-W229 HydrophobicContact CG-CH2 3.57Å; R225-W229 HydrophobicContact CG-CZ2 3.44Å; R225-W229 VanDerWaalsContact CG-CZ2 3.44Å; R225-W229 HydrophobicContact CG-CZ3 3.94Å; R225-W229 PolarHBondContact O-N 2.72Å
226	E	92.5	Very high	88.9	Confident	7 Å²	7	19.5 Å²	19.5	3%	0.033	11%	0.11	C	C	.	.	H	α-helix	trans	-66.8	-38.4	178.4	-64.8	68.9	-148	0	0	111.2	F146 T196 T222 G223 A228 W229 I230	F146-E226 HydrophobicContact CE2-CG 4.21Å; T196-E226 HydrophobicContact CG2-CB 4.07Å; T222-E226 HydrophobicContact CG2-CB 4.25Å; T222-E226 HydrophobicContact CG2-CG 4.02Å; G223-E226 PolarHBondContact N-OE2 3.4Å; G223-E226 PolarHBondContact O-N 3.06Å; E226-A228 VanDerWaalsContact C-N 3.32Å; E226-A228 PolarHBondContact O-N 3.27Å; E226-W229 HydrophobicContact CB-CE3 4.32Å; E226-W229 HydrophobicContact CG-CE3 4Å; E226-W229 HydrophobicContact CG-CZ3 3.92Å; E226-W229 PolarHBondContact O-N 3.49Å; E226-I230 VanDerWaalsContact O-CG1 3.26Å; E226-I230 WeakPolarHBondContact O-CG1 3.48Å; E226-I230 PolarHBondContact O-N 2.82Å
227	M	92.8	Very high	89.1	Confident	1 Å²	1	22.1 Å²	22.1	1%	0.005	13%	0.126	C	C	.	.	H	α-helix	trans	-67.8	-32.7	175.3	-58.7	-50.8	101.4	0	0	112.5	I144 A217 P218 G223 E224 R225 I230 A231 V249 T250 K252	I144-M227 HydrophobicContact CD1-CE 4.36Å; A217-M227 VanDerWaalsContact CA-SD 3.6Å; P218-M227 HydrophobicContact CB-CE 4.08Å; P218-M227 HydrophobicContact CB-CG 4.16Å; P218-M227 HydrophobicContact CB-SD 4.33Å; P218-M227 HydrophobicContact CG-CG 3.58Å; P218-M227 HydrophobicContact CG-SD 4.16Å; P218-M227 VanDerWaalsContact N-SD 3.38Å; G223-M227 WeakPolarHBondContact O-CG 3.22Å; G223-M227 PolarHBondContact O-N 3.43Å; E224-M227 PolarHBondContact O-N 2.87Å; R225-M227 PolarHBondContact O-N 3.05Å; M227-I230 HydrophobicContact CE-CD1 3.78Å; M227-I230 PolarHBondContact O-N 2.66Å; M227-I230 HydrophobicContact SD-CD1 4.23Å; M227-A231 VanDerWaalsContact O-CB 3.31Å; M227-A231 WeakPolarHBondContact O-CB 3.32Å; M227-A231 PolarHBondContact O-N 3.41Å; M227-V249 HydrophobicContact CB-CG2 4.16Å; M227-V249 HydrophobicContact CG-CG2 4.15Å; M227-V249 WeakPolarHBondContact O-CG1 3.49Å; M227-V249 HydrophobicContact SD-CG2 3.34Å; M227-V249 WeakPolarHBondContact SD-CG2 3.43Å; M227-T250 WeakPolarHBondContact CG-O 3.12Å; M227-K252 HydrophobicContact CB-CG 4.36Å
228	A	94.4	Very high	89.4	Confident	16 Å²	16	26.1 Å²	26.1	13%	0.132	15%	0.147	C	C	.	.	H	α-helix	trans	-65.2	-45	173.4	0	0	0	0	0	111.3	E224 R225 E226 A231 N232 P253 L256	E224-A228 VanDerWaalsContact O-CB 3.32Å; E224-A228 WeakPolarHBondContact O-CB 3.46Å; E224-A228 PolarHBondContact O-N 3.32Å; R225-A228 WeakPolarHBondContact O-CB 3.35Å; R225-A228 PolarHBondContact O-N 3.25Å; E226-A228 VanDerWaalsContact C-N 3.32Å; E226-A228 PolarHBondContact O-N 3.27Å; A228-A231 PolarHBondContact O-N 2.78Å; A228-N232 WeakPolarHBondContact O-CB 3.39Å; A228-N232 PolarHBondContact O-N 3.2Å; A228-P253 HydrophobicContact CB-CG 4.03Å; A228-L256 HydrophobicContact CB-CD1 3.5Å
229	W	96.1	Very high	90.1	Very high	25 Å²	25	26.3 Å²	26.3	10%	0.095	15%	0.148	C	C	.	.	H	α-helix	trans	-61.2	-42.6	174.4	-64.4	-38	0	0	0	112.3	T189 L192 E193 T196 R197 R225 E226 T233	T189-W229 HydrophobicContact CG2-CH2 4.05Å; T189-W229 HydrophobicContact CG2-CZ2 4.06Å; L192-W229 HydrophobicContact CB-CH2 4.18Å; L192-W229 HydrophobicContact CB-CZ3 4.02Å; E193-W229 HydrophobicContact CB-CD2 4.04Å; E193-W229 HydrophobicContact CB-CE3 4.27Å; E193-W229 HydrophobicContact CB-CH2 3.86Å; E193-W229 HydrophobicContact CB-CZ2 3.57Å; E193-W229 HydrophobicContact CB-CZ3 4.21Å; E193-W229 HydrophobicContact CG-CD2 3.91Å; E193-W229 HydrophobicContact CG-CG 4.03Å; E193-W229 HydrophobicContact CG-CZ2 4.08Å; E193-W229 PolarHBondContact OE1-NE1 3.06Å; E193-W229 PolarHBondContact OE2-NE1 3.32Å; T196-W229 HydrophobicContact CG2-CB 3.98Å; T196-W229 HydrophobicContact CG2-CE3 4.06Å; R197-W229 HydrophobicContact CG-CB 4.21Å; R225-W229 VanDerWaalsContact CD-CH2 3.43Å; R225-W229 HydrophobicContact CG-CD2 4.14Å; R225-W229 HydrophobicContact CG-CE3 4.22Å; R225-W229 HydrophobicContact CG-CH2 3.57Å; R225-W229 HydrophobicContact CG-CZ2 3.44Å; R225-W229 VanDerWaalsContact CG-CZ2 3.44Å; R225-W229 HydrophobicContact CG-CZ3 3.94Å; R225-W229 PolarHBondContact O-N 2.72Å; E226-W229 HydrophobicContact CB-CE3 4.32Å; E226-W229 HydrophobicContact CG-CE3 4Å; E226-W229 HydrophobicContact CG-CZ3 3.92Å; E226-W229 PolarHBondContact O-N 3.49Å; W229-T233 VanDerWaalsContact O-CB 3.3Å; W229-T233 WeakPolarHBondContact O-CB 3.06Å; W229-T233 PolarHBondContact O-N 3.14Å; W229-T233 PolarHBondContact O-OG1 3.38Å
230	I	95.4	Very high	90.9	Very high	3 Å²	3	32.5 Å²	32.5	2%	0.015	18%	0.177	C	C	.	.	H	α-helix	trans	-63.9	-49.9	176.5	-67.5	165.5	0	0	0	111.2	I144 T196 A200 L209 E226 M227 N232 T233 Y234 V249	I144-I230 HydrophobicContact CD1-CD1 3.32Å; T196-I230 HydrophobicContact CG2-CD1 4.03Å; T196-I230 HydrophobicContact CG2-CG1 3.6Å; A200-I230 HydrophobicContact CB-CB 4.48Å; A200-I230 HydrophobicContact CB-CG1 4.24Å; A200-I230 HydrophobicContact CB-CG2 4.29Å; L209-I230 HydrophobicContact CD1-CG2 4.19Å; L209-I230 HydrophobicContact CD2-CG2 3.69Å; E226-I230 VanDerWaalsContact O-CG1 3.26Å; E226-I230 WeakPolarHBondContact O-CG1 3.48Å; E226-I230 PolarHBondContact O-N 2.82Å; M227-I230 HydrophobicContact CE-CD1 3.78Å; M227-I230 PolarHBondContact O-N 2.66Å; M227-I230 HydrophobicContact SD-CD1 4.23Å; I230-N232 PolarHBondContact O-N 2.77Å; I230-T233 PolarHBondContact O-N 3.05Å; I230-Y234 WeakPolarHBondContact O-CB 3.37Å; I230-Y234 PolarHBondContact O-N 2.81Å; I230-V249 HydrophobicContact CB-CG1 4.5Å; I230-V249 HydrophobicContact CG2-CB 4.09Å; I230-V249 HydrophobicContact CG2-CG1 4.21Å; I230-V249 HydrophobicContact CG2-CG2 4.22Å
231	A	95.3	Very high	92.2	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-58.7	-48.5	180	0	0	0	0	0	111.3	M227 A228 Y234 A235 Y246 V249 K252	M227-A231 VanDerWaalsContact O-CB 3.31Å; M227-A231 WeakPolarHBondContact O-CB 3.32Å; M227-A231 PolarHBondContact O-N 3.41Å; A228-A231 PolarHBondContact O-N 2.78Å; A231-Y234 PolarHBondContact O-N 3.22Å; A231-A235 VanDerWaalsContact O-CB 3.31Å; A231-A235 WeakPolarHBondContact O-CB 3.41Å; A231-A235 PolarHBondContact O-N 2.79Å; A231-Y246 HydrophobicContact CB-CD1 4.03Å; A231-Y246 HydrophobicContact CB-CE1 4.37Å; A231-V249 HydrophobicContact CB-CG1 3.64Å; A231-K252 HydrophobicContact CB-CD 3.91Å
232	N	96.6	Very high	93	Very high	59 Å²	59	40.9 Å²	40.9	32%	0.316	22%	0.217	S	C	.	.	H	α-helix	trans	-61.1	-50.1	178.3	-174.5	26.3	0	0	0	111.3	R197 A228 I230 Y234 A235 S236	R197-N232 PolarHBondContact NH1-ND2 3.12Å; R197-N232 PolarHBondContact NH2-ND2 3.13Å; A228-N232 WeakPolarHBondContact O-CB 3.39Å; A228-N232 PolarHBondContact O-N 3.2Å; I230-N232 PolarHBondContact O-N 2.77Å; N232-Y234 PolarHBondContact O-N 2.83Å; N232-A235 PolarHBondContact O-N 2.92Å; N232-S236 WeakPolarHBondContact O-CB 3.44Å; N232-S236 PolarHBondContact O-N 2.81Å; N232-S236 PolarHBondContact O-OG 2.76Å; N232-S236 PolarHBondContact OD1-OG 2.91Å
233	T	96.3	Very high	93.6	Very high	8 Å²	8	47.8 Å²	47.8	5%	0.049	25%	0.246	C	C	.	.	H	α-helix	trans	-63.8	-39.2	179.4	-71.2	0	0	0	0	112.6	R197 A200 I201 W229 I230 T237	R197-T233 HydrophobicContact CB-CG2 4.39Å; R197-T233 WeakPolarHBondContact CD-OG1 3.42Å; R197-T233 WeakPolarHBondContact CG-OG1 3.45Å; R197-T233 PolarHBondContact NH1-OG1 3.24Å; A200-T233 HydrophobicContact CB-CG2 4.08Å; I201-T233 HydrophobicContact CD1-CG2 4.09Å; I201-T233 HydrophobicContact CG1-CG2 3.64Å; W229-T233 VanDerWaalsContact O-CB 3.3Å; W229-T233 WeakPolarHBondContact O-CB 3.06Å; W229-T233 PolarHBondContact O-N 3.14Å; W229-T233 PolarHBondContact O-OG1 3.38Å; I230-T233 PolarHBondContact O-N 3.05Å; T233-T237 WeakPolarHBondContact O-CB 3.42Å; T233-T237 WeakPolarHBondContact O-CG2 3.19Å; T233-T237 PolarHBondContact O-N 3.2Å; T233-T237 PolarHBondContact O-OG1 3.01Å
234	Y	95.9	Very high	94.2	Very high	19 Å²	19	48.2 Å²	48.2	8%	0.075	25%	0.247	C	C	.	.	H	α-helix	trans	-62.3	-53	174.9	-172.7	-97	0	0	0	111.2	S204 L209 G210 P211 I230 A231 N232 S236 T237 I238 G239 A245 C248	S204-Y234 WeakPolarHBondContact OG-CD2 3.25Å; L209-Y234 HydrophobicContact CD2-CD2 3.93Å; L209-Y234 HydrophobicContact CG-CD2 3.81Å; L209-Y234 HydrophobicContact CG-CE2 4.21Å; G210-Y234 WeakPolarHBondContact CA-OH 3.41Å; P211-Y234 WeakPolarHBondContact CD-OH 2.98Å; I230-Y234 WeakPolarHBondContact O-CB 3.37Å; I230-Y234 PolarHBondContact O-N 2.81Å; A231-Y234 PolarHBondContact O-N 3.22Å; N232-Y234 PolarHBondContact O-N 2.83Å; Y234-S236 PolarHBondContact O-N 3.12Å; Y234-T237 PolarHBondContact O-N 3.44Å; Y234-I238 HydrophobicContact CE2-CG2 4.41Å; Y234-I238 PolarHBondContact O-N 3.13Å; Y234-G239 WeakPolarHBondContact O-CA 3.4Å; Y234-G239 PolarHBondContact O-N 2.86Å; Y234-A245 HydrophobicContact CD1-CB 4.18Å; Y234-A245 HydrophobicContact CE1-CB 4.39Å; Y234-C248 VanDerWaalsContact CB-SG 3.59Å; Y234-C248 HydrophobicContact CD1-CB 3.49Å; Y234-C248 VanDerWaalsContact CD1-CB 3.49Å; Y234-C248 HydrophobicContact CD2-CB 4.32Å; Y234-C248 HydrophobicContact CE1-CB 3.78Å; Y234-C248 HydrophobicContact CG-CB 3.8Å
235	A	96	Very high	94.6	Very high	15 Å²	15	47 Å²	47	12%	0.124	24%	0.242	C	C	.	.	H	α-helix	trans	-63.4	-36.8	-178.4	0	0	0	0	0	113	A231 N232 T237 H240 A245 Y246	A231-A235 VanDerWaalsContact O-CB 3.31Å; A231-A235 WeakPolarHBondContact O-CB 3.41Å; A231-A235 PolarHBondContact O-N 2.79Å; N232-A235 PolarHBondContact O-N 2.92Å; A235-T237 VanDerWaalsContact C-N 3.33Å; A235-T237 PolarHBondContact O-N 2.86Å; A235-H240 WeakPolarHBondContact O-CA 3.37Å; A235-H240 PolarHBondContact O-N 3.42Å; A235-A245 HydrophobicContact CB-CB 3.82Å; A235-Y246 HydrophobicContact CB-CE2 4.09Å
236	S	95.6	Very high	94.7	Very high	82 Å²	82	47.3 Å²	47.3	57%	0.573	24%	0.244	S	C	*	.	H	α-helix	trans	-80.3	-6.6	178.3	-56.5	0	0	0	0	114.8	N232 Y234	N232-S236 WeakPolarHBondContact O-CB 3.44Å; N232-S236 PolarHBondContact O-N 2.81Å; N232-S236 PolarHBondContact O-OG 2.76Å; N232-S236 PolarHBondContact OD1-OG 2.91Å; Y234-S236 PolarHBondContact O-N 3.12Å
237	T	96	Very high	94.8	Very high	55 Å²	55	47 Å²	47	34%	0.337	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-126	-94.3	-176.8	63.7	0	0	0	0	112.1	T233 Y234 A235 G239 H240	T233-T237 WeakPolarHBondContact O-CB 3.42Å; T233-T237 WeakPolarHBondContact O-CG2 3.19Å; T233-T237 PolarHBondContact O-N 3.2Å; T233-T237 PolarHBondContact O-OG1 3.01Å; Y234-T237 PolarHBondContact O-N 3.44Å; A235-T237 VanDerWaalsContact C-N 3.33Å; A235-T237 PolarHBondContact O-N 2.86Å; T237-G239 PolarHBondContact O-N 3.14Å; T237-H240 PolarHBondContact O-ND1 2.97Å
238	I	93.6	Very high	94.9	Very high	85 Å²	85	47 Å²	47	44%	0.436	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-30.2	-172.3	-71.6	160.3	0	0	0	111.5	K205 Y234	K205-I238 HydrophobicContact CG-CD1 4.25Å; Y234-I238 HydrophobicContact CE2-CG2 4.41Å; Y234-I238 PolarHBondContact O-N 3.13Å
239	G	92.4	Very high	94.8	Very high	3 Å²	3	46.2 Å²	46.2	3%	0.031	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.2	13.5	178.7	0	0	0	0	0	115.6	Y234 T237 L241 D242	Y234-G239 WeakPolarHBondContact O-CA 3.4Å; Y234-G239 PolarHBondContact O-N 2.86Å; T237-G239 PolarHBondContact O-N 3.14Å; G239-L241 PolarHBondContact O-N 3.4Å; G239-L241 VanDerWaalsContact O-N 3.12Å; G239-D242 WeakPolarHBondContact O-CB 2.84Å; G239-D242 PolarHBondContact O-N 3.04Å
240	H	93.8	Very high	94.6	Very high	131 Å²	131	45 Å²	45	61%	0.606	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-18.5	-171.7	72.9	-82.5	0	0	0	115.6	A235 T237	A235-H240 WeakPolarHBondContact O-CA 3.37Å; A235-H240 PolarHBondContact O-N 3.42Å; T237-H240 PolarHBondContact O-ND1 2.97Å
241	L	95.1	Very high	94.2	Very high	154 Å²	154	44.9 Å²	44.9	81%	0.806	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.8	-3.1	172.2	-56.3	179.2	0	0	0	113	G239 K243	G239-L241 PolarHBondContact O-N 3.4Å; G239-L241 VanDerWaalsContact O-N 3.12Å; L241-K243 PolarHBondContact O-N 3.47Å
242	D	93.6	Very high	94	Very high	58 Å²	58	44.9 Å²	44.9	31%	0.31	23%	0.231	S	C	.	.			trans	-86	112	-177.4	-172.3	-9.8	0	0	0	109.9	P211 G239 D244 A245	P211-D242 WeakPolarHBondContact CG-OD2 3.33Å; G239-D242 WeakPolarHBondContact O-CB 2.84Å; G239-D242 PolarHBondContact O-N 3.04Å; D242-D244 PolarHBondContact O-N 2.83Å; D242-D244 VanDerWaalsContact O-N 3.1Å; D242-D244 PolarHBondContact OD1-N 3.18Å; D242-A245 HydrophobicContact CB-CB 4.28Å; D242-A245 VanDerWaalsContact O-CB 3.27Å; D242-A245 WeakPolarHBondContact O-CB 3.4Å; D242-A245 PolarHBondContact O-N 3.16Å
243	K	93.4	Very high	93.7	Very high	149 Å²	149	43.1 Å²	43.1	65%	0.648	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-28.1	175.7	66.7	171.3	-169.1	71.8	0	112.5	L241 H443	L241-K243 PolarHBondContact O-N 3.47Å; K243-H443 PolarHBondContact O-CE1 3.11Å; K243-H443 PolarHBondContact O-NE2 3.13Å
244	D	94.9	Very high	93.4	Very high	15 Å²	15	47.1 Å²	47.1	8%	0.08	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	16.7	-177.5	-58.7	-34	0	0	0	112.2	P211 D242 Y246 A247 M441 H443	P211-D244 HydrophobicContact CB-CB 4.27Å; P211-D244 HydrophobicContact CG-CB 4.27Å; D242-D244 PolarHBondContact O-N 2.83Å; D242-D244 VanDerWaalsContact O-N 3.1Å; D242-D244 PolarHBondContact OD1-N 3.18Å; D244-Y246 VanDerWaalsContact C-N 3.26Å; D244-Y246 PolarHBondContact O-N 2.9Å; D244-Y246 VanDerWaalsContact O-N 3.08Å; D244-A247 HydrophobicContact CB-CB 4.45Å; D244-A247 WeakPolarHBondContact O-CA 3.12Å; D244-A247 VanDerWaalsContact O-CB 3.23Å; D244-A247 WeakPolarHBondContact O-CB 3.44Å; D244-A247 PolarHBondContact O-N 3.1Å; D244-M441 HydrophobicContact CB-CE 4.18Å; D244-M441 HydrophobicContact CB-SD 3.74Å; D244-M441 WeakPolarHBondContact OD2-CE 3.2Å; D244-H443 IonicContact OD1-CD2 3.77Å; D244-H443 IonicContact OD1-CE1 2.86Å; D244-H443 IonicContact OD1-NE2 2.84Å; D244-H443 PolarHBondContact OD1-NE2 3.25Å
245	A	95.2	Very high	93.2	Very high	5 Å²	5	51.8 Å²	51.8	4%	0.041	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-51	-38.8	-174.5	0	0	0	0	0	114.5	Y234 A235 D242 A247 C248	Y234-A245 HydrophobicContact CD1-CB 4.18Å; Y234-A245 HydrophobicContact CE1-CB 4.39Å; A235-A245 HydrophobicContact CB-CB 3.82Å; D242-A245 HydrophobicContact CB-CB 4.28Å; D242-A245 VanDerWaalsContact O-CB 3.27Å; D242-A245 WeakPolarHBondContact O-CB 3.4Å; D242-A245 PolarHBondContact O-N 3.16Å; A245-A247 PolarHBondContact O-N 2.9Å; A245-C248 WeakPolarHBondContact O-CB 3.31Å; A245-C248 PolarHBondContact O-N 2.9Å; A245-C248 VanDerWaalsContact O-N 3.08Å; A245-C248 PolarHBondContact O-SG 2.65Å
246	Y	94.2	Very high	93	Very high	103 Å²	103	54 Å²	54	40%	0.404	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-71.9	-11.7	177.4	-75.3	-84.9	0	0	0	114.3	A231 A235 D244 C248 K252	A231-Y246 HydrophobicContact CB-CD1 4.03Å; A231-Y246 HydrophobicContact CB-CE1 4.37Å; A235-Y246 HydrophobicContact CB-CE2 4.09Å; D244-Y246 VanDerWaalsContact C-N 3.26Å; D244-Y246 PolarHBondContact O-N 2.9Å; D244-Y246 VanDerWaalsContact O-N 3.08Å; Y246-C248 VanDerWaalsContact C-N 3.27Å; Y246-K252 WeakPolarHBondContact O-CE 3.45Å; Y246-K252 PolarHBondContact O-NZ 2.92Å; Y246-K252 VanDerWaalsContact O-NZ 3.13Å
247	A	94.8	Very high	92.7	Very high	1 Å²	1	50.9 Å²	50.9	1%	0.008	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-80.7	-3.1	168.8	0	0	0	0	0	112.9	P211 V215 D244 A245 V249 W437 N440 M441	P211-A247 HydrophobicContact CB-CB 3.88Å; V215-A247 WeakPolarHBondContact CG1-O 3.47Å; V215-A247 WeakPolarHBondContact CG2-O 3.42Å; D244-A247 HydrophobicContact CB-CB 4.45Å; D244-A247 WeakPolarHBondContact O-CA 3.12Å; D244-A247 VanDerWaalsContact O-CB 3.23Å; D244-A247 WeakPolarHBondContact O-CB 3.44Å; D244-A247 PolarHBondContact O-N 3.1Å; A245-A247 PolarHBondContact O-N 2.9Å; A247-V249 PolarHBondContact O-N 3.47Å; A247-V249 VanDerWaalsContact O-N 3.12Å; A247-W437 VanDerWaalsContact O-CD1 3.28Å; A247-N440 HydrophobicContact CB-CB 3.71Å; A247-M441 HydrophobicContact CB-CG 4.38Å; A247-M441 HydrophobicContact CB-SD 3.76Å
248	C	93.9	Very high	92.4	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-61.4	-19.1	176.4	77.2	0	0	0	0	113.7	L209 V215 P216 Y234 A245 Y246	L209-C248 HydrophobicContact CD1-CB 4.22Å; L209-C248 VanDerWaalsContact CD1-O 3.29Å; L209-C248 WeakPolarHBondContact CD1-O 3.37Å; V215-C248 WeakPolarHBondContact CA-O 3.22Å; P216-C248 WeakPolarHBondContact CD-O 3.4Å; Y234-C248 VanDerWaalsContact CB-SG 3.59Å; Y234-C248 HydrophobicContact CD1-CB 3.49Å; Y234-C248 VanDerWaalsContact CD1-CB 3.49Å; Y234-C248 HydrophobicContact CD2-CB 4.32Å; Y234-C248 HydrophobicContact CE1-CB 3.78Å; Y234-C248 HydrophobicContact CG-CB 3.8Å; A245-C248 WeakPolarHBondContact O-CB 3.31Å; A245-C248 PolarHBondContact O-N 2.9Å; A245-C248 VanDerWaalsContact O-N 3.08Å; A245-C248 PolarHBondContact O-SG 2.65Å; Y246-C248 VanDerWaalsContact C-N 3.27Å
249	V	93.8	Very high	92.3	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.24	C	C	.	.			trans	-148	154.4	-178.8	69.9	0	0	0	0	110.3	P216 M227 I230 A231 A247 K252	P216-V249 HydrophobicContact CB-CG2 4.14Å; M227-V249 HydrophobicContact CB-CG2 4.16Å; M227-V249 HydrophobicContact CG-CG2 4.15Å; M227-V249 WeakPolarHBondContact O-CG1 3.49Å; M227-V249 HydrophobicContact SD-CG2 3.34Å; M227-V249 WeakPolarHBondContact SD-CG2 3.43Å; I230-V249 HydrophobicContact CB-CG1 4.5Å; I230-V249 HydrophobicContact CG2-CB 4.09Å; I230-V249 HydrophobicContact CG2-CG1 4.21Å; I230-V249 HydrophobicContact CG2-CG2 4.22Å; A231-V249 HydrophobicContact CB-CG1 3.64Å; A247-V249 PolarHBondContact O-N 3.47Å; A247-V249 VanDerWaalsContact O-N 3.12Å; V249-K252 HydrophobicContact CG1-CD 3.97Å; V249-K252 HydrophobicContact CG1-CG 4Å; V249-K252 PolarHBondContact O-NZ 3.32Å
250	T	91.7	Very high	92.1	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.27	C	S	.	.	S	Bend	trans	-125.3	169.5	-179.7	49.5	0	0	0	0	110.8	K125 V215 P216 A217 P218 M227 K252 S433 E436 W437	K125-T250 WeakPolarHBondContact CE-OG1 3.32Å; K125-T250 PolarHBondContact NZ-OG1 2.92Å; V215-T250 HydrophobicContact CG1-CG2 3.83Å; P216-T250 PolarHBondContact O-N 3.05Å; P216-T250 PolarHBondContact O-OG1 3.2Å; A217-T250 VanDerWaalsContact CA-O 3.25Å; A217-T250 WeakPolarHBondContact CA-O 3.37Å; A217-T250 WeakPolarHBondContact CB-O 3.38Å; A217-T250 WeakPolarHBondContact CB-OG1 3.47Å; P218-T250 WeakPolarHBondContact CD-O 3.07Å; M227-T250 WeakPolarHBondContact CG-O 3.12Å; T250-K252 VanDerWaalsContact C-N 3.32Å; T250-S433 WeakPolarHBondContact CG2-O 3.47Å; T250-E436 VanDerWaalsContact CA-OE1 3.23Å; T250-E436 WeakPolarHBondContact CA-OE1 3.45Å; T250-E436 HydrophobicContact CG2-CB 4.24Å; T250-E436 HydrophobicContact CG2-CG 4.44Å; T250-W437 HydrophobicContact CG2-CB 4.07Å
251	G	86.3	Confident	91.6	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.264	C	S	.	.	S	Bend	trans	72.9	26.6	-169.2	0	0	0	0	0	112.9	E224 E436	E224-G251 WeakPolarHBondContact CG-O 3.43Å; G251-E436 WeakPolarHBondContact CA-OE2 3.43Å; G251-E436 PolarHBondContact N-OE1 3.42Å; G251-E436 PolarHBondContact N-OE2 3.19Å
252	K	91	Very high	90.9	Very high	1 Å²	1	40.7 Å²	40.7	0%	0.004	23%	0.226	C	C	.	.			trans	-72.2	159.9	176.8	-62	-176.7	-59.5	-62.3	0	111.4	M227 A231 Y246 V249 T250 L256 G258 E436 N440	M227-K252 HydrophobicContact CB-CG 4.36Å; A231-K252 HydrophobicContact CB-CD 3.91Å; Y246-K252 WeakPolarHBondContact O-CE 3.45Å; Y246-K252 PolarHBondContact O-NZ 2.92Å; Y246-K252 VanDerWaalsContact O-NZ 3.13Å; V249-K252 HydrophobicContact CG1-CD 3.97Å; V249-K252 HydrophobicContact CG1-CG 4Å; V249-K252 PolarHBondContact O-NZ 3.32Å; T250-K252 VanDerWaalsContact C-N 3.32Å; K252-L256 VanDerWaalsContact CD-O 3.3Å; K252-L256 WeakPolarHBondContact CD-O 3.45Å; K252-L256 WeakPolarHBondContact CE-O 3.31Å; K252-G258 WeakPolarHBondContact O-CA 3.02Å; K252-E436 PolarHBondContact N-OE1 3.45Å; K252-E436 VanDerWaalsContact N-OE1 3.14Å; K252-E436 IonicContact NZ-OE1 2.95Å; K252-E436 PolarHBondContact NZ-OE1 3.31Å; K252-N440 WeakPolarHBondContact CE-OD1 3.15Å; K252-N440 PolarHBondContact NZ-ND2 3.12Å; K252-N440 VanDerWaalsContact NZ-ND2 3.1Å
253	P	90.6	Very high	90.1	Very high	21 Å²	21	39.7 Å²	39.7	14%	0.136	22%	0.223	C	C	.	.			trans	-51.4	148.9	164	-22.3	29.4	0	0	0	112.2	E224 A228 C255 L256 G258	E224-P253 HydrophobicContact CB-CG 3.94Å; E224-P253 HydrophobicContact CG-CG 4.43Å; E224-P253 WeakPolarHBondContact O-CD 3.4Å; E224-P253 WeakPolarHBondContact OE1-CA 3.48Å; A228-P253 HydrophobicContact CB-CG 4.03Å; P253-C255 VanDerWaalsContact CB-SG 3.58Å; P253-C255 PolarHBondContact O-N 3.39Å; P253-L256 HydrophobicContact CB-CB 4.4Å; P253-L256 HydrophobicContact CG-CB 4.46Å; P253-L256 HydrophobicContact CG-CD1 4.1Å; P253-L256 HydrophobicContact CG-CG 4.44Å; P253-L256 CarbonylContact O-C 3.52Å; P253-L256 PolarHBondContact O-N 2.98Å; P253-G258 WeakPolarHBondContact O-CA 3.4Å; P253-G258 PolarHBondContact O-N 2.96Å
254	L	90.7	Very high	89.8	Confident	93 Å²	93	36.3 Å²	36.3	49%	0.487	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-56.7	-36.7	176.1	-64	179.3	0	0	0	112.8	L256 G257 I259 N260	L254-L256 VanDerWaalsContact C-N 3.27Å; L254-L256 PolarHBondContact O-N 2.89Å; L254-G257 PolarHBondContact O-N 3.42Å; L254-I259 VanDerWaalsContact CD2-C 3.5Å; L254-N260 VanDerWaalsContact CD1-OD1 3.3Å; L254-N260 WeakPolarHBondContact CD1-OD1 3.42Å; L254-N260 VanDerWaalsContact CD2-OD1 3.22Å; L254-N260 WeakPolarHBondContact CD2-OD1 3.36Å
255	C	91.6	Very high	89.5	Confident	117 Å²	117	36 Å²	36	79%	0.791	21%	0.209	S	C	*	.	G	3₁₀ helix	trans	-69.6	-18.2	175.9	56.2	0	0	0	0	114.3	P253	P253-C255 VanDerWaalsContact CB-SG 3.58Å; P253-C255 PolarHBondContact O-N 3.39Å
256	L	90.9	Very high	89.1	Confident	60 Å²	60	36.1 Å²	36.1	31%	0.314	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-110.4	34.5	177.1	-64.5	-179.1	0	0	0	111.9	A228 K252 P253 L254	A228-L256 HydrophobicContact CB-CD1 3.5Å; K252-L256 VanDerWaalsContact CD-O 3.3Å; K252-L256 WeakPolarHBondContact CD-O 3.45Å; K252-L256 WeakPolarHBondContact CE-O 3.31Å; P253-L256 HydrophobicContact CB-CB 4.4Å; P253-L256 HydrophobicContact CG-CB 4.46Å; P253-L256 HydrophobicContact CG-CD1 4.1Å; P253-L256 HydrophobicContact CG-CG 4.44Å; P253-L256 CarbonylContact O-C 3.52Å; P253-L256 PolarHBondContact O-N 2.98Å; L254-L256 VanDerWaalsContact C-N 3.27Å; L254-L256 PolarHBondContact O-N 2.89Å
257	G	89.8	Confident	89	Confident	17 Å²	17	31.2 Å²	31.2	18%	0.175	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.1	9.2	176.2	0	0	0	0	0	115.5	L254 N440	L254-G257 PolarHBondContact O-N 3.42Å; G257-N440 PolarHBondContact O-ND2 2.68Å
258	G	90	Very high	88.9	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.214	C	C	.	.			trans	-59.9	168.2	170.4	0	0	0	0	0	113.7	K252 P253 K439	K252-G258 WeakPolarHBondContact O-CA 3.02Å; P253-G258 WeakPolarHBondContact O-CA 3.4Å; P253-G258 PolarHBondContact O-N 2.96Å; G258-K439 PolarHBondContact O-NZ 2.96Å
259	I	90.3	Very high	88.9	Confident	38 Å²	38	38.3 Å²	38.3	20%	0.195	22%	0.22	C	C	.	.			trans	-118.1	141.5	-179.9	-160.4	169.3	0	0	0	113.1	L254 R262 V432 F435 E436	L254-I259 VanDerWaalsContact CD2-C 3.5Å; I259-R262 HydrophobicContact CG2-CB 3.92Å; I259-R262 WeakPolarHBondContact O-CB 3.35Å; I259-V432 HydrophobicContact CG2-CG1 3.58Å; I259-F435 HydrophobicContact CD1-CB 3.66Å; I259-E436 HydrophobicContact CB-CB 4Å; I259-E436 HydrophobicContact CB-CG 4.11Å; I259-E436 HydrophobicContact CG2-CB 3.66Å; I259-E436 HydrophobicContact CG2-CG 4.11Å
260	N	88	Confident	88.9	Confident	125 Å²	125	38.3 Å²	38.3	67%	0.668	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.8	149.4	175.1	-73.1	-9.9	0	0	0	111.3	L254 R262	L254-N260 VanDerWaalsContact CD1-OD1 3.3Å; L254-N260 WeakPolarHBondContact CD1-OD1 3.42Å; L254-N260 VanDerWaalsContact CD2-OD1 3.22Å; L254-N260 WeakPolarHBondContact CD2-OD1 3.36Å; N260-R262 PolarHBondContact O-N 3.31Å; N260-R262 VanDerWaalsContact O-N 3.14Å
261	G	84.4	Confident	89.2	Confident	46 Å²	46	40.5 Å²	40.5	47%	0.474	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.9	-6.2	177.4	0	0	0	0	0	115.6	V263 Q264 A265	G261-V263 PolarHBondContact O-N 3.08Å; G261-V263 VanDerWaalsContact O-N 3.09Å; G261-Q264 PolarHBondContact O-N 3.42Å; G261-A265 PolarHBondContact O-N 3.45Å
262	R	79.3	Confident	89.6	Confident	5 Å²	5	44.4 Å²	44.4	2%	0.019	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-32.3	-177.6	-178.1	59.1	-167.7	89.6	-8.9	114	G127 I259 N260 A265 G429 V432 S433	G127-R262 PolarHBondContact O-NH2 2.8Å; I259-R262 HydrophobicContact CG2-CB 3.92Å; I259-R262 WeakPolarHBondContact O-CB 3.35Å; N260-R262 PolarHBondContact O-N 3.31Å; N260-R262 VanDerWaalsContact O-N 3.14Å; R262-A265 WeakPolarHBondContact O-CB 3.4Å; R262-G429 PolarHBondContact NE-O 3.44Å; R262-G429 VanDerWaalsContact NH2-C 3.34Å; R262-G429 PolarHBondContact NH2-O 3.28Å; R262-V432 HydrophobicContact CB-CG1 4.04Å; R262-V432 HydrophobicContact CG-CG1 4.49Å; R262-S433 PolarHBondContact NE-OG 3.35Å; R262-S433 PolarHBondContact NH2-OG 3.39Å
263	V	78	Confident	89.8	Confident	38 Å²	38	44.5 Å²	44.5	23%	0.23	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-46.2	177.3	-170.9	0	0	0	0	111.2	G261 Y309	G261-V263 PolarHBondContact O-N 3.08Å; G261-V263 VanDerWaalsContact O-N 3.09Å; V263-Y309 HydrophobicContact CB-CE2 4.49Å; V263-Y309 HydrophobicContact CG1-CD2 4.41Å; V263-Y309 HydrophobicContact CG1-CE2 3.68Å
264	Q	87.5	Confident	90.1	Very high	77 Å²	77	43.5 Å²	43.5	36%	0.36	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81	-20.7	-175.3	-44.4	-171.5	-8.4	0	0	112.4	G261 T266 G267 R268 Y309 F313	G261-Q264 PolarHBondContact O-N 3.42Å; Q264-T266 VanDerWaalsContact C-N 3.3Å; Q264-T266 PolarHBondContact O-N 2.97Å; Q264-T266 VanDerWaalsContact O-N 3.16Å; Q264-G267 PolarHBondContact O-N 3.45Å; Q264-G267 VanDerWaalsContact O-N 3.1Å; Q264-R268 PolarHBondContact O-N 2.82Å; Q264-Y309 HydrophobicContact CB-CD1 4.01Å; Q264-Y309 HydrophobicContact CB-CD2 4.3Å; Q264-Y309 HydrophobicContact CB-CE1 4.35Å; Q264-Y309 HydrophobicContact CB-CG 4.02Å; Q264-Y309 HydrophobicContact CG-CD1 3.73Å; Q264-Y309 HydrophobicContact CG-CD2 4.17Å; Q264-Y309 HydrophobicContact CG-CE1 3.55Å; Q264-Y309 HydrophobicContact CG-CE2 4.01Å; Q264-Y309 HydrophobicContact CG-CG 4.07Å; Q264-F313 HydrophobicContact CB-CE2 4.21Å; Q264-F313 HydrophobicContact CB-CZ 4.18Å
265	A	87.9	Confident	90.3	Very high	9 Å²	9	41.5 Å²	41.5	7%	0.074	23%	0.233	C	C	.	.	H	α-helix	trans	-51.2	-39.1	-173	0	0	0	0	0	115.2	G261 R262 G269 G428 V432	G261-A265 PolarHBondContact O-N 3.45Å; R262-A265 WeakPolarHBondContact O-CB 3.4Å; A265-G269 PolarHBondContact O-N 3.24Å; A265-G428 CarbonylContact O-C 3.6Å; A265-V432 HydrophobicContact CB-CB 3.64Å; A265-V432 HydrophobicContact CB-CG1 4.19Å; A265-V432 HydrophobicContact CB-CG2 3.44Å; A265-V432 VanDerWaalsContact CB-CG2 3.44Å
266	T	87.2	Confident	90.4	Very high	7 Å²	7	42.3 Å²	42.3	4%	0.043	22%	0.224	C	C	.	.	H	α-helix	trans	-68	-49.7	178.8	-46	0	0	0	0	110.5	K128 Q264 G269 V270 V306 N426	K128-T266 HydrophobicContact CD-CG2 4.4Å; Q264-T266 VanDerWaalsContact C-N 3.3Å; Q264-T266 PolarHBondContact O-N 2.97Å; Q264-T266 VanDerWaalsContact O-N 3.16Å; T266-G269 WeakPolarHBondContact O-CA 3.35Å; T266-G269 PolarHBondContact O-N 2.84Å; T266-G269 VanDerWaalsContact O-N 3.09Å; T266-V270 WeakPolarHBondContact O-CG2 2.98Å; T266-V270 PolarHBondContact O-N 3.34Å; T266-V306 HydrophobicContact CG2-CG1 3.89Å; T266-V306 HydrophobicContact CG2-CG2 3.82Å; T266-N426 HydrophobicContact CG2-CB 4.3Å
267	G	91.1	Very high	90.6	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-67	-36.3	179.9	0	0	0	0	0	113.1	Q264 G269 V270 W271 T310	Q264-G267 PolarHBondContact O-N 3.45Å; Q264-G267 VanDerWaalsContact O-N 3.1Å; G267-G269 VanDerWaalsContact C-N 3.27Å; G267-G269 PolarHBondContact O-N 3.36Å; G267-V270 PolarHBondContact O-N 2.91Å; G267-W271 PolarHBondContact O-N 2.88Å; G267-T310 VanDerWaalsContact CA-OG1 3.22Å; G267-T310 WeakPolarHBondContact CA-OG1 3.48Å
268	R	92.7	Very high	90.8	Very high	140 Å²	140	41 Å²	41	53%	0.528	21%	0.21	S	C	.	.	H	α-helix	trans	-63.6	-32.9	170.5	-162.7	173.4	-179.9	-176.7	0.6	112.4	Q264 W271 N272 F313	Q264-R268 PolarHBondContact O-N 2.82Å; R268-W271 HydrophobicContact CG-CE3 4.14Å; R268-N272 WeakPolarHBondContact O-CB 3.3Å; R268-N272 VanDerWaalsContact O-CG 3.29Å; R268-N272 PolarHBondContact O-N 2.98Å; R268-F313 HydrophobicContact CB-CD2 3.9Å; R268-F313 HydrophobicContact CB-CE2 3.55Å; R268-F313 HydrophobicContact CB-CZ 4.16Å; R268-F313 HydrophobicContact CG-CD2 4.27Å; R268-F313 HydrophobicContact CG-CE2 4.06Å; R268-F313 HydrophobicContact CG-CZ 4.31Å
269	G	93.9	Very high	91	Very high	11 Å²	11	45 Å²	45	11%	0.113	23%	0.232	C	C	.	.	H	α-helix	trans	-64.7	-45.2	171.9	0	0	0	0	0	112.7	A265 T266 G267 W271 N272 A273 T425	A265-G269 PolarHBondContact O-N 3.24Å; T266-G269 WeakPolarHBondContact O-CA 3.35Å; T266-G269 PolarHBondContact O-N 2.84Å; T266-G269 VanDerWaalsContact O-N 3.09Å; G267-G269 VanDerWaalsContact C-N 3.27Å; G267-G269 PolarHBondContact O-N 3.36Å; G269-W271 VanDerWaalsContact C-N 3.34Å; G269-W271 PolarHBondContact O-N 3.43Å; G269-N272 PolarHBondContact O-N 2.78Å; G269-A273 WeakPolarHBondContact O-CB 3.17Å; G269-A273 PolarHBondContact O-N 3.16Å; G269-T425 CarbonylContact C-O 3.57Å
270	V	95	Very high	91.2	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-61.7	-44.2	175.5	-179.2	0	0	0	0	110.6	T266 G267 A273 L274 V306 T310 I375 A397 A399 T425	T266-V270 WeakPolarHBondContact O-CG2 2.98Å; T266-V270 PolarHBondContact O-N 3.34Å; G267-V270 PolarHBondContact O-N 2.91Å; V270-A273 PolarHBondContact O-N 3.11Å; V270-L274 HydrophobicContact CG1-CD1 4.14Å; V270-L274 WeakPolarHBondContact O-CB 3.29Å; V270-L274 PolarHBondContact O-N 2.99Å; V270-V306 HydrophobicContact CG2-CG1 4.33Å; V270-T310 HydrophobicContact CB-CG2 4Å; V270-T310 HydrophobicContact CG1-CG2 3.62Å; V270-I375 HydrophobicContact CG1-CG2 4.46Å; V270-A397 HydrophobicContact CG1-CB 4.21Å; V270-A399 HydrophobicContact CG1-CB 4.23Å; V270-A399 HydrophobicContact CG2-CB 3.75Å; V270-T425 WeakPolarHBondContact CA-O 3.22Å; V270-T425 HydrophobicContact CB-CG2 4.29Å; V270-T425 HydrophobicContact CG1-CG2 3.9Å; V270-T425 HydrophobicContact CG2-CG2 4.19Å; V270-T425 PolarHBondContact N-O 2.76Å
271	W	96.2	Very high	91.3	Very high	45 Å²	45	42.5 Å²	42.5	17%	0.17	22%	0.223	C	C	.	.	H	α-helix	trans	-60.4	-47.5	174.4	171.1	78	0	0	0	112.6	G267 R268 G269 A273 L274 N275 F313 S317	G267-W271 PolarHBondContact O-N 2.88Å; R268-W271 HydrophobicContact CG-CE3 4.14Å; G269-W271 VanDerWaalsContact C-N 3.34Å; G269-W271 PolarHBondContact O-N 3.43Å; W271-A273 VanDerWaalsContact C-N 3.32Å; W271-A273 PolarHBondContact O-N 3.12Å; W271-L274 PolarHBondContact O-N 3.4Å; W271-N275 VanDerWaalsContact O-CB 3.26Å; W271-N275 WeakPolarHBondContact O-CB 3.4Å; W271-N275 PolarHBondContact O-N 3.33Å; W271-F313 HydrophobicContact CB-CB 3.77Å; W271-F313 HydrophobicContact CD2-CB 4.07Å; W271-F313 HydrophobicContact CG-CB 3.57Å; W271-F313 PolarHBondContact NE1-O 2.81Å; W271-S317 PolarHBondContact NE1-OG 3.44Å
272	N	95.8	Very high	91.7	Very high	82 Å²	82	47.4 Å²	47.4	44%	0.439	23%	0.231	S	C	.	.	H	α-helix	trans	-57.1	-44.8	175.2	-80.9	-19.3	0	0	0	111.7	R268 G269 N275 F276	R268-N272 WeakPolarHBondContact O-CB 3.3Å; R268-N272 VanDerWaalsContact O-CG 3.29Å; R268-N272 PolarHBondContact O-N 2.98Å; G269-N272 PolarHBondContact O-N 2.78Å; N272-N275 PolarHBondContact O-N 3.38Å; N272-F276 WeakPolarHBondContact O-CB 3.45Å; N272-F276 PolarHBondContact O-N 3.08Å
273	A	95.5	Very high	92.3	Very high	3 Å²	3	49.2 Å²	49.2	3%	0.025	24%	0.241	C	C	.	.	H	α-helix	trans	-62.8	-49.4	178.7	0	0	0	0	0	111.5	G269 V270 W271 F276 F277 Y424 T425	G269-A273 WeakPolarHBondContact O-CB 3.17Å; G269-A273 PolarHBondContact O-N 3.16Å; V270-A273 PolarHBondContact O-N 3.11Å; W271-A273 VanDerWaalsContact C-N 3.32Å; W271-A273 PolarHBondContact O-N 3.12Å; A273-F276 PolarHBondContact O-N 2.9Å; A273-F277 VanDerWaalsContact O-CD2 3.25Å; A273-F277 WeakPolarHBondContact O-CD2 3.37Å; A273-F277 PolarHBondContact O-N 2.63Å; A273-Y424 HydrophobicContact CB-CD1 4.03Å; A273-Y424 HydrophobicContact CB-CE1 3.57Å; A273-T425 HydrophobicContact CB-CG2 4.23Å
274	L	95.8	Very high	93	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-58	-49.5	174.8	-83	167.2	0	0	0	111.4	V270 W271 F276 F277 L278 L314 I373 I375 V395 A397 L420	V270-L274 HydrophobicContact CG1-CD1 4.14Å; V270-L274 WeakPolarHBondContact O-CB 3.29Å; V270-L274 PolarHBondContact O-N 2.99Å; W271-L274 PolarHBondContact O-N 3.4Å; L274-F276 VanDerWaalsContact C-N 3.3Å; L274-F276 PolarHBondContact O-N 3.19Å; L274-F277 PolarHBondContact O-N 3.4Å; L274-L278 HydrophobicContact CB-CD1 4.23Å; L274-L278 HydrophobicContact CD2-CD1 4.1Å; L274-L278 WeakPolarHBondContact O-CB 3.49Å; L274-L278 WeakPolarHBondContact O-CG 3.46Å; L274-L278 PolarHBondContact O-N 2.73Å; L274-L314 HydrophobicContact CD1-CD1 4.07Å; L274-L314 HydrophobicContact CD1-CD2 3.91Å; L274-I373 HydrophobicContact CD1-CG2 4.19Å; L274-I373 HydrophobicContact CD2-CD1 4.32Å; L274-I373 HydrophobicContact CD2-CG2 3.81Å; L274-I375 HydrophobicContact CD1-CD1 4.14Å; L274-V395 HydrophobicContact CD2-CG1 4.06Å; L274-A397 HydrophobicContact CD1-CB 3.97Å; L274-A397 HydrophobicContact CD2-CB 3.97Å; L274-A397 HydrophobicContact CG-CB 3.98Å; L274-L420 HydrophobicContact CD2-CD1 3.83Å; L274-L420 HydrophobicContact CG-CD1 4.16Å
275	N	95	Very high	93.2	Very high	51 Å²	51	51 Å²	51	27%	0.273	25%	0.247	S	C	.	.	H	α-helix	trans	-60.9	-37.8	179.5	-169.2	35.1	0	0	0	112.1	W271 N272 N279 L293	W271-N275 VanDerWaalsContact O-CB 3.26Å; W271-N275 WeakPolarHBondContact O-CB 3.4Å; W271-N275 PolarHBondContact O-N 3.33Å; N272-N275 PolarHBondContact O-N 3.38Å; N275-N279 WeakPolarHBondContact O-CB 3.5Å; N275-N279 PolarHBondContact O-N 2.88Å; N275-N279 PolarHBondContact O-ND2 3.01Å; N275-N279 PolarHBondContact OD1-ND2 3.01Å; N275-L293 HydrophobicContact CB-CD1 3.94Å
276	F	94.5	Very high	93.3	Very high	135 Å²	135	60.1 Å²	60.1	59%	0.592	28%	0.279	S	S	*	.	H	α-helix	trans	-64.3	-53.1	175.1	-178.1	-96.7	0	0	0	111.9	N272 A273 L274 N279	N272-F276 WeakPolarHBondContact O-CB 3.45Å; N272-F276 PolarHBondContact O-N 3.08Å; A273-F276 PolarHBondContact O-N 2.9Å; L274-F276 VanDerWaalsContact C-N 3.3Å; L274-F276 PolarHBondContact O-N 3.19Å; F276-N279 PolarHBondContact O-N 3.31Å
277	F	94.4	Very high	93.4	Very high	48 Å²	48	60.8 Å²	60.8	21%	0.211	28%	0.282	C	S	.	.	H	α-helix	trans	-72.2	-34.4	-175.5	-75.9	-69.8	0	0	0	113.8	A273 L274 N279 D280 L283 L418 L420 Y424	A273-F277 VanDerWaalsContact O-CD2 3.25Å; A273-F277 WeakPolarHBondContact O-CD2 3.37Å; A273-F277 PolarHBondContact O-N 2.63Å; L274-F277 PolarHBondContact O-N 3.4Å; F277-N279 VanDerWaalsContact C-N 3.26Å; F277-N279 PolarHBondContact O-N 2.94Å; F277-D280 PolarHBondContact O-N 2.71Å; F277-L283 HydrophobicContact CD1-CD1 3.68Å; F277-L283 HydrophobicContact CE1-CD1 4.32Å; F277-L418 HydrophobicContact CB-CD2 4.45Å; F277-L420 HydrophobicContact CB-CD1 4.35Å; F277-L420 HydrophobicContact CB-CD2 4Å; F277-L420 HydrophobicContact CD1-CD2 4.25Å; F277-L420 HydrophobicContact CD2-CD1 3.85Å; F277-L420 HydrophobicContact CD2-CD2 3.35Å; F277-L420 HydrophobicContact CD2-CG 4.18Å; F277-L420 HydrophobicContact CE2-CD2 3.78Å; F277-L420 HydrophobicContact CG-CD1 4.44Å; F277-L420 HydrophobicContact CG-CD2 3.61Å; F277-L420 HydrophobicContact CZ-CD2 4.4Å; F277-Y424 HydrophobicContact CD2-CE1 4.4Å; F277-Y424 AromaticContact CE2-CD1 3.97Å; F277-Y424 HydrophobicContact CE2-CD1 3.97Å; F277-Y424 AromaticContact CE2-CE1 3.59Å; F277-Y424 HydrophobicContact CE2-CE1 3.59Å; F277-Y424 HydrophobicContact CZ-CE1 4.42Å
278	L	94.1	Very high	93.4	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-74	-14.8	178.2	-65	172.4	0	0	0	113.5	L274 M284 N291 G292 L293 K296 I373 V395	L274-L278 HydrophobicContact CB-CD1 4.23Å; L274-L278 HydrophobicContact CD2-CD1 4.1Å; L274-L278 WeakPolarHBondContact O-CB 3.49Å; L274-L278 WeakPolarHBondContact O-CG 3.46Å; L274-L278 PolarHBondContact O-N 2.73Å; L278-M284 HydrophobicContact CB-SD 4.39Å; L278-M284 HydrophobicContact CD2-CE 3.75Å; L278-M284 HydrophobicContact CD2-SD 3.58Å; L278-M284 VanDerWaalsContact CD2-SD 3.58Å; L278-M284 WeakPolarHBondContact O-CG 3.23Å; L278-N291 WeakPolarHBondContact O-CA 3.37Å; L278-G292 PolarHBondContact O-N 2.81Å; L278-L293 HydrophobicContact CD1-CD2 3.4Å; L278-L293 HydrophobicContact CD1-CG 3.96Å; L278-K296 HydrophobicContact CD1-CD 4.24Å; L278-K296 HydrophobicContact CD2-CD 4.39Å; L278-I373 HydrophobicContact CD1-CD1 3.79Å; L278-V395 HydrophobicContact CD2-CG2 4.08Å
279	N	94.2	Very high	93.3	Very high	85 Å²	85	58.3 Å²	58.3	46%	0.455	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-7.9	171.3	-74.5	-46.9	0	0	0	113.3	N275 F276 F277 S281 G292	N275-N279 WeakPolarHBondContact O-CB 3.5Å; N275-N279 PolarHBondContact O-N 2.88Å; N275-N279 PolarHBondContact O-ND2 3.01Å; N275-N279 PolarHBondContact OD1-ND2 3.01Å; F276-N279 PolarHBondContact O-N 3.31Å; F277-N279 VanDerWaalsContact C-N 3.26Å; F277-N279 PolarHBondContact O-N 2.94Å; N279-S281 PolarHBondContact O-N 3.26Å; N279-G292 WeakPolarHBondContact OD1-CA 3.2Å
280	D	93.8	Very high	93.2	Very high	60 Å²	60	62.2 Å²	62.2	32%	0.321	32%	0.318	S	S	.	.			trans	-77.5	102.1	171.6	-174.3	-12.1	0	0	0	110.8	F277 K282 L283 M284	F277-D280 PolarHBondContact O-N 2.71Å; D280-K282 PolarHBondContact O-N 3.45Å; D280-K282 VanDerWaalsContact O-N 3.15Å; D280-K282 WeakPolarHBondContact OD1-CB 3.29Å; D280-K282 PolarHBondContact OD1-N 3.44Å; D280-L283 HydrophobicContact CB-CB 4.26Å; D280-L283 HydrophobicContact CB-CD1 4.04Å; D280-L283 HydrophobicContact CB-CG 4.18Å; D280-L283 PolarHBondContact O-N 3.03Å; D280-L283 VanDerWaalsContact O-N 3.09Å; D280-M284 WeakPolarHBondContact O-CG 3.16Å; D280-M284 PolarHBondContact O-N 3.3Å
281	S	91.7	Very high	93.1	Very high	51 Å²	51	66.5 Å²	66.5	36%	0.357	34%	0.341	S	S	.	.	H	α-helix	trans	-53.4	-32.4	177.8	59.3	0	0	0	0	114.2	N279 Q285	N279-S281 PolarHBondContact O-N 3.26Å; S281-Q285 WeakPolarHBondContact O-CB 3.48Å; S281-Q285 WeakPolarHBondContact O-CG 3.4Å; S281-Q285 PolarHBondContact O-N 3.46Å; S281-Q285 VanDerWaalsContact O-N 3.1Å
282	K	92.9	Very high	92.9	Very high	149 Å²	149	65 Å²	65	65%	0.648	34%	0.339	S	S	*	.	H	α-helix	trans	-75	-32.2	-179.2	-64.4	177.1	-178.8	172.1	0	112.1	D280 R286	D280-K282 PolarHBondContact O-N 3.45Å; D280-K282 VanDerWaalsContact O-N 3.15Å; D280-K282 WeakPolarHBondContact OD1-CB 3.29Å; D280-K282 PolarHBondContact OD1-N 3.44Å; K282-R286 WeakPolarHBondContact O-CG 3.23Å
283	L	91.9	Very high	92.7	Very high	42 Å²	42	61.5 Å²	61.5	22%	0.22	32%	0.321	C	S	.	.	H	α-helix	trans	-76.8	-45.5	175.3	-66.5	177.6	0	0	0	110.4	F277 D280 Q285 R286 I287	F277-L283 HydrophobicContact CD1-CD1 3.68Å; F277-L283 HydrophobicContact CE1-CD1 4.32Å; D280-L283 HydrophobicContact CB-CB 4.26Å; D280-L283 HydrophobicContact CB-CD1 4.04Å; D280-L283 HydrophobicContact CB-CG 4.18Å; D280-L283 PolarHBondContact O-N 3.03Å; D280-L283 VanDerWaalsContact O-N 3.09Å; L283-Q285 VanDerWaalsContact C-N 3.34Å; L283-Q285 PolarHBondContact O-N 3.33Å; L283-R286 WeakPolarHBondContact O-CB 3.42Å; L283-R286 PolarHBondContact O-N 3.01Å; L283-I287 VanDerWaalsContact O-CD1 3.31Å; L283-I287 WeakPolarHBondContact O-CD1 3.47Å; L283-I287 WeakPolarHBondContact O-CG1 3.2Å; L283-I287 PolarHBondContact O-N 3.25Å
284	M	91.8	Very high	92.6	Very high	0 Å²	0	68.6 Å²	68.6	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-61.1	-40.9	-179.3	-69.7	-55.6	101.2	0	0	112.7	L278 D280 R286 I287 G288 L289 N291 L418	L278-M284 HydrophobicContact CB-SD 4.39Å; L278-M284 HydrophobicContact CD2-CE 3.75Å; L278-M284 HydrophobicContact CD2-SD 3.58Å; L278-M284 VanDerWaalsContact CD2-SD 3.58Å; L278-M284 WeakPolarHBondContact O-CG 3.23Å; D280-M284 WeakPolarHBondContact O-CG 3.16Å; D280-M284 PolarHBondContact O-N 3.3Å; M284-R286 VanDerWaalsContact C-N 3.3Å; M284-R286 PolarHBondContact O-N 2.91Å; M284-I287 HydrophobicContact CE-CD1 3.58Å; M284-I287 PolarHBondContact O-N 2.87Å; M284-G288 PolarHBondContact O-N 2.96Å; M284-L289 WeakPolarHBondContact CB-O 3.4Å; M284-L289 PolarHBondContact O-N 2.91Å; M284-L289 VanDerWaalsContact O-N 3.16Å; M284-L289 HydrophobicContact SD-CB 4.23Å; M284-N291 VanDerWaalsContact CB-OD1 3.29Å; M284-N291 WeakPolarHBondContact CB-OD1 3.18Å; M284-L418 HydrophobicContact CE-CD2 4.14Å
285	Q	91.4	Very high	92.5	Very high	153 Å²	153	70.9 Å²	70.9	72%	0.715	38%	0.376	S	S	*	.	H	α-helix	trans	-58.9	-35.7	172.1	-77.5	173.1	2.2	0	0	113.8	S281 L283	S281-Q285 WeakPolarHBondContact O-CB 3.48Å; S281-Q285 WeakPolarHBondContact O-CG 3.4Å; S281-Q285 PolarHBondContact O-N 3.46Å; S281-Q285 VanDerWaalsContact O-N 3.1Å; L283-Q285 VanDerWaalsContact C-N 3.34Å; L283-Q285 PolarHBondContact O-N 3.33Å
286	R	90.8	Very high	92.5	Very high	201 Å²	201	68.7 Å²	68.7	76%	0.758	37%	0.365	S	S	*	.	H	α-helix	trans	-74.2	-29.9	179.3	-72.4	174.6	176.7	-166.2	-1.2	113.2	K282 L283 M284	K282-R286 WeakPolarHBondContact O-CG 3.23Å; L283-R286 WeakPolarHBondContact O-CB 3.42Å; L283-R286 PolarHBondContact O-N 3.01Å; M284-R286 VanDerWaalsContact C-N 3.3Å; M284-R286 PolarHBondContact O-N 2.91Å
287	I	90	Very high	92.6	Very high	20 Å²	20	64 Å²	64	10%	0.103	35%	0.347	C	S	.	.	H	α-helix	trans	-87.6	-24.4	-177.7	-62	154.6	0	0	0	110.9	L283 M284 L289 K394 L418	L283-I287 VanDerWaalsContact O-CD1 3.31Å; L283-I287 WeakPolarHBondContact O-CD1 3.47Å; L283-I287 WeakPolarHBondContact O-CG1 3.2Å; L283-I287 PolarHBondContact O-N 3.25Å; M284-I287 HydrophobicContact CE-CD1 3.58Å; M284-I287 PolarHBondContact O-N 2.87Å; I287-L289 HydrophobicContact CG2-CD1 4.19Å; I287-L289 HydrophobicContact CG2-CG 4.16Å; I287-K394 HydrophobicContact CG2-CB 3.75Å; I287-K394 HydrophobicContact CG2-CD 4.35Å; I287-K394 HydrophobicContact CG2-CG 4.44Å; I287-L418 HydrophobicContact CD1-CB 3.52Å; I287-L418 HydrophobicContact CD1-CD2 3.62Å; I287-L418 HydrophobicContact CD1-CG 4.11Å; I287-L418 HydrophobicContact CG1-CB 4.18Å
288	G	90	Very high	92.7	Very high	65 Å²	65	61.8 Å²	61.8	67%	0.67	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.6	32.3	-178.4	0	0	0	0	0	113.3	M284	M284-G288 PolarHBondContact O-N 2.96Å
289	L	91.1	Very high	92.8	Very high	24 Å²	24	61.8 Å²	61.8	13%	0.126	34%	0.337	C	S	.	.			trans	-117.6	153.2	178	-73.6	-175.6	0	0	0	111.6	M284 I287 D372 K394 V395	M284-L289 WeakPolarHBondContact CB-O 3.4Å; M284-L289 PolarHBondContact O-N 2.91Å; M284-L289 VanDerWaalsContact O-N 3.16Å; M284-L289 HydrophobicContact SD-CB 4.23Å; I287-L289 HydrophobicContact CG2-CD1 4.19Å; I287-L289 HydrophobicContact CG2-CG 4.16Å; L289-D372 HydrophobicContact CD1-CB 4.28Å; L289-D372 WeakPolarHBondContact CD2-OD1 3.28Å; L289-K394 HydrophobicContact CD1-CB 3.77Å; L289-K394 HydrophobicContact CD1-CG 4.43Å; L289-K394 HydrophobicContact CD2-CG 4.43Å; L289-K394 HydrophobicContact CG-CB 4.24Å; L289-K394 HydrophobicContact CG-CG 4.43Å; L289-V395 HydrophobicContact CD1-CG2 4.13Å
290	P	91.8	Very high	92.9	Very high	92 Å²	92	57.7 Å²	57.7	60%	0.597	32%	0.316	S	S	*	.			trans	-71.1	156.8	169.2	29.5	-34.3	0	0	0	111.3	K296	P290-K296 WeakPolarHBondContact O-CE 3.5Å; P290-K296 PolarHBondContact O-NZ 3.01Å
291	N	92.4	Very high	92.9	Very high	91 Å²	91	56 Å²	56	49%	0.487	31%	0.306	S	S	.	.	S	Bend	trans	-69.6	155.8	177.6	-59.5	-9.4	0	0	0	112.4	L278 M284	L278-N291 WeakPolarHBondContact O-CA 3.37Å; M284-N291 VanDerWaalsContact CB-OD1 3.29Å; M284-N291 WeakPolarHBondContact CB-OD1 3.18Å
292	G	92.2	Very high	92.8	Very high	13 Å²	13	53.6 Å²	53.6	13%	0.134	29%	0.289	C	S	.	.	S	Bend	trans	89.7	-172.1	174.8	0	0	0	0	0	114.2	L278 N279 K296	L278-G292 PolarHBondContact O-N 2.81Å; N279-G292 WeakPolarHBondContact OD1-CA 3.2Å; G292-K296 WeakPolarHBondContact O-CD 3.37Å; G292-K296 WeakPolarHBondContact O-CE 3.3Å
293	L	92.4	Very high	92.7	Very high	8 Å²	8	46.6 Å²	46.6	4%	0.042	26%	0.258	C	S	.	.	S	Bend	trans	-105.3	-23.8	178	-85.4	165.7	0	0	0	113.6	N275 L278 G295 K296 L314 A319 I373	N275-L293 HydrophobicContact CB-CD1 3.94Å; L278-L293 HydrophobicContact CD1-CD2 3.4Å; L278-L293 HydrophobicContact CD1-CG 3.96Å; L293-G295 PolarHBondContact O-N 3.13Å; L293-K296 WeakPolarHBondContact O-CB 3.23Å; L293-K296 PolarHBondContact O-N 2.8Å; L293-L314 HydrophobicContact CD1-CD2 4.12Å; L293-L314 HydrophobicContact CD2-CD2 3.47Å; L293-L314 VanDerWaalsContact CD2-CD2 3.47Å; L293-L314 HydrophobicContact CG-CD2 4.46Å; L293-A319 HydrophobicContact CD2-CB 4.36Å; L293-I373 HydrophobicContact CD2-CD1 4.2Å
294	Q	93.3	Very high	92.3	Very high	153 Å²	153	44.8 Å²	44.8	72%	0.715	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	128.1	-175	-165.6	72.7	33.5	0	0	112	K296	Q294-K296 PolarHBondContact O-N 2.94Å
295	G	92.3	Very high	91.7	Very high	47 Å²	47	45.5 Å²	45.5	49%	0.485	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.2	1.3	176.5	0	0	0	0	0	115.6	L293 G318	L293-G295 PolarHBondContact O-N 3.13Å; G295-G318 PolarHBondContact N-O 2.87Å
296	K	95.3	Very high	91.5	Very high	5 Å²	5	38.6 Å²	38.6	2%	0.022	22%	0.222	C	C	.	.			trans	-76.9	137.1	176.8	-67	-168.7	-178.3	-60.8	0	111.5	L278 P290 G292 L293 Q294 A319 I320 D372 I373	L278-K296 HydrophobicContact CD1-CD 4.24Å; L278-K296 HydrophobicContact CD2-CD 4.39Å; P290-K296 WeakPolarHBondContact O-CE 3.5Å; P290-K296 PolarHBondContact O-NZ 3.01Å; G292-K296 WeakPolarHBondContact O-CD 3.37Å; G292-K296 WeakPolarHBondContact O-CE 3.3Å; L293-K296 WeakPolarHBondContact O-CB 3.23Å; L293-K296 PolarHBondContact O-N 2.8Å; Q294-K296 PolarHBondContact O-N 2.94Å; K296-A319 CarbonylContact O-C 3.59Å; K296-A319 WeakPolarHBondContact O-CA 3.43Å; K296-A319 WeakPolarHBondContact O-CB 3.45Å; K296-I320 PolarHBondContact O-N 3.16Å; K296-D372 HydrophobicContact CB-CB 4.25Å; K296-I373 HydrophobicContact CB-CD1 4.32Å; K296-I373 HydrophobicContact CD-CD1 4.29Å
297	T	96.9	Very high	91.5	Very high	38 Å²	38	29 Å²	29	23%	0.233	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	138.6	176.4	59.1	0	0	0	0	111.4	I320 I322 C371 D372 I373	T297-I320 CarbonylContact C-O 3.51Å; T297-I320 WeakPolarHBondContact CA-O 3.22Å; T297-I322 HydrophobicContact CG2-CG2 3.79Å; T297-C371 WeakPolarHBondContact OG1-CA 3.41Å; T297-D372 PolarHBondContact N-OD2 3.1Å; T297-D372 WeakPolarHBondContact O-CB 3.3Å; T297-D372 PolarHBondContact O-N 3.47Å; T297-D372 PolarHBondContact OG1-N 3.04Å; T297-D372 PolarHBondContact OG1-OD2 3.48Å; T297-I373 PolarHBondContact O-N 3.06Å
298	F	97.1	Very high	91.6	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	148	175.7	72.3	-91.2	0	0	0	114	L314 A319 I320 C321 I322 I373 I375	F298-L314 HydrophobicContact CD1-CB 4.29Å; F298-L314 HydrophobicContact CD1-CD1 4.31Å; F298-L314 HydrophobicContact CD2-CD1 4.14Å; F298-L314 HydrophobicContact CE1-CB 3.64Å; F298-L314 HydrophobicContact CE1-CD1 4.26Å; F298-L314 HydrophobicContact CE2-CD1 4.1Å; F298-L314 HydrophobicContact CG-CD1 4.23Å; F298-L314 HydrophobicContact CZ-CB 3.78Å; F298-L314 HydrophobicContact CZ-CD1 4.14Å; F298-A319 HydrophobicContact CD1-CB 3.86Å; F298-A319 HydrophobicContact CE1-CB 3.92Å; F298-I320 VanDerWaalsContact CD1-O 3.29Å; F298-I320 WeakPolarHBondContact CD1-O 3.47Å; F298-I320 PolarHBondContact N-O 3.18Å; F298-C321 HydrophobicContact CD2-CB 4.42Å; F298-C321 HydrophobicContact CE1-CB 3.88Å; F298-C321 HydrophobicContact CE2-CB 3.7Å; F298-C321 HydrophobicContact CZ-CB 3.4Å; F298-I322 PolarHBondContact O-N 2.93Å; F298-I373 CarbonylContact C-O 3.6Å; F298-I373 WeakPolarHBondContact CA-O 3.39Å; F298-I373 HydrophobicContact CB-CB 3.89Å; F298-I373 WeakPolarHBondContact CB-O 3.33Å; F298-I375 HydrophobicContact CD2-CD1 4.06Å
299	V	96.6	Very high	91.8	Very high	0 Å²	0	27 Å²	27	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	131.2	172.3	174.7	0	0	0	0	108.6	I322 G323 V325 L366 C371 I373 L374 I375	V299-I322 HydrophobicContact CG2-CD1 4.06Å; V299-I322 HydrophobicContact CG2-CG1 3.67Å; V299-G323 WeakPolarHBondContact CA-O 3.11Å; V299-V325 HydrophobicContact CG1-CG2 4.45Å; V299-L366 HydrophobicContact CG1-CG 4.23Å; V299-L366 HydrophobicContact CG2-CD1 4.35Å; V299-C371 HydrophobicContact CG2-CB 3.94Å; V299-I373 PolarHBondContact N-O 3.31Å; V299-L374 HydrophobicContact CB-CD1 4.1Å; V299-L374 HydrophobicContact CG1-CD1 4.05Å; V299-I375 PolarHBondContact O-N 2.8Å
300	V	95.7	Very high	91.9	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	131.9	177.6	61.3	0	0	0	0	111	F303 S311 G323 V324 V325 I375 A377	V300-F303 HydrophobicContact CG1-CD2 4.13Å; V300-S311 WeakPolarHBondContact CG1-OG 3.49Å; V300-G323 PolarHBondContact N-O 2.83Å; V300-V324 HydrophobicContact CG1-CB 4.3Å; V300-V324 HydrophobicContact CG1-CG1 4.21Å; V300-V324 HydrophobicContact CG1-CG2 3.79Å; V300-V324 WeakPolarHBondContact O-CA 3.48Å; V300-V325 PolarHBondContact O-N 3Å; V300-I375 HydrophobicContact CB-CB 4.35Å; V300-I375 HydrophobicContact CG2-CB 4.26Å; V300-I375 HydrophobicContact CG2-CG2 4.34Å; V300-A377 HydrophobicContact CG2-CB 4.35Å
301	Q	93.9	Very high	92.1	Very high	25 Å²	25	21.5 Å²	21.5	12%	0.117	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	110.5	174.1	-175.2	-95.8	-1.3	0	0	109.3	V325 F367 I375 A377 A378	Q301-V325 CarbonylContact C-O 3.54Å; Q301-V325 WeakPolarHBondContact CA-O 3.45Å; Q301-V325 HydrophobicContact CB-CB 4.25Å; Q301-V325 HydrophobicContact CG-CB 4.07Å; Q301-V325 HydrophobicContact CG-CG1 4.06Å; Q301-F367 HydrophobicContact CB-CD2 4.05Å; Q301-F367 HydrophobicContact CB-CE2 3.76Å; Q301-F367 HydrophobicContact CG-CD2 4.07Å; Q301-F367 HydrophobicContact CG-CE2 3.86Å; Q301-I375 PolarHBondContact N-O 3.08Å; Q301-A377 CarbonylContact O-C 3.19Å; Q301-A377 VanDerWaalsContact O-C 3.27Å; Q301-A377 WeakPolarHBondContact O-CA 3.44Å; Q301-A377 VanDerWaalsContact O-CB 3.29Å; Q301-A377 WeakPolarHBondContact O-CB 3.37Å; Q301-A377 PolarHBondContact O-N 3.1Å; Q301-A378 PolarHBondContact O-N 2.86Å; Q301-A378 VanDerWaalsContact OE1-CB 3.29Å; Q301-A378 VanDerWaalsContact OE1-N 3.12Å
302	G	89.5	Confident	92.3	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.112	C	C	.	.			trans	90.3	115.3	-175.5	0	0	0	0	0	112.6	T138 G307 V325	T138-G302 VanDerWaalsContact CG2-O 3.3Å; T138-G302 WeakPolarHBondContact CG2-O 3.49Å; G302-G307 WeakPolarHBondContact O-CA 3.26Å; G302-V325 PolarHBondContact N-O 2.84Å
303	F	90	Very high	92.4	Very high	1 Å²	1	20.2 Å²	20.2	0%	0.004	11%	0.11	C	C	.	.			trans	-111.6	31.4	-173.8	-158.8	-100.5	0	0	0	113.4	V300 A308 V324 E326 P339 L342 L343 K346 V352	V300-F303 HydrophobicContact CG1-CD2 4.13Å; F303-A308 HydrophobicContact CD1-CB 4.1Å; F303-A308 HydrophobicContact CD2-CB 4.39Å; F303-A308 HydrophobicContact CE1-CB 3.9Å; F303-A308 HydrophobicContact CE2-CB 4.22Å; F303-A308 HydrophobicContact CG-CB 4.33Å; F303-A308 HydrophobicContact CZ-CB 3.95Å; F303-V324 HydrophobicContact CB-CG1 3.58Å; F303-V324 HydrophobicContact CD2-CG1 3.86Å; F303-V324 HydrophobicContact CD2-CG2 4.14Å; F303-V324 HydrophobicContact CE2-CG2 4.45Å; F303-V324 HydrophobicContact CG-CG1 3.91Å; F303-E326 VanDerWaalsContact CA-OE1 3.31Å; F303-E326 WeakPolarHBondContact CA-OE1 3.36Å; F303-E326 HydrophobicContact CB-CG 4.36Å; F303-E326 WeakPolarHBondContact CB-OE1 3.15Å; F303-E326 PolarHBondContact N-OE1 2.74Å; F303-P339 HydrophobicContact CE2-CB 4.43Å; F303-P339 HydrophobicContact CZ-CB 4.18Å; F303-L342 HydrophobicContact CD1-CD2 3.98Å; F303-L342 HydrophobicContact CD1-CG 4.17Å; F303-L342 HydrophobicContact CD2-CD2 4.15Å; F303-L342 HydrophobicContact CE1-CB 4.1Å; F303-L342 HydrophobicContact CE1-CD2 3.75Å; F303-L342 HydrophobicContact CE1-CG 3.74Å; F303-L342 HydrophobicContact CE2-CD2 3.91Å; F303-L342 HydrophobicContact CG-CD2 4.19Å; F303-L342 HydrophobicContact CZ-CB 4.11Å; F303-L342 HydrophobicContact CZ-CD2 3.72Å; F303-L342 HydrophobicContact CZ-CG 4.05Å; F303-L343 HydrophobicContact CE1-CB 4.2Å; F303-K346 HydrophobicContact CD1-CD 3.91Å; F303-K346 PolarHBondContact O-NZ 3.04Å; F303-V352 HydrophobicContact CB-CG1 4.29Å; F303-V352 HydrophobicContact CD1-CG1 4.27Å
304	G	84.6	Confident	92.6	Very high	5 Å²	5	19.8 Å²	19.8	5%	0.052	11%	0.108	C	C	.	.	S	Bend	trans	-84.6	-160.7	159.7	0	0	0	0	0	111.2	T138 V306 G307 A308	T138-G304 WeakPolarHBondContact OG1-CA 3.34Å; G304-V306 VanDerWaalsContact C-N 3.32Å; G304-V306 PolarHBondContact O-N 3.12Å; G304-G307 PolarHBondContact O-N 2.79Å; G304-G307 VanDerWaalsContact O-N 3.16Å; G304-A308 WeakPolarHBondContact O-CB 3.18Å; G304-A308 PolarHBondContact O-N 3.03Å
305	N	78.3	Confident	92.7	Very high	14 Å²	14	14.1 Å²	14.1	8%	0.075	9%	0.087	C	C	.	.	H	α-helix	trans	-46.1	-44.6	-165.1	-69.8	-12.4	0	0	0	115.9	W131 Y309	W131-N305 PolarHBondContact N-ND2 2.84Å; W131-N305 PolarHBondContact O-ND2 2.94Å; W131-N305 PolarHBondContact O-OD1 3.45Å; N305-Y309 VanDerWaalsContact O-CD2 3.23Å; N305-Y309 WeakPolarHBondContact O-CD2 3.27Å; N305-Y309 PolarHBondContact O-N 2.86Å
306	V	86.5	Confident	92.8	Very high	8 Å²	8	17.4 Å²	17.4	5%	0.048	9%	0.09	C	C	.	.	H	α-helix	trans	-70.5	-58.9	-179.4	-172.1	0	0	0	0	110.4	T266 V270 G304 A308 Y309 T310 A377 A399	T266-V306 HydrophobicContact CG2-CG1 3.89Å; T266-V306 HydrophobicContact CG2-CG2 3.82Å; V270-V306 HydrophobicContact CG2-CG1 4.33Å; G304-V306 VanDerWaalsContact C-N 3.32Å; G304-V306 PolarHBondContact O-N 3.12Å; V306-A308 PolarHBondContact O-N 3.14Å; V306-Y309 PolarHBondContact O-N 3.12Å; V306-T310 WeakPolarHBondContact O-CB 3.42Å; V306-T310 PolarHBondContact O-N 2.97Å; V306-T310 PolarHBondContact O-OG1 3.12Å; V306-A377 HydrophobicContact CB-CB 4.45Å; V306-A377 HydrophobicContact CG1-CB 4.43Å; V306-A399 HydrophobicContact CG1-CB 3.86Å
307	G	91.6	Very high	92.7	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-63.1	-40.2	-176.5	0	0	0	0	0	114.1	G302 G304 T310 S311	G302-G307 WeakPolarHBondContact O-CA 3.26Å; G304-G307 PolarHBondContact O-N 2.79Å; G304-G307 VanDerWaalsContact O-N 3.16Å; G307-T310 PolarHBondContact O-N 2.97Å; G307-S311 VanDerWaalsContact O-CB 3.28Å; G307-S311 WeakPolarHBondContact O-CB 3.34Å; G307-S311 PolarHBondContact O-N 2.86Å; G307-S311 PolarHBondContact O-OG 3.36Å
308	A	92.3	Very high	92.6	Very high	3 Å²	3	17.9 Å²	17.9	3%	0.025	10%	0.099	C	C	.	.	H	α-helix	trans	-64	-47.9	179.1	0	0	0	0	0	112.3	F303 G304 V306 S311 K312 L343	F303-A308 HydrophobicContact CD1-CB 4.1Å; F303-A308 HydrophobicContact CD2-CB 4.39Å; F303-A308 HydrophobicContact CE1-CB 3.9Å; F303-A308 HydrophobicContact CE2-CB 4.22Å; F303-A308 HydrophobicContact CG-CB 4.33Å; F303-A308 HydrophobicContact CZ-CB 3.95Å; G304-A308 WeakPolarHBondContact O-CB 3.18Å; G304-A308 PolarHBondContact O-N 3.03Å; V306-A308 PolarHBondContact O-N 3.14Å; A308-S311 PolarHBondContact O-N 2.94Å; A308-K312 WeakPolarHBondContact O-CB 3.32Å; A308-K312 PolarHBondContact O-N 3Å; A308-L343 HydrophobicContact CB-CD1 4.17Å
309	Y	93	Very high	92.5	Very high	41 Å²	41	18.1 Å²	18.1	16%	0.161	10%	0.101	C	C	.	.	H	α-helix	trans	-71.7	-35.5	177.2	-74.5	-62.4	0	0	0	112.6	V263 Q264 N305 V306 K312 F313	V263-Y309 HydrophobicContact CB-CE2 4.49Å; V263-Y309 HydrophobicContact CG1-CD2 4.41Å; V263-Y309 HydrophobicContact CG1-CE2 3.68Å; Q264-Y309 HydrophobicContact CB-CD1 4.01Å; Q264-Y309 HydrophobicContact CB-CD2 4.3Å; Q264-Y309 HydrophobicContact CB-CE1 4.35Å; Q264-Y309 HydrophobicContact CB-CG 4.02Å; Q264-Y309 HydrophobicContact CG-CD1 3.73Å; Q264-Y309 HydrophobicContact CG-CD2 4.17Å; Q264-Y309 HydrophobicContact CG-CE1 3.55Å; Q264-Y309 HydrophobicContact CG-CE2 4.01Å; Q264-Y309 HydrophobicContact CG-CG 4.07Å; N305-Y309 VanDerWaalsContact O-CD2 3.23Å; N305-Y309 WeakPolarHBondContact O-CD2 3.27Å; N305-Y309 PolarHBondContact O-N 2.86Å; V306-Y309 PolarHBondContact O-N 3.12Å; Y309-K312 PolarHBondContact O-N 2.79Å; Y309-F313 WeakPolarHBondContact O-CD2 3.41Å; Y309-F313 PolarHBondContact O-N 2.9Å; Y309-F313 VanDerWaalsContact O-N 3.08Å
310	T	94.9	Very high	92.5	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-57.9	-50.4	170.9	-62.3	0	0	0	0	110.8	G267 V270 V306 G307 K312 F313 L314 I375	G267-T310 VanDerWaalsContact CA-OG1 3.22Å; G267-T310 WeakPolarHBondContact CA-OG1 3.48Å; V270-T310 HydrophobicContact CB-CG2 4Å; V270-T310 HydrophobicContact CG1-CG2 3.62Å; V306-T310 WeakPolarHBondContact O-CB 3.42Å; V306-T310 PolarHBondContact O-N 2.97Å; V306-T310 PolarHBondContact O-OG1 3.12Å; G307-T310 PolarHBondContact O-N 2.97Å; T310-K312 VanDerWaalsContact C-N 3.33Å; T310-K312 PolarHBondContact O-N 2.69Å; T310-F313 PolarHBondContact O-N 3.04Å; T310-L314 HydrophobicContact CG2-CD1 3.69Å; T310-L314 HydrophobicContact CG2-CG 4.36Å; T310-L314 WeakPolarHBondContact O-CB 3.4Å; T310-L314 VanDerWaalsContact O-CG 3.29Å; T310-L314 WeakPolarHBondContact O-CG 3.08Å; T310-L314 PolarHBondContact O-N 2.91Å; T310-I375 HydrophobicContact CG2-CD1 3.77Å; T310-I375 HydrophobicContact CG2-CG2 4.17Å
311	S	96	Very high	92.5	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-60.2	-44.9	-179.3	-54.6	0	0	0	0	111	V300 G307 A308 L314 A315	V300-S311 WeakPolarHBondContact CG1-OG 3.49Å; G307-S311 VanDerWaalsContact O-CB 3.28Å; G307-S311 WeakPolarHBondContact O-CB 3.34Å; G307-S311 PolarHBondContact O-N 2.86Å; G307-S311 PolarHBondContact O-OG 3.36Å; A308-S311 PolarHBondContact O-N 2.94Å; S311-L314 PolarHBondContact O-N 3.01Å; S311-A315 WeakPolarHBondContact O-CB 3.4Å; S311-A315 PolarHBondContact O-N 3.08Å
312	K	95.1	Very high	92.7	Very high	54 Å²	54	20.3 Å²	20.3	24%	0.235	11%	0.113	C	C	.	.	H	α-helix	trans	-54.8	-53.6	175.5	176.4	171	177	139.7	0	112.5	A308 Y309 T310 L314 A315 E316 P339 N340	A308-K312 WeakPolarHBondContact O-CB 3.32Å; A308-K312 PolarHBondContact O-N 3Å; Y309-K312 PolarHBondContact O-N 2.79Å; T310-K312 VanDerWaalsContact C-N 3.33Å; T310-K312 PolarHBondContact O-N 2.69Å; K312-L314 VanDerWaalsContact C-N 3.3Å; K312-L314 PolarHBondContact O-N 3.31Å; K312-A315 PolarHBondContact O-N 3.28Å; K312-E316 WeakPolarHBondContact CE-OE1 3.15Å; K312-E316 IonicContact NZ-OE1 3.68Å; K312-E316 WeakPolarHBondContact O-CG 3.49Å; K312-E316 PolarHBondContact O-N 2.76Å; K312-P339 HydrophobicContact CB-CB 4.37Å; K312-N340 WeakPolarHBondContact CD-OD1 3.45Å; K312-N340 WeakPolarHBondContact CE-OD1 3.49Å; K312-N340 PolarHBondContact NZ-OD1 3.37Å
313	F	95.5	Very high	92.9	Very high	22 Å²	22	20.3 Å²	20.3	10%	0.096	11%	0.113	C	C	.	.	H	α-helix	trans	-67.8	-29.7	-178.1	-65.3	-56.3	0	0	0	112.9	Q264 R268 W271 Y309 T310 E316 S317	Q264-F313 HydrophobicContact CB-CE2 4.21Å; Q264-F313 HydrophobicContact CB-CZ 4.18Å; R268-F313 HydrophobicContact CB-CD2 3.9Å; R268-F313 HydrophobicContact CB-CE2 3.55Å; R268-F313 HydrophobicContact CB-CZ 4.16Å; R268-F313 HydrophobicContact CG-CD2 4.27Å; R268-F313 HydrophobicContact CG-CE2 4.06Å; R268-F313 HydrophobicContact CG-CZ 4.31Å; W271-F313 HydrophobicContact CB-CB 3.77Å; W271-F313 HydrophobicContact CD2-CB 4.07Å; W271-F313 HydrophobicContact CG-CB 3.57Å; W271-F313 PolarHBondContact NE1-O 2.81Å; Y309-F313 WeakPolarHBondContact O-CD2 3.41Å; Y309-F313 PolarHBondContact O-N 2.9Å; Y309-F313 VanDerWaalsContact O-N 3.08Å; T310-F313 PolarHBondContact O-N 3.04Å; F313-E316 VanDerWaalsContact CD1-OE2 3.31Å; F313-E316 WeakPolarHBondContact CD1-OE2 3.26Å; F313-S317 WeakPolarHBondContact O-CB 3.13Å; F313-S317 PolarHBondContact O-N 3.27Å; F313-S317 PolarHBondContact O-OG 3.01Å
314	L	96.1	Very high	93.2	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-68.7	-44.6	172.8	-71.7	170.5	0	0	0	111.9	L274 L293 F298 T310 S311 K312 S317 G318 A319 I375	L274-L314 HydrophobicContact CD1-CD1 4.07Å; L274-L314 HydrophobicContact CD1-CD2 3.91Å; L293-L314 HydrophobicContact CD1-CD2 4.12Å; L293-L314 HydrophobicContact CD2-CD2 3.47Å; L293-L314 VanDerWaalsContact CD2-CD2 3.47Å; L293-L314 HydrophobicContact CG-CD2 4.46Å; F298-L314 HydrophobicContact CD1-CB 4.29Å; F298-L314 HydrophobicContact CD1-CD1 4.31Å; F298-L314 HydrophobicContact CD2-CD1 4.14Å; F298-L314 HydrophobicContact CE1-CB 3.64Å; F298-L314 HydrophobicContact CE1-CD1 4.26Å; F298-L314 HydrophobicContact CE2-CD1 4.1Å; F298-L314 HydrophobicContact CG-CD1 4.23Å; F298-L314 HydrophobicContact CZ-CB 3.78Å; F298-L314 HydrophobicContact CZ-CD1 4.14Å; T310-L314 HydrophobicContact CG2-CD1 3.69Å; T310-L314 HydrophobicContact CG2-CG 4.36Å; T310-L314 WeakPolarHBondContact O-CB 3.4Å; T310-L314 VanDerWaalsContact O-CG 3.29Å; T310-L314 WeakPolarHBondContact O-CG 3.08Å; T310-L314 PolarHBondContact O-N 2.91Å; S311-L314 PolarHBondContact O-N 3.01Å; K312-L314 VanDerWaalsContact C-N 3.3Å; K312-L314 PolarHBondContact O-N 3.31Å; L314-S317 CarbonylContact O-C 3.52Å; L314-S317 WeakPolarHBondContact O-CA 3.43Å; L314-S317 WeakPolarHBondContact O-CB 3.35Å; L314-S317 PolarHBondContact O-N 2.98Å; L314-G318 PolarHBondContact O-N 2.74Å; L314-A319 HydrophobicContact CB-CB 4.16Å; L314-A319 WeakPolarHBondContact O-CB 3.2Å; L314-A319 PolarHBondContact O-N 2.86Å; L314-I375 HydrophobicContact CD1-CD1 3.33Å
315	A	95.3	Very high	93.6	Very high	34 Å²	34	20.4 Å²	20.4	28%	0.281	11%	0.113	S	C	.	.	H	α-helix	trans	-63	-42.9	174.8	0	0	0	0	0	112.2	S311 K312 S317 G318 A319 P339	S311-A315 WeakPolarHBondContact O-CB 3.4Å; S311-A315 PolarHBondContact O-N 3.08Å; K312-A315 PolarHBondContact O-N 3.28Å; A315-S317 PolarHBondContact O-N 3.48Å; A315-S317 VanDerWaalsContact O-N 3.1Å; A315-G318 PolarHBondContact O-N 3.4Å; A315-A319 WeakPolarHBondContact CA-O 3.49Å; A315-P339 HydrophobicContact CB-CG 3.82Å
316	E	94.6	Very high	94.2	Very high	115 Å²	115	20.3 Å²	20.3	54%	0.537	11%	0.112	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-18.4	171.6	-72.8	174.9	169.6	0	0	113.1	K312 F313	K312-E316 WeakPolarHBondContact CE-OE1 3.15Å; K312-E316 IonicContact NZ-OE1 3.68Å; K312-E316 WeakPolarHBondContact O-CG 3.49Å; K312-E316 PolarHBondContact O-N 2.76Å; F313-E316 VanDerWaalsContact CD1-OE2 3.31Å; F313-E316 WeakPolarHBondContact CD1-OE2 3.26Å
317	S	93.5	Very high	94.1	Very high	32 Å²	32	25.3 Å²	25.3	22%	0.224	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.1	14.2	175.6	-53.5	0	0	0	0	113.7	W271 F313 L314 A315	W271-S317 PolarHBondContact NE1-OG 3.44Å; F313-S317 WeakPolarHBondContact O-CB 3.13Å; F313-S317 PolarHBondContact O-N 3.27Å; F313-S317 PolarHBondContact O-OG 3.01Å; L314-S317 CarbonylContact O-C 3.52Å; L314-S317 WeakPolarHBondContact O-CA 3.43Å; L314-S317 WeakPolarHBondContact O-CB 3.35Å; L314-S317 PolarHBondContact O-N 2.98Å; A315-S317 PolarHBondContact O-N 3.48Å; A315-S317 VanDerWaalsContact O-N 3.1Å
318	G	93.9	Very high	93.8	Very high	21 Å²	21	28.1 Å²	28.1	22%	0.216	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.2	12.7	175	0	0	0	0	0	115.9	G295 L314 A315	G295-G318 PolarHBondContact N-O 2.87Å; L314-G318 PolarHBondContact O-N 2.74Å; A315-G318 PolarHBondContact O-N 3.4Å
319	A	96	Very high	93.7	Very high	6 Å²	6	28.4 Å²	28.4	5%	0.05	15%	0.149	C	C	.	.			trans	-84.6	147.1	169.7	0	0	0	0	0	110.9	L293 K296 F298 L314 A315	L293-A319 HydrophobicContact CD2-CB 4.36Å; K296-A319 CarbonylContact O-C 3.59Å; K296-A319 WeakPolarHBondContact O-CA 3.43Å; K296-A319 WeakPolarHBondContact O-CB 3.45Å; F298-A319 HydrophobicContact CD1-CB 3.86Å; F298-A319 HydrophobicContact CE1-CB 3.92Å; L314-A319 HydrophobicContact CB-CB 4.16Å; L314-A319 WeakPolarHBondContact O-CB 3.2Å; L314-A319 PolarHBondContact O-N 2.86Å; A315-A319 WeakPolarHBondContact CA-O 3.49Å
320	I	96.5	Very high	93.7	Very high	62 Å²	62	26.6 Å²	26.6	32%	0.318	14%	0.142	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	115.9	-171.6	-54.9	174.9	0	0	0	109.4	K296 T297 F298 I322	K296-I320 PolarHBondContact O-N 3.16Å; T297-I320 CarbonylContact C-O 3.51Å; T297-I320 WeakPolarHBondContact CA-O 3.22Å; F298-I320 VanDerWaalsContact CD1-O 3.29Å; F298-I320 WeakPolarHBondContact CD1-O 3.47Å; F298-I320 PolarHBondContact N-O 3.18Å; I320-I322 HydrophobicContact CG2-CG2 4Å; I320-I322 PolarHBondContact O-N 2.89Å
321	C	96.5	Very high	93.7	Very high	3 Å²	3	26.6 Å²	26.6	2%	0.02	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	100.6	173.9	-171.6	0	0	0	0	108.9	F298 G336 I337	F298-C321 HydrophobicContact CD2-CB 4.42Å; F298-C321 HydrophobicContact CE1-CB 3.88Å; F298-C321 HydrophobicContact CE2-CB 3.7Å; F298-C321 HydrophobicContact CZ-CB 3.4Å; C321-G336 CarbonylContact O-C 3.48Å; C321-G336 WeakPolarHBondContact O-CA 3.29Å; C321-I337 HydrophobicContact CB-CB 4.4Å; C321-I337 WeakPolarHBondContact CB-O 3.06Å; C321-I337 PolarHBondContact O-N 3.35Å
322	I	96.4	Very high	93.7	Very high	6 Å²	6	29.7 Å²	29.7	3%	0.031	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	-16.3	-178.3	67.3	169.7	0	0	0	112.8	T297 F298 V299 I320 Y332 N333 P370 C371	T297-I322 HydrophobicContact CG2-CG2 3.79Å; F298-I322 PolarHBondContact O-N 2.93Å; V299-I322 HydrophobicContact CG2-CD1 4.06Å; V299-I322 HydrophobicContact CG2-CG1 3.67Å; I320-I322 HydrophobicContact CG2-CG2 4Å; I320-I322 PolarHBondContact O-N 2.89Å; I322-Y332 HydrophobicContact CB-CE2 4.25Å; I322-Y332 HydrophobicContact CD1-CE2 4.12Å; I322-Y332 HydrophobicContact CG1-CE2 4.32Å; I322-Y332 WeakPolarHBondContact O-CA 3.48Å; I322-Y332 WeakPolarHBondContact O-CD2 3.4Å; I322-N333 WeakPolarHBondContact CA-O 3.22Å; I322-N333 PolarHBondContact O-N 2.88Å; I322-P370 WeakPolarHBondContact CD1-O 3.47Å; I322-C371 HydrophobicContact CD1-CB 3.92Å
323	G	94.9	Very high	93.7	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-168.3	150.6	-177.3	0	0	0	0	0	116	V299 V300 I331	V299-G323 WeakPolarHBondContact CA-O 3.11Å; V300-G323 PolarHBondContact N-O 2.83Å; G323-I331 CarbonylContact C-O 3.38Å; G323-I331 VanDerWaalsContact CA-O 3.23Å; G323-I331 WeakPolarHBondContact CA-O 3.21Å
324	V	95.3	Very high	93.5	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	124.2	-179.8	-179.1	0	0	0	0	109.3	V300 F303 A330 I331 I337 L342	V300-V324 HydrophobicContact CG1-CB 4.3Å; V300-V324 HydrophobicContact CG1-CG1 4.21Å; V300-V324 HydrophobicContact CG1-CG2 3.79Å; V300-V324 WeakPolarHBondContact O-CA 3.48Å; F303-V324 HydrophobicContact CB-CG1 3.58Å; F303-V324 HydrophobicContact CD2-CG1 3.86Å; F303-V324 HydrophobicContact CD2-CG2 4.14Å; F303-V324 HydrophobicContact CE2-CG2 4.45Å; F303-V324 HydrophobicContact CG-CG1 3.91Å; V324-A330 CarbonylContact O-C 3.55Å; V324-A330 VanDerWaalsContact O-CA 3.3Å; V324-A330 WeakPolarHBondContact O-CA 3.35Å; V324-I331 HydrophobicContact CB-CD1 4.26Å; V324-I331 HydrophobicContact CB-CG1 3.81Å; V324-I331 HydrophobicContact CG2-CG1 4.46Å; V324-I331 PolarHBondContact N-O 2.88Å; V324-I331 PolarHBondContact O-N 3.25Å; V324-I337 HydrophobicContact CG2-CD1 4.4Å; V324-L342 HydrophobicContact CB-CD2 4.29Å; V324-L342 HydrophobicContact CG1-CD2 4.35Å; V324-L342 HydrophobicContact CG2-CD2 3.69Å
325	V	93.7	Very high	93.3	Very high	8 Å²	8	39.8 Å²	39.8	5%	0.048	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	121.8	176.5	179.3	0	0	0	0	109.4	V299 V300 Q301 G302 A330 P363 L366	V299-V325 HydrophobicContact CG1-CG2 4.45Å; V300-V325 PolarHBondContact O-N 3Å; Q301-V325 CarbonylContact C-O 3.54Å; Q301-V325 WeakPolarHBondContact CA-O 3.45Å; Q301-V325 HydrophobicContact CB-CB 4.25Å; Q301-V325 HydrophobicContact CG-CB 4.07Å; Q301-V325 HydrophobicContact CG-CG1 4.06Å; G302-V325 PolarHBondContact N-O 2.84Å; V325-A330 HydrophobicContact CB-CB 4.4Å; V325-A330 HydrophobicContact CG1-CB 4.46Å; V325-A330 HydrophobicContact CG2-CB 4.06Å; V325-P363 HydrophobicContact CG1-CB 3.94Å; V325-L366 HydrophobicContact CG2-CB 4.06Å; V325-L366 HydrophobicContact CG2-CD2 3.75Å; V325-L366 HydrophobicContact CG2-CG 3.89Å
326	E	90.5	Very high	93.2	Very high	12 Å²	12	39.1 Å²	39.1	6%	0.056	21%	0.208	C	C	.	.			trans	-113.1	-175.3	170	-83.9	-77.5	-172.1	0	0	110.9	F303 D328 G329 K346 V352	F303-E326 VanDerWaalsContact CA-OE1 3.31Å; F303-E326 WeakPolarHBondContact CA-OE1 3.36Å; F303-E326 HydrophobicContact CB-CG 4.36Å; F303-E326 WeakPolarHBondContact CB-OE1 3.15Å; F303-E326 PolarHBondContact N-OE1 2.74Å; E326-D328 WeakPolarHBondContact CB-OD1 3.15Å; E326-G329 CarbonylContact C-O 3.55Å; E326-G329 WeakPolarHBondContact CA-O 3.26Å; E326-G329 PolarHBondContact N-O 3.24Å; E326-K346 IonicContact OE1-NZ 3.98Å; E326-K346 PolarHBondContact OE1-NZ 3.38Å; E326-V352 HydrophobicContact CB-CG2 4.01Å; E326-V352 HydrophobicContact CG-CG1 4.24Å; E326-V352 HydrophobicContact CG-CG2 3.83Å
327	Y	84.5	Confident	93.2	Very high	113 Å²	113	34 Å²	34	44%	0.443	18%	0.184	S	C	.	.	S	Bend	trans	-77.1	-23.7	179	68.1	-74.3	0	0	0	113.4	R135 D136 S137	R135-Y327 WeakPolarHBondContact CB-OH 3.26Å; D136-Y327 HydrophobicContact CB-CE1 3.86Å; D136-Y327 WeakPolarHBondContact OD1-CE1 3.48Å; D136-Y327 PolarHBondContact OD1-OH 3.36Å; S137-Y327 WeakPolarHBondContact OG-CD1 3.19Å
328	D	85	Confident	93.3	Very high	58 Å²	58	35.5 Å²	35.5	31%	0.31	19%	0.189	S	C	.	.	S	Bend	trans	-95.6	-26.2	-178.4	56.1	-19.2	0	0	0	112.6	E326 T351 I353	E326-D328 WeakPolarHBondContact CB-OD1 3.15Å; D328-T351 WeakPolarHBondContact OD2-CB 3.47Å; D328-T351 PolarHBondContact OD2-OG1 2.72Å; D328-I353 HydrophobicContact CB-CD1 3.88Å; D328-I353 WeakPolarHBondContact O-CD1 3.13Å
329	G	89.8	Confident	93.2	Very high	10 Å²	10	34.6 Å²	34.6	10%	0.103	18%	0.18	C	C	.	.			trans	179.6	-173.7	179.2	0	0	0	0	0	112.9	E326	E326-G329 CarbonylContact C-O 3.55Å; E326-G329 WeakPolarHBondContact CA-O 3.26Å; E326-G329 PolarHBondContact N-O 3.24Å
330	A	93.6	Very high	93.1	Very high	2 Å²	2	36.5 Å²	36.5	2%	0.017	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	146	177.2	0	0	0	0	0	110.9	V324 V325 C360 V361 P363 L366	V324-A330 CarbonylContact O-C 3.55Å; V324-A330 VanDerWaalsContact O-CA 3.3Å; V324-A330 WeakPolarHBondContact O-CA 3.35Å; V325-A330 HydrophobicContact CB-CB 4.4Å; V325-A330 HydrophobicContact CG1-CB 4.46Å; V325-A330 HydrophobicContact CG2-CB 4.06Å; A330-C360 WeakPolarHBondContact O-CA 2.92Å; A330-V361 HydrophobicContact CB-CG2 4.05Å; A330-V361 PolarHBondContact O-N 2.84Å; A330-P363 HydrophobicContact CB-CB 4.17Å; A330-P363 HydrophobicContact CB-CG 3.93Å; A330-L366 HydrophobicContact CB-CB 4.32Å; A330-L366 HydrophobicContact CB-CD2 3.84Å
331	I	95.2	Very high	92.9	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	142.2	178.5	58.9	167.2	0	0	0	110.9	G323 V324 I337 L342 V352 F355 A358 E359 L366	G323-I331 CarbonylContact C-O 3.38Å; G323-I331 VanDerWaalsContact CA-O 3.23Å; G323-I331 WeakPolarHBondContact CA-O 3.21Å; V324-I331 HydrophobicContact CB-CD1 4.26Å; V324-I331 HydrophobicContact CB-CG1 3.81Å; V324-I331 HydrophobicContact CG2-CG1 4.46Å; V324-I331 PolarHBondContact N-O 2.88Å; V324-I331 PolarHBondContact O-N 3.25Å; I331-I337 HydrophobicContact CD1-CD1 4.17Å; I331-I337 HydrophobicContact CG1-CD1 4.24Å; I331-L342 HydrophobicContact CD1-CD1 3.62Å; I331-L342 HydrophobicContact CD1-CD2 3.84Å; I331-L342 HydrophobicContact CD1-CG 4.4Å; I331-V352 HydrophobicContact CD1-CB 4.22Å; I331-F355 HydrophobicContact CD1-CB 4.4Å; I331-F355 HydrophobicContact CD1-CD1 4.49Å; I331-A358 HydrophobicContact CB-CB 3.86Å; I331-A358 HydrophobicContact CD1-CB 4.18Å; I331-A358 HydrophobicContact CG1-CB 4.42Å; I331-E359 CarbonylContact C-O 3.45Å; I331-E359 VanDerWaalsContact CA-O 3.3Å; I331-E359 WeakPolarHBondContact CA-O 3.45Å; I331-L366 WeakPolarHBondContact O-CD2 3.41Å
332	Y	95.7	Very high	92.8	Very high	66 Å²	66	37.5 Å²	37.5	26%	0.259	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	136.7	-176.3	179.1	-110.6	0	0	0	111.1	I322 P334 E359 L366	I322-Y332 HydrophobicContact CB-CE2 4.25Å; I322-Y332 HydrophobicContact CD1-CE2 4.12Å; I322-Y332 HydrophobicContact CG1-CE2 4.32Å; I322-Y332 WeakPolarHBondContact O-CA 3.48Å; I322-Y332 WeakPolarHBondContact O-CD2 3.4Å; Y332-P334 HydrophobicContact CE1-CB 4.34Å; Y332-P334 HydrophobicContact CE1-CG 4.34Å; Y332-E359 PolarHBondContact N-O 2.73Å; Y332-E359 PolarHBondContact O-N 3.14Å; Y332-L366 HydrophobicContact CD2-CD1 3.47Å; Y332-L366 VanDerWaalsContact CD2-CD1 3.47Å; Y332-L366 HydrophobicContact CE2-CD1 4.22Å; Y332-L366 HydrophobicContact CG-CD1 4.16Å
333	N	95.1	Very high	92.5	Very high	27 Å²	27	38.3 Å²	38.3	14%	0.144	20%	0.197	C	C	.	.			trans	-145.8	117.3	165.7	-177.6	-13.6	0	0	0	108.8	I322 E335 G336 I337 N357 A358	I322-N333 WeakPolarHBondContact CA-O 3.22Å; I322-N333 PolarHBondContact O-N 2.88Å; N333-E335 VanDerWaalsContact C-N 3.26Å; N333-E335 PolarHBondContact O-N 3.02Å; N333-E335 WeakPolarHBondContact OD1-CB 3.37Å; N333-E335 PolarHBondContact OD1-N 3.09Å; N333-G336 PolarHBondContact ND2-O 2.83Å; N333-G336 PolarHBondContact O-N 2.87Å; N333-I337 HydrophobicContact CB-CD1 4.45Å; N333-I337 HydrophobicContact CB-CG1 3.83Å; N333-N357 PolarHBondContact ND2-O 2.66Å; N333-A358 HydrophobicContact CB-CB 4.29Å
334	P	91.8	Very high	92.4	Very high	85 Å²	85	44.4 Å²	44.4	55%	0.552	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-23.8	178.6	28.6	-34.9	0	0	0	113.9	Y332	Y332-P334 HydrophobicContact CE1-CB 4.34Å; Y332-P334 HydrophobicContact CE1-CG 4.34Å
335	E	91.4	Very high	92.3	Very high	175 Å²	175	46.2 Å²	46.2	82%	0.818	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-24.4	176.5	-54.9	-170.7	157.6	0	0	112.2	N333	N333-E335 VanDerWaalsContact C-N 3.26Å; N333-E335 PolarHBondContact O-N 3.02Å; N333-E335 WeakPolarHBondContact OD1-CB 3.37Å; N333-E335 PolarHBondContact OD1-N 3.09Å
336	G	92.9	Very high	92.1	Very high	21 Å²	21	46.7 Å²	46.7	22%	0.216	23%	0.231	C	C	.	.			trans	119.1	149.9	175.3	0	0	0	0	0	114.5	C321 N333	C321-G336 CarbonylContact O-C 3.48Å; C321-G336 WeakPolarHBondContact O-CA 3.29Å; N333-G336 PolarHBondContact ND2-O 2.83Å; N333-G336 PolarHBondContact O-N 2.87Å
337	I	95	Very high	91.9	Very high	7 Å²	7	51.4 Å²	51.4	4%	0.036	25%	0.254	C	S	.	.			trans	-111.6	122.1	179.2	-58.1	168.2	0	0	0	108.4	C321 V324 I331 N333 P339 L342 F355 A358	C321-I337 HydrophobicContact CB-CB 4.4Å; C321-I337 WeakPolarHBondContact CB-O 3.06Å; C321-I337 PolarHBondContact O-N 3.35Å; V324-I337 HydrophobicContact CG2-CD1 4.4Å; I331-I337 HydrophobicContact CD1-CD1 4.17Å; I331-I337 HydrophobicContact CG1-CD1 4.24Å; N333-I337 HydrophobicContact CB-CD1 4.45Å; N333-I337 HydrophobicContact CB-CG1 3.83Å; I337-P339 WeakPolarHBondContact O-CD 3.44Å; I337-L342 HydrophobicContact CG2-CB 4.16Å; I337-L342 HydrophobicContact CG2-CD2 4.06Å; I337-F355 HydrophobicContact CG2-CD1 4.39Å; I337-F355 HydrophobicContact CG2-CE1 3.91Å; I337-A358 HydrophobicContact CD1-CB 4.14Å; I337-A358 HydrophobicContact CG1-CB 4.29Å
338	D	94.7	Very high	92.2	Very high	63 Å²	63	52.8 Å²	52.8	34%	0.337	27%	0.266	S	S	.	.			trans	-69.5	117.4	171.3	175.4	20.4	0	0	0	110.3	N340 E341 L342	D338-N340 PolarHBondContact O-N 3.03Å; D338-N340 PolarHBondContact OD1-N 3.21Å; D338-N340 PolarHBondContact OD1-ND2 2.81Å; D338-N340 WeakPolarHBondContact OD2-CB 3.34Å; D338-E341 HydrophobicContact CB-CB 4.22Å; D338-E341 HydrophobicContact CB-CG 4.32Å; D338-E341 PolarHBondContact O-N 2.77Å; D338-E341 WeakPolarHBondContact OD2-CG 3.25Å; D338-E341 PolarHBondContact OD2-N 3.04Å; D338-L342 PolarHBondContact O-N 3.24Å
339	P	93.2	Very high	92.4	Very high	3 Å²	3	54.4 Å²	54.4	2%	0.019	27%	0.274	C	S	.	.	H	α-helix	trans	-64	-22.3	177.7	-21.6	35.8	0	0	0	113.7	F303 K312 A315 I337 L343	F303-P339 HydrophobicContact CE2-CB 4.43Å; F303-P339 HydrophobicContact CZ-CB 4.18Å; K312-P339 HydrophobicContact CB-CB 4.37Å; A315-P339 HydrophobicContact CB-CG 3.82Å; I337-P339 WeakPolarHBondContact O-CD 3.44Å; P339-L343 WeakPolarHBondContact O-CB 3.18Å; P339-L343 PolarHBondContact O-N 3.03Å
340	N	92.7	Very high	92.2	Very high	45 Å²	45	55.1 Å²	55.1	24%	0.241	28%	0.282	C	S	.	.	H	α-helix	trans	-76.6	-42.1	178.2	-58.1	-84.8	0	0	0	111.7	K312 D338 K344	K312-N340 WeakPolarHBondContact CD-OD1 3.45Å; K312-N340 WeakPolarHBondContact CE-OD1 3.49Å; K312-N340 PolarHBondContact NZ-OD1 3.37Å; D338-N340 PolarHBondContact O-N 3.03Å; D338-N340 PolarHBondContact OD1-N 3.21Å; D338-N340 PolarHBondContact OD1-ND2 2.81Å; D338-N340 WeakPolarHBondContact OD2-CB 3.34Å; N340-K344 WeakPolarHBondContact O-CG 3.35Å; N340-K344 PolarHBondContact O-N 2.84Å; N340-K344 VanDerWaalsContact O-N 3.15Å
341	E	93.8	Very high	92	Very high	87 Å²	87	56.5 Å²	56.5	41%	0.407	29%	0.29	S	S	.	.	H	α-helix	trans	-63.3	-49.1	171	-74.8	-178.7	173.8	0	0	111.8	D338 L343 K344 Y345 F355	D338-E341 HydrophobicContact CB-CB 4.22Å; D338-E341 HydrophobicContact CB-CG 4.32Å; D338-E341 PolarHBondContact O-N 2.77Å; D338-E341 WeakPolarHBondContact OD2-CG 3.25Å; D338-E341 PolarHBondContact OD2-N 3.04Å; E341-L343 VanDerWaalsContact C-N 3.27Å; E341-L343 PolarHBondContact O-N 3.27Å; E341-K344 WeakPolarHBondContact O-CB 3.38Å; E341-K344 PolarHBondContact O-N 2.89Å; E341-Y345 PolarHBondContact O-N 3.15Å; E341-F355 HydrophobicContact CB-CE2 4.06Å; E341-F355 HydrophobicContact CB-CZ 3.85Å
342	L	93.2	Very high	91.7	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-61.1	-36.8	178.6	-175	65.1	0	0	0	112	F303 V324 I331 I337 D338 Y345 K346 V352 F355	F303-L342 HydrophobicContact CD1-CD2 3.98Å; F303-L342 HydrophobicContact CD1-CG 4.17Å; F303-L342 HydrophobicContact CD2-CD2 4.15Å; F303-L342 HydrophobicContact CE1-CB 4.1Å; F303-L342 HydrophobicContact CE1-CD2 3.75Å; F303-L342 HydrophobicContact CE1-CG 3.74Å; F303-L342 HydrophobicContact CE2-CD2 3.91Å; F303-L342 HydrophobicContact CG-CD2 4.19Å; F303-L342 HydrophobicContact CZ-CB 4.11Å; F303-L342 HydrophobicContact CZ-CD2 3.72Å; F303-L342 HydrophobicContact CZ-CG 4.05Å; V324-L342 HydrophobicContact CB-CD2 4.29Å; V324-L342 HydrophobicContact CG1-CD2 4.35Å; V324-L342 HydrophobicContact CG2-CD2 3.69Å; I331-L342 HydrophobicContact CD1-CD1 3.62Å; I331-L342 HydrophobicContact CD1-CD2 3.84Å; I331-L342 HydrophobicContact CD1-CG 4.4Å; I337-L342 HydrophobicContact CG2-CB 4.16Å; I337-L342 HydrophobicContact CG2-CD2 4.06Å; D338-L342 PolarHBondContact O-N 3.24Å; L342-Y345 PolarHBondContact O-N 2.95Å; L342-K346 VanDerWaalsContact O-CB 3.27Å; L342-K346 WeakPolarHBondContact O-CB 3.44Å; L342-K346 PolarHBondContact O-N 2.91Å; L342-V352 HydrophobicContact CD1-CB 4.11Å; L342-V352 HydrophobicContact CD1-CG1 4.14Å; L342-V352 HydrophobicContact CD2-CG1 4.33Å; L342-V352 HydrophobicContact CG-CG1 4.33Å; L342-F355 HydrophobicContact CD1-CB 3.98Å; L342-F355 HydrophobicContact CD1-CD1 4.11Å; L342-F355 HydrophobicContact CD1-CD2 4.04Å; L342-F355 HydrophobicContact CD1-CG 3.78Å
343	L	90.8	Very high	91.4	Very high	23 Å²	23	56.2 Å²	56.2	12%	0.12	29%	0.292	C	S	.	.	H	α-helix	trans	-65.7	-37.9	175.2	-179.1	61.4	0	0	0	112.3	F132 F303 A308 P339 E341 Q347	F132-L343 HydrophobicContact CZ-CD1 4.25Å; F303-L343 HydrophobicContact CE1-CB 4.2Å; A308-L343 HydrophobicContact CB-CD1 4.17Å; P339-L343 WeakPolarHBondContact O-CB 3.18Å; P339-L343 PolarHBondContact O-N 3.03Å; E341-L343 VanDerWaalsContact C-N 3.27Å; E341-L343 PolarHBondContact O-N 3.27Å; L343-Q347 WeakPolarHBondContact O-CB 3.22Å; L343-Q347 WeakPolarHBondContact O-CG 3.37Å; L343-Q347 PolarHBondContact O-N 2.93Å; L343-Q347 VanDerWaalsContact O-N 3.09Å
344	K	91.9	Very high	91.1	Very high	127 Å²	127	56.7 Å²	56.7	55%	0.552	30%	0.303	S	S	*	.	H	α-helix	trans	-66.5	-47.2	172.7	-69.7	165.9	-177	171.1	0	111.1	N340 E341 K346 Q347 M348	N340-K344 WeakPolarHBondContact O-CG 3.35Å; N340-K344 PolarHBondContact O-N 2.84Å; N340-K344 VanDerWaalsContact O-N 3.15Å; E341-K344 WeakPolarHBondContact O-CB 3.38Å; E341-K344 PolarHBondContact O-N 2.89Å; K344-K346 VanDerWaalsContact C-N 3.33Å; K344-K346 PolarHBondContact O-N 3.35Å; K344-Q347 WeakPolarHBondContact O-CB 3.22Å; K344-Q347 PolarHBondContact O-N 2.78Å; K344-Q347 VanDerWaalsContact O-N 3.11Å; K344-M348 WeakPolarHBondContact O-CG 3.3Å; K344-M348 PolarHBondContact O-N 3.01Å; K344-M348 VanDerWaalsContact O-N 3.1Å
345	Y	92.8	Very high	91	Very high	38 Å²	38	53.2 Å²	53.2	15%	0.149	28%	0.28	C	S	.	.	H	α-helix	trans	-54.3	-50.9	177.5	-177.3	-83.4	0	0	0	110.9	E341 L342 Q347 M348 N349 T351 I353 G354 F355	E341-Y345 PolarHBondContact O-N 3.15Å; L342-Y345 PolarHBondContact O-N 2.95Å; Y345-Q347 VanDerWaalsContact C-N 3.3Å; Y345-Q347 PolarHBondContact O-N 2.98Å; Y345-M348 PolarHBondContact O-N 2.83Å; Y345-M348 VanDerWaalsContact O-N 3.07Å; Y345-N349 HydrophobicContact CD1-CB 4.44Å; Y345-N349 HydrophobicContact CE1-CB 4.05Å; Y345-N349 WeakPolarHBondContact CE1-ND2 3.21Å; Y345-N349 WeakPolarHBondContact CE2-ND2 3.17Å; Y345-N349 PolarHBondContact O-N 3.44Å; Y345-N349 PolarHBondContact OH-ND2 3.08Å; Y345-T351 WeakPolarHBondContact CD1-O 3.3Å; Y345-I353 PolarHBondContact OH-O 2.69Å; Y345-I353 VanDerWaalsContact OH-O 3.07Å; Y345-G354 WeakPolarHBondContact CE2-O 3.11Å; Y345-G354 VanDerWaalsContact CZ-C 3.46Å; Y345-G354 VanDerWaalsContact CZ-O 3.23Å; Y345-G354 PolarHBondContact OH-O 3.19Å; Y345-F355 HydrophobicContact CD1-CB 4.39Å; Y345-F355 HydrophobicContact CD1-CD2 4.4Å; Y345-F355 AromaticContact CD2-CD2 3.72Å; Y345-F355 HydrophobicContact CD2-CD2 3.72Å; Y345-F355 HydrophobicContact CE1-CB 4.44Å; Y345-F355 HydrophobicContact CE2-CB 4.49Å; Y345-F355 HydrophobicContact CE2-CD2 4.41Å; Y345-F355 HydrophobicContact CG-CB 4.45Å; Y345-F355 AromaticContact CG-CD2 3.71Å; Y345-F355 HydrophobicContact CG-CD2 3.71Å
346	K	89.6	Confident	90.9	Very high	18 Å²	18	52.1 Å²	52.1	8%	0.078	28%	0.279	C	S	.	.	H	α-helix	trans	-62.5	-33.5	178.2	-171.7	174.7	-174.1	179	0	113.5	D136 F303 E326 L342 K344 M348 G350 T351 V352	D136-K346 VanDerWaalsContact CB-CE 3.42Å; D136-K346 WeakPolarHBondContact OD2-CE 3.1Å; D136-K346 IonicContact OD2-NZ 3.64Å; F303-K346 HydrophobicContact CD1-CD 3.91Å; F303-K346 PolarHBondContact O-NZ 3.04Å; E326-K346 IonicContact OE1-NZ 3.98Å; E326-K346 PolarHBondContact OE1-NZ 3.38Å; L342-K346 VanDerWaalsContact O-CB 3.27Å; L342-K346 WeakPolarHBondContact O-CB 3.44Å; L342-K346 PolarHBondContact O-N 2.91Å; K344-K346 VanDerWaalsContact C-N 3.33Å; K344-K346 PolarHBondContact O-N 3.35Å; K346-M348 VanDerWaalsContact C-N 3.33Å; K346-G350 VanDerWaalsContact O-CA 3.29Å; K346-G350 WeakPolarHBondContact O-CA 3.2Å; K346-G350 PolarHBondContact O-N 3.22Å; K346-T351 WeakPolarHBondContact CA-O 3.27Å; K346-V352 HydrophobicContact CD-CG1 3.85Å; K346-V352 HydrophobicContact CG-CG1 4.44Å
347	Q	87.5	Confident	90.6	Very high	112 Å²	112	55.4 Å²	55.4	52%	0.523	29%	0.292	S	S	.	.	H	α-helix	trans	-67.7	-31.4	174.2	-78.7	171.7	17.4	0	0	113.2	F132 L343 K344 Y345	F132-Q347 HydrophobicContact CE1-CG 3.72Å; F132-Q347 HydrophobicContact CZ-CG 4.06Å; L343-Q347 WeakPolarHBondContact O-CB 3.22Å; L343-Q347 WeakPolarHBondContact O-CG 3.37Å; L343-Q347 PolarHBondContact O-N 2.93Å; L343-Q347 VanDerWaalsContact O-N 3.09Å; K344-Q347 WeakPolarHBondContact O-CB 3.22Å; K344-Q347 PolarHBondContact O-N 2.78Å; K344-Q347 VanDerWaalsContact O-N 3.11Å; Y345-Q347 VanDerWaalsContact C-N 3.3Å; Y345-Q347 PolarHBondContact O-N 2.98Å
348	M	90.1	Very high	90.5	Very high	142 Å²	142	55.8 Å²	55.8	70%	0.7	30%	0.297	S	S	*	.	H	α-helix	trans	-84.5	-44.3	179.1	-63.5	-178.7	-62.1	0	0	112	K344 Y345 K346	K344-M348 WeakPolarHBondContact O-CG 3.3Å; K344-M348 PolarHBondContact O-N 3.01Å; K344-M348 VanDerWaalsContact O-N 3.1Å; Y345-M348 PolarHBondContact O-N 2.83Å; Y345-M348 VanDerWaalsContact O-N 3.07Å; K346-M348 VanDerWaalsContact C-N 3.33Å
349	N	89.6	Confident	90.4	Very high	92 Å²	92	59.5 Å²	59.5	49%	0.492	31%	0.312	S	S	.	.	H	α-helix	trans	-102.2	-15.5	-169.2	-63.9	-12.4	0	0	0	114.1	Y345 T351	Y345-N349 HydrophobicContact CD1-CB 4.44Å; Y345-N349 HydrophobicContact CE1-CB 4.05Å; Y345-N349 WeakPolarHBondContact CE1-ND2 3.21Å; Y345-N349 WeakPolarHBondContact CE2-ND2 3.17Å; Y345-N349 PolarHBondContact O-N 3.44Å; Y345-N349 PolarHBondContact OH-ND2 3.08Å; N349-T351 VanDerWaalsContact C-N 3.29Å; N349-T351 PolarHBondContact O-N 3.36Å
350	G	85.3	Confident	90.3	Very high	25 Å²	25	63.2 Å²	63.2	26%	0.258	34%	0.337	S	S	.	.	S	Bend	trans	69.4	21.7	179	0	0	0	0	0	115.1	K346	K346-G350 VanDerWaalsContact O-CA 3.29Å; K346-G350 WeakPolarHBondContact O-CA 3.2Å; K346-G350 PolarHBondContact O-N 3.22Å
351	T	89	Confident	90.2	Very high	30 Å²	30	63.3 Å²	63.3	18%	0.184	34%	0.339	C	S	.	.	S	Bend	trans	-154.2	166.1	172.8	177.7	0	0	0	0	109.4	D328 Y345 K346 N349 I353	D328-T351 WeakPolarHBondContact OD2-CB 3.47Å; D328-T351 PolarHBondContact OD2-OG1 2.72Å; Y345-T351 WeakPolarHBondContact CD1-O 3.3Å; K346-T351 WeakPolarHBondContact CA-O 3.27Å; N349-T351 VanDerWaalsContact C-N 3.29Å; N349-T351 PolarHBondContact O-N 3.36Å; T351-I353 HydrophobicContact CG2-CB 4.45Å; T351-I353 WeakPolarHBondContact OG1-CG1 3.42Å; T351-I353 PolarHBondContact OG1-N 2.91Å
352	V	89	Confident	90.1	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	34%	0.335	C	S	.	.	S	Bend	trans	-94.8	-12.8	168.1	-62.8	0	0	0	0	113	F303 E326 I331 L342 K346	F303-V352 HydrophobicContact CB-CG1 4.29Å; F303-V352 HydrophobicContact CD1-CG1 4.27Å; E326-V352 HydrophobicContact CB-CG2 4.01Å; E326-V352 HydrophobicContact CG-CG1 4.24Å; E326-V352 HydrophobicContact CG-CG2 3.83Å; I331-V352 HydrophobicContact CD1-CB 4.22Å; L342-V352 HydrophobicContact CD1-CB 4.11Å; L342-V352 HydrophobicContact CD1-CG1 4.14Å; L342-V352 HydrophobicContact CD2-CG1 4.33Å; L342-V352 HydrophobicContact CG-CG1 4.33Å; K346-V352 HydrophobicContact CD-CG1 3.85Å; K346-V352 HydrophobicContact CG-CG1 4.44Å
353	I	89.8	Confident	89.9	Confident	60 Å²	60	64.1 Å²	64.1	31%	0.308	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	136.5	-176.4	-59	173.2	0	0	0	109.5	D328 Y345 T351	D328-I353 HydrophobicContact CB-CD1 3.88Å; D328-I353 WeakPolarHBondContact O-CD1 3.13Å; Y345-I353 PolarHBondContact OH-O 2.69Å; Y345-I353 VanDerWaalsContact OH-O 3.07Å; T351-I353 HydrophobicContact CG2-CB 4.45Å; T351-I353 WeakPolarHBondContact OG1-CG1 3.42Å; T351-I353 PolarHBondContact OG1-N 2.91Å
354	G	88.3	Confident	89.7	Confident	37 Å²	37	68.7 Å²	68.7	38%	0.381	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.2	19.7	-179.1	0	0	0	0	0	114.4	Y345 D356	Y345-G354 WeakPolarHBondContact CE2-O 3.11Å; Y345-G354 VanDerWaalsContact CZ-C 3.46Å; Y345-G354 VanDerWaalsContact CZ-O 3.23Å; Y345-G354 PolarHBondContact OH-O 3.19Å; G354-D356 PolarHBondContact O-N 2.84Å
355	F	90.9	Very high	89.6	Confident	13 Å²	13	70 Å²	70	6%	0.057	38%	0.379	C	S	.	.			trans	-70.4	117.9	169.2	-179.2	-113	0	0	0	109.9	I331 I337 E341 L342 Y345 N357 A358	I331-F355 HydrophobicContact CD1-CB 4.4Å; I331-F355 HydrophobicContact CD1-CD1 4.49Å; I337-F355 HydrophobicContact CG2-CD1 4.39Å; I337-F355 HydrophobicContact CG2-CE1 3.91Å; E341-F355 HydrophobicContact CB-CE2 4.06Å; E341-F355 HydrophobicContact CB-CZ 3.85Å; L342-F355 HydrophobicContact CD1-CB 3.98Å; L342-F355 HydrophobicContact CD1-CD1 4.11Å; L342-F355 HydrophobicContact CD1-CD2 4.04Å; L342-F355 HydrophobicContact CD1-CG 3.78Å; Y345-F355 HydrophobicContact CD1-CB 4.39Å; Y345-F355 HydrophobicContact CD1-CD2 4.4Å; Y345-F355 AromaticContact CD2-CD2 3.72Å; Y345-F355 HydrophobicContact CD2-CD2 3.72Å; Y345-F355 HydrophobicContact CE1-CB 4.44Å; Y345-F355 HydrophobicContact CE2-CB 4.49Å; Y345-F355 HydrophobicContact CE2-CD2 4.41Å; Y345-F355 HydrophobicContact CG-CB 4.45Å; Y345-F355 AromaticContact CG-CD2 3.71Å; Y345-F355 HydrophobicContact CG-CD2 3.71Å; F355-N357 HydrophobicContact CD1-CB 4.21Å; F355-N357 HydrophobicContact CE1-CB 3.66Å; F355-N357 HydrophobicContact CZ-CB 4.17Å; F355-N357 PolarHBondContact O-N 3.15Å; F355-A358 HydrophobicContact CD1-CB 4.08Å; F355-A358 PolarHBondContact O-N 2.67Å
356	D	87.9	Confident	89.4	Confident	151 Å²	151	68.5 Å²	68.5	81%	0.807	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-32.1	-167.7	-57.4	-46.4	0	0	0	114.4	G354 A358	G354-D356 PolarHBondContact O-N 2.84Å; D356-A358 VanDerWaalsContact C-N 3.32Å; D356-A358 PolarHBondContact O-N 3.25Å
357	N	88.6	Confident	89.4	Confident	90 Å²	90	68.4 Å²	68.4	48%	0.481	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	21.5	-179.1	-62.7	-26	0	0	0	113.5	N333 F355	N333-N357 PolarHBondContact ND2-O 2.66Å; F355-N357 HydrophobicContact CD1-CB 4.21Å; F355-N357 HydrophobicContact CE1-CB 3.66Å; F355-N357 HydrophobicContact CZ-CB 4.17Å; F355-N357 PolarHBondContact O-N 3.15Å
358	A	91.4	Very high	89.4	Confident	16 Å²	16	64.2 Å²	64.2	13%	0.132	36%	0.356	C	S	.	.	S	Bend	trans	-153	144.5	174.8	0	0	0	0	0	113.9	I331 N333 I337 F355 D356	I331-A358 HydrophobicContact CB-CB 3.86Å; I331-A358 HydrophobicContact CD1-CB 4.18Å; I331-A358 HydrophobicContact CG1-CB 4.42Å; N333-A358 HydrophobicContact CB-CB 4.29Å; I337-A358 HydrophobicContact CD1-CB 4.14Å; I337-A358 HydrophobicContact CG1-CB 4.29Å; F355-A358 HydrophobicContact CD1-CB 4.08Å; F355-A358 PolarHBondContact O-N 2.67Å; D356-A358 VanDerWaalsContact C-N 3.32Å; D356-A358 PolarHBondContact O-N 3.25Å
359	E	92.2	Very high	89.5	Confident	141 Å²	141	58.2 Å²	58.2	66%	0.659	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.8	137.4	176.8	-64.7	-173.2	163.5	0	0	111.3	I331 Y332	I331-E359 CarbonylContact C-O 3.45Å; I331-E359 VanDerWaalsContact CA-O 3.3Å; I331-E359 WeakPolarHBondContact CA-O 3.45Å; Y332-E359 PolarHBondContact N-O 2.73Å; Y332-E359 PolarHBondContact O-N 3.14Å
360	C	91	Very high	89.6	Confident	80 Å²	80	57.8 Å²	57.8	54%	0.541	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	125.2	172.4	-63.7	0	0	0	0	110.4	A330	A330-C360 WeakPolarHBondContact O-CA 2.92Å
361	V	91.7	Very high	90.1	Very high	47 Å²	47	57.1 Å²	57.1	29%	0.285	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	164.5	-175.7	-65.1	0	0	0	0	111.7	A330 P363 L366	A330-V361 HydrophobicContact CB-CG2 4.05Å; A330-V361 PolarHBondContact O-N 2.84Å; V361-P363 WeakPolarHBondContact O-CD 3.3Å; V361-L366 HydrophobicContact CG2-CB 3.87Å; V361-L366 HydrophobicContact CG2-CD2 3.94Å; V361-L366 HydrophobicContact CG2-CG 4.34Å
362	D	90.8	Very high	90.4	Very high	63 Å²	63	57.4 Å²	57.4	34%	0.337	32%	0.321	S	S	.	.			trans	-65	121.4	173	168.6	18.9	0	0	0	110.6	N364 K365 L366	D362-N364 PolarHBondContact O-N 3.34Å; D362-N364 VanDerWaalsContact O-N 3.14Å; D362-N364 PolarHBondContact OD1-N 2.87Å; D362-N364 PolarHBondContact OD1-ND2 3.22Å; D362-K365 HydrophobicContact CB-CB 4.27Å; D362-K365 HydrophobicContact CB-CD 4.06Å; D362-K365 HydrophobicContact CB-CG 4.23Å; D362-K365 PolarHBondContact O-N 3.07Å; D362-K365 VanDerWaalsContact O-N 3.12Å; D362-K365 WeakPolarHBondContact OD2-CE 3.23Å; D362-K365 WeakPolarHBondContact OD2-CG 3.48Å; D362-L366 PolarHBondContact O-N 3.14Å
363	P	89.1	Confident	90.8	Very high	41 Å²	41	57.4 Å²	57.4	27%	0.266	32%	0.321	S	S	.	.	H	α-helix	trans	-48.4	-39.9	177.6	-32.5	38.1	0	0	0	114.7	V325 A330 V361 L366 F367	V325-P363 HydrophobicContact CG1-CB 3.94Å; A330-P363 HydrophobicContact CB-CB 4.17Å; A330-P363 HydrophobicContact CB-CG 3.93Å; V361-P363 WeakPolarHBondContact O-CD 3.3Å; P363-L366 PolarHBondContact O-N 3.37Å; P363-F367 VanDerWaalsContact O-CB 3.29Å; P363-F367 WeakPolarHBondContact O-CB 3.35Å; P363-F367 PolarHBondContact O-N 2.92Å
364	N	87.5	Confident	91.1	Very high	119 Å²	119	54.6 Å²	54.6	64%	0.636	31%	0.307	S	S	*	.	H	α-helix	trans	-70.8	-38.1	-176.1	-61.2	-69.4	0	0	0	111.8	D362 C368	D362-N364 PolarHBondContact O-N 3.34Å; D362-N364 VanDerWaalsContact O-N 3.14Å; D362-N364 PolarHBondContact OD1-N 2.87Å; D362-N364 PolarHBondContact OD1-ND2 3.22Å; N364-C368 PolarHBondContact O-N 2.86Å; N364-C368 PolarHBondContact O-SG 2.94Å
365	K	88.7	Confident	91.5	Very high	155 Å²	155	52.8 Å²	52.8	67%	0.674	29%	0.289	S	S	*	.	H	α-helix	trans	-68	-43.7	174.5	-70.9	175.7	-164	174.9	0	111.4	D362 C368 S369	D362-K365 HydrophobicContact CB-CB 4.27Å; D362-K365 HydrophobicContact CB-CD 4.06Å; D362-K365 HydrophobicContact CB-CG 4.23Å; D362-K365 PolarHBondContact O-N 3.07Å; D362-K365 VanDerWaalsContact O-N 3.12Å; D362-K365 WeakPolarHBondContact OD2-CE 3.23Å; D362-K365 WeakPolarHBondContact OD2-CG 3.48Å; K365-C368 CarbonylContact O-C 3.55Å; K365-C368 PolarHBondContact O-N 3.08Å; K365-S369 PolarHBondContact O-N 2.8Å; K365-S369 VanDerWaalsContact O-N 3.12Å
366	L	88.9	Confident	91.7	Very high	6 Å²	6	52.2 Å²	52.2	3%	0.031	29%	0.286	C	S	.	.	H	α-helix	trans	-66.1	-39.2	178.8	-176.2	58.3	0	0	0	112.1	V299 V325 A330 I331 Y332 V361 D362 P363 C368 S369	V299-L366 HydrophobicContact CG1-CG 4.23Å; V299-L366 HydrophobicContact CG2-CD1 4.35Å; V325-L366 HydrophobicContact CG2-CB 4.06Å; V325-L366 HydrophobicContact CG2-CD2 3.75Å; V325-L366 HydrophobicContact CG2-CG 3.89Å; A330-L366 HydrophobicContact CB-CB 4.32Å; A330-L366 HydrophobicContact CB-CD2 3.84Å; I331-L366 WeakPolarHBondContact O-CD2 3.41Å; Y332-L366 HydrophobicContact CD2-CD1 3.47Å; Y332-L366 VanDerWaalsContact CD2-CD1 3.47Å; Y332-L366 HydrophobicContact CE2-CD1 4.22Å; Y332-L366 HydrophobicContact CG-CD1 4.16Å; V361-L366 HydrophobicContact CG2-CB 3.87Å; V361-L366 HydrophobicContact CG2-CD2 3.94Å; V361-L366 HydrophobicContact CG2-CG 4.34Å; D362-L366 PolarHBondContact O-N 3.14Å; P363-L366 PolarHBondContact O-N 3.37Å; L366-C368 PolarHBondContact O-N 3.19Å; L366-S369 WeakPolarHBondContact O-CB 3.31Å; L366-S369 PolarHBondContact O-N 3.47Å; L366-S369 VanDerWaalsContact O-N 3.13Å; L366-S369 PolarHBondContact O-OG 3.38Å
367	F	89.2	Confident	91.8	Very high	17 Å²	17	45 Å²	45	8%	0.075	25%	0.247	C	C	.	.	H	α-helix	trans	-64.1	-23	177.4	-165.1	-102.1	0	0	0	113.4	Q301 P363 L374 V382 I383 I391	Q301-F367 HydrophobicContact CB-CD2 4.05Å; Q301-F367 HydrophobicContact CB-CE2 3.76Å; Q301-F367 HydrophobicContact CG-CD2 4.07Å; Q301-F367 HydrophobicContact CG-CE2 3.86Å; P363-F367 VanDerWaalsContact O-CB 3.29Å; P363-F367 WeakPolarHBondContact O-CB 3.35Å; P363-F367 PolarHBondContact O-N 2.92Å; F367-L374 HydrophobicContact CD2-CD1 4.16Å; F367-L374 HydrophobicContact CE1-CD2 4.33Å; F367-L374 HydrophobicContact CE2-CD1 4.09Å; F367-L374 HydrophobicContact CE2-CD2 4.24Å; F367-L374 HydrophobicContact CZ-CD2 4.05Å; F367-V382 HydrophobicContact CZ-CB 4.35Å; F367-V382 HydrophobicContact CZ-CG2 4.34Å; F367-I383 HydrophobicContact CE1-CD1 4.49Å; F367-I383 HydrophobicContact CE1-CG1 3.72Å; F367-I383 HydrophobicContact CZ-CD1 4.07Å; F367-I383 HydrophobicContact CZ-CG1 3.58Å; F367-I391 HydrophobicContact CE1-CD1 4.35Å
368	C	89.6	Confident	91.5	Very high	24 Å²	24	41 Å²	41	16%	0.162	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.1	11.7	176.9	-55.9	0	0	0	0	113.4	N364 K365 L366 F390 Q392	N364-C368 PolarHBondContact O-N 2.86Å; N364-C368 PolarHBondContact O-SG 2.94Å; K365-C368 CarbonylContact O-C 3.55Å; K365-C368 PolarHBondContact O-N 3.08Å; L366-C368 PolarHBondContact O-N 3.19Å; C368-F390 HydrophobicContact CB-CB 3.99Å; C368-Q392 PolarHBondContact O-NE2 3Å
369	S	90.6	Very high	90.9	Very high	16 Å²	16	41.9 Å²	41.9	11%	0.112	23%	0.23	C	C	.	.	S	Bend	trans	-72.5	157.5	-177.9	77.8	0	0	0	0	112.2	K365 L366 C371	K365-S369 PolarHBondContact O-N 2.8Å; K365-S369 VanDerWaalsContact O-N 3.12Å; L366-S369 WeakPolarHBondContact O-CB 3.31Å; L366-S369 PolarHBondContact O-N 3.47Å; L366-S369 VanDerWaalsContact O-N 3.13Å; L366-S369 PolarHBondContact O-OG 3.38Å; S369-C371 PolarHBondContact O-N 2.83Å
370	P	92.7	Very high	90.5	Very high	82 Å²	82	37.2 Å²	37.2	53%	0.532	21%	0.209	S	C	.	.			trans	-64.5	119.3	169.6	27.1	-34.2	0	0	0	110.7	I322	I322-P370 WeakPolarHBondContact CD1-O 3.47Å
371	C	94.7	Very high	90.2	Very high	11 Å²	11	36.2 Å²	36.2	7%	0.074	19%	0.193	C	C	.	.			trans	-149.2	162	171.7	56.4	0	0	0	0	109.3	T297 V299 I322 S369 A393	T297-C371 WeakPolarHBondContact OG1-CA 3.41Å; V299-C371 HydrophobicContact CG2-CB 3.94Å; I322-C371 HydrophobicContact CD1-CB 3.92Å; S369-C371 PolarHBondContact O-N 2.83Å; C371-A393 WeakPolarHBondContact O-CA 3.48Å
372	D	95.6	Very high	90.1	Very high	36 Å²	36	35 Å²	35	19%	0.193	19%	0.187	C	C	.	.	S	Bend	trans	-76.4	-43.1	173.7	-59.9	-71.9	0	0	0	111.1	L289 K296 T297 K394 V395	L289-D372 HydrophobicContact CD1-CB 4.28Å; L289-D372 WeakPolarHBondContact CD2-OD1 3.28Å; K296-D372 HydrophobicContact CB-CB 4.25Å; T297-D372 PolarHBondContact N-OD2 3.1Å; T297-D372 WeakPolarHBondContact O-CB 3.3Å; T297-D372 PolarHBondContact O-N 3.47Å; T297-D372 PolarHBondContact OG1-N 3.04Å; T297-D372 PolarHBondContact OG1-OD2 3.48Å; D372-K394 PolarHBondContact O-N 3.41Å; D372-V395 PolarHBondContact O-N 3.05Å
373	I	96.9	Very high	90.1	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	121.1	-171.9	-49.5	165.8	0	0	0	110.9	L274 L278 L293 K296 T297 F298 V299 I375 V395	L274-I373 HydrophobicContact CD1-CG2 4.19Å; L274-I373 HydrophobicContact CD2-CD1 4.32Å; L274-I373 HydrophobicContact CD2-CG2 3.81Å; L278-I373 HydrophobicContact CD1-CD1 3.79Å; L293-I373 HydrophobicContact CD2-CD1 4.2Å; K296-I373 HydrophobicContact CB-CD1 4.32Å; K296-I373 HydrophobicContact CD-CD1 4.29Å; T297-I373 PolarHBondContact O-N 3.06Å; F298-I373 CarbonylContact C-O 3.6Å; F298-I373 WeakPolarHBondContact CA-O 3.39Å; F298-I373 HydrophobicContact CB-CB 3.89Å; F298-I373 WeakPolarHBondContact CB-O 3.33Å; V299-I373 PolarHBondContact N-O 3.31Å; I373-I375 HydrophobicContact CG2-CD1 4.19Å; I373-I375 HydrophobicContact CG2-CG1 3.84Å; I373-V395 CarbonylContact C-O 3.58Å; I373-V395 WeakPolarHBondContact CA-O 3.25Å; I373-V395 HydrophobicContact CG1-CB 4.32Å
374	L	96.8	Very high	90.2	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.005	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	131.8	169.6	-179.6	64.7	0	0	0	110.4	V299 F367 P376 I383 I391 A393 V395 I396 A397	V299-L374 HydrophobicContact CB-CD1 4.1Å; V299-L374 HydrophobicContact CG1-CD1 4.05Å; F367-L374 HydrophobicContact CD2-CD1 4.16Å; F367-L374 HydrophobicContact CE1-CD2 4.33Å; F367-L374 HydrophobicContact CE2-CD1 4.09Å; F367-L374 HydrophobicContact CE2-CD2 4.24Å; F367-L374 HydrophobicContact CZ-CD2 4.05Å; L374-P376 WeakPolarHBondContact O-CD 3.17Å; L374-I383 HydrophobicContact CD2-CD1 4.21Å; L374-I391 HydrophobicContact CD2-CD1 4.32Å; L374-I391 HydrophobicContact CD2-CG1 4.48Å; L374-I391 HydrophobicContact CD2-CG2 3.98Å; L374-A393 HydrophobicContact CB-CB 3.58Å; L374-V395 PolarHBondContact N-O 3.4Å; L374-I396 HydrophobicContact CB-CG1 4.36Å; L374-I396 CarbonylContact O-C 3.27Å; L374-I396 VanDerWaalsContact O-CA 3.31Å; L374-I396 WeakPolarHBondContact O-CA 3.18Å; L374-A397 PolarHBondContact O-N 3.09Å
375	I	96.4	Very high	90.4	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	84.8	-174.1	-49.4	-176.7	0	0	0	110	V270 L274 F298 V299 V300 Q301 T310 L314 I373 A377 A397 A399	V270-I375 HydrophobicContact CG1-CG2 4.46Å; L274-I375 HydrophobicContact CD1-CD1 4.14Å; F298-I375 HydrophobicContact CD2-CD1 4.06Å; V299-I375 PolarHBondContact O-N 2.8Å; V300-I375 HydrophobicContact CB-CB 4.35Å; V300-I375 HydrophobicContact CG2-CB 4.26Å; V300-I375 HydrophobicContact CG2-CG2 4.34Å; Q301-I375 PolarHBondContact N-O 3.08Å; T310-I375 HydrophobicContact CG2-CD1 3.77Å; T310-I375 HydrophobicContact CG2-CG2 4.17Å; L314-I375 HydrophobicContact CD1-CD1 3.33Å; I373-I375 HydrophobicContact CG2-CD1 4.19Å; I373-I375 HydrophobicContact CG2-CG1 3.84Å; I375-A377 PolarHBondContact O-N 2.79Å; I375-A397 HydrophobicContact CG1-CB 4.47Å; I375-A399 HydrophobicContact CG2-CB 3.65Å
376	P	94.6	Very high	90.5	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	112.9	169.7	27.7	-34.9	0	0	0	110.2	L374 V382 I383 I396 A397 A399 A400 P403	L374-P376 WeakPolarHBondContact O-CD 3.17Å; P376-V382 HydrophobicContact CB-CG2 3.73Å; P376-I383 HydrophobicContact CG-CD1 4.18Å; P376-I396 HydrophobicContact CG-CG2 3.99Å; P376-A397 WeakPolarHBondContact CD-O 3.45Å; P376-A399 CarbonylContact O-C 3.59Å; P376-A399 WeakPolarHBondContact O-CB 3.42Å; P376-A399 PolarHBondContact O-N 3.13Å; P376-A400 VanDerWaalsContact O-CB 3.26Å; P376-A400 WeakPolarHBondContact O-CB 3.27Å; P376-A400 PolarHBondContact O-N 3.15Å; P376-P403 HydrophobicContact CB-CB 3.69Å; P376-P403 HydrophobicContact CB-CG 4.14Å; P376-P403 HydrophobicContact CG-CB 3.89Å; P376-P403 HydrophobicContact CG-CG 3.82Å
377	A	90.9	Very high	90.7	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	16%	0.16	C	C	.	.			trans	-129.2	-0.5	-175.4	0	0	0	0	0	113.9	V300 Q301 V306 I375 A399	V300-A377 HydrophobicContact CG2-CB 4.35Å; Q301-A377 CarbonylContact O-C 3.19Å; Q301-A377 VanDerWaalsContact O-C 3.27Å; Q301-A377 WeakPolarHBondContact O-CA 3.44Å; Q301-A377 VanDerWaalsContact O-CB 3.29Å; Q301-A377 WeakPolarHBondContact O-CB 3.37Å; Q301-A377 PolarHBondContact O-N 3.1Å; V306-A377 HydrophobicContact CB-CB 4.45Å; V306-A377 HydrophobicContact CG1-CB 4.43Å; I375-A377 PolarHBondContact O-N 2.79Å; A377-A399 HydrophobicContact CB-CB 3.81Å
378	A	82.4	Confident	90.7	Very high	5 Å²	5	25.7 Å²	25.7	4%	0.041	16%	0.157	C	C	.	.	S	Bend	trans	-90.2	-84.9	175	0	0	0	0	0	113.2	R139 Q301	R139-A378 CarbonylContact C-O 3.43Å; R139-A378 WeakPolarHBondContact CA-O 3.25Å; R139-A378 WeakPolarHBondContact CB-O 3.48Å; R139-A378 PolarHBondContact N-O 3.14Å; Q301-A378 PolarHBondContact O-N 2.86Å; Q301-A378 VanDerWaalsContact OE1-CB 3.29Å; Q301-A378 VanDerWaalsContact OE1-N 3.12Å
379	T	79.3	Confident	90.8	Very high	35 Å²	35	30.4 Å²	30.4	22%	0.215	18%	0.177	C	C	.	.			trans	-116.6	164.6	-167.8	77.8	0	0	0	0	112.5	R139 V382	R139-T379 HydrophobicContact CB-CG2 4.02Å; R139-T379 HydrophobicContact CG-CG2 3.89Å; T379-V382 WeakPolarHBondContact OG1-CG1 3.33Å
380	E	82.6	Confident	90.9	Very high	44 Å²	44	35.3 Å²	35.3	21%	0.206	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	158.5	162.5	59.3	-85.7	-158.7	0	0	112.1	Y44 V382 G402	Y44-E380 HydrophobicContact CE2-CB 4.38Å; E380-V382 PolarHBondContact O-N 2.99Å; E380-G402 WeakPolarHBondContact CA-O 3.46Å
381	R	85.2	Confident	90.9	Very high	58 Å²	58	31.4 Å²	31.4	22%	0.219	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.1	13.7	173.6	-47	-177	-169.4	-162.5	-2.8	118.3	E41 M42 M47 I383 G402 P403 T405	E41-R381 IonicContact OE2-CZ 2.67Å; E41-R381 IonicContact OE2-NH1 2.99Å; E41-R381 PolarHBondContact OE2-NH1 3.37Å; M42-R381 PolarHBondContact O-NH1 3.21Å; M42-R381 PolarHBondContact O-NH2 2.93Å; M47-R381 HydrophobicContact SD-CG 4.19Å; R381-I383 PolarHBondContact O-N 3.27Å; R381-I383 VanDerWaalsContact O-N 3.13Å; R381-G402 PolarHBondContact N-O 3.26Å; R381-P403 CarbonylContact C-O 3.6Å; R381-P403 VanDerWaalsContact C-O 3.24Å; R381-P403 VanDerWaalsContact CA-O 3.28Å; R381-P403 WeakPolarHBondContact CA-O 3.26Å; R381-P403 PolarHBondContact N-O 3.07Å; R381-T405 HydrophobicContact CB-CG2 3.92Å; R381-T405 HydrophobicContact CG-CG2 4.12Å
382	V	88.9	Confident	90.9	Very high	23 Å²	23	35.9 Å²	35.9	14%	0.139	19%	0.191	C	C	.	.			trans	-58	-24.4	176.6	-67.7	0	0	0	0	113.6	F367 P376 T379 E380 N387 P403	F367-V382 HydrophobicContact CZ-CB 4.35Å; F367-V382 HydrophobicContact CZ-CG2 4.34Å; P376-V382 HydrophobicContact CB-CG2 3.73Å; T379-V382 WeakPolarHBondContact OG1-CG1 3.33Å; E380-V382 PolarHBondContact O-N 2.99Å; V382-N387 PolarHBondContact O-ND2 3.4Å; V382-P403 HydrophobicContact CG2-CB 3.54Å; V382-P403 PolarHBondContact N-O 3.24Å
383	I	92	Very high	90.9	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.183	C	C	.	.	B	Isolated β-bridge	trans	-112.5	110.1	175.4	-64.4	168.1	0	0	0	107.9	F367 L374 P376 R381 N387 A388 I391 I396 P403 I404 T405 A408 L412	F367-I383 HydrophobicContact CE1-CD1 4.49Å; F367-I383 HydrophobicContact CE1-CG1 3.72Å; F367-I383 HydrophobicContact CZ-CD1 4.07Å; F367-I383 HydrophobicContact CZ-CG1 3.58Å; L374-I383 HydrophobicContact CD2-CD1 4.21Å; P376-I383 HydrophobicContact CG-CD1 4.18Å; R381-I383 PolarHBondContact O-N 3.27Å; R381-I383 VanDerWaalsContact O-N 3.13Å; I383-N387 WeakPolarHBondContact CA-OD1 3.25Å; I383-A388 HydrophobicContact CG2-CB 4.46Å; I383-I391 HydrophobicContact CB-CD1 4.26Å; I383-I391 HydrophobicContact CD1-CD1 3.99Å; I383-I391 HydrophobicContact CG1-CD1 3.76Å; I383-I391 HydrophobicContact CG2-CD1 3.58Å; I383-I396 HydrophobicContact CD1-CD1 4.16Å; I383-I396 HydrophobicContact CD1-CG2 3.99Å; I383-P403 PolarHBondContact N-O 3.44Å; I383-I404 HydrophobicContact CB-CB 4.39Å; I383-I404 HydrophobicContact CB-CG1 3.9Å; I383-I404 HydrophobicContact CD1-CD1 4.36Å; I383-I404 HydrophobicContact CD1-CG1 3.77Å; I383-I404 HydrophobicContact CG1-CG1 4.39Å; I383-I404 HydrophobicContact CG2-CB 4.45Å; I383-I404 HydrophobicContact CG2-CG1 4.04Å; I383-I404 HydrophobicContact CG2-CG2 4.15Å; I383-I404 WeakPolarHBondContact O-CA 3.29Å; I383-T405 PolarHBondContact O-N 3.32Å; I383-A408 HydrophobicContact CG2-CB 3.85Å; I383-L412 HydrophobicContact CG2-CD1 3.81Å
384	N	91.3	Very high	90.8	Very high	33 Å²	33	38.9 Å²	38.9	18%	0.176	20%	0.203	C	C	.	.			trans	-135.1	-177.2	-169.6	65.4	33.9	0	0	0	111.4	S386 N387 A388 T405	N384-S386 PolarHBondContact O-N 2.87Å; N384-S386 PolarHBondContact OD1-N 3.47Å; N384-S386 VanDerWaalsContact OD1-N 3.09Å; N384-S386 PolarHBondContact OD1-OG 2.9Å; N384-N387 PolarHBondContact N-OD1 2.83Å; N384-N387 PolarHBondContact O-N 3.24Å; N384-N387 PolarHBondContact O-OD1 2.6Å; N384-N387 PolarHBondContact OD1-N 2.94Å; N384-N387 PolarHBondContact OD1-OD1 2.73Å; N384-A388 VanDerWaalsContact O-CB 3.24Å; N384-A388 WeakPolarHBondContact O-CB 3.38Å; N384-A388 PolarHBondContact O-N 2.94Å; N384-T405 HydrophobicContact CB-CG2 3.99Å
385	A	90.5	Very high	90.7	Very high	59 Å²	59	38.8 Å²	38.8	49%	0.488	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-25.1	-173.9	0	0	0	0	0	114.1	I407	A385-I407 HydrophobicContact CB-CB 4.41Å; A385-I407 HydrophobicContact CB-CG2 3.85Å
386	S	91.2	Very high	90.7	Very high	81 Å²	81	38.8 Å²	38.8	57%	0.566	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-33.1	-178.8	67.9	0	0	0	0	112.9	N384 F390	N384-S386 PolarHBondContact O-N 2.87Å; N384-S386 PolarHBondContact OD1-N 3.47Å; N384-S386 VanDerWaalsContact OD1-N 3.09Å; N384-S386 PolarHBondContact OD1-OG 2.9Å; S386-F390 WeakPolarHBondContact O-CE2 3.45Å
387	N	92.7	Very high	90.9	Very high	29 Å²	29	38.8 Å²	38.8	16%	0.155	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.1	-19.6	-176.2	71.4	8.7	0	0	0	115.7	V382 I383 N384 Q389 F390 I391	V382-N387 PolarHBondContact O-ND2 3.4Å; I383-N387 WeakPolarHBondContact CA-OD1 3.25Å; N384-N387 PolarHBondContact N-OD1 2.83Å; N384-N387 PolarHBondContact O-N 3.24Å; N384-N387 PolarHBondContact O-OD1 2.6Å; N384-N387 PolarHBondContact OD1-N 2.94Å; N384-N387 PolarHBondContact OD1-OD1 2.73Å; N387-Q389 PolarHBondContact O-N 2.65Å; N387-F390 PolarHBondContact O-N 2.9Å; N387-I391 PolarHBondContact O-N 3.41Å
388	A	90.5	Very high	91	Very high	2 Å²	2	39.5 Å²	39.5	2%	0.017	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-27.1	-176.6	0	0	0	0	0	114.9	I383 N384 A408 A411 L412 R415	I383-A388 HydrophobicContact CG2-CB 4.46Å; N384-A388 VanDerWaalsContact O-CB 3.24Å; N384-A388 WeakPolarHBondContact O-CB 3.38Å; N384-A388 PolarHBondContact O-N 2.94Å; A388-A408 HydrophobicContact CB-CB 3.74Å; A388-A411 HydrophobicContact CB-CB 4.28Å; A388-L412 HydrophobicContact CB-CG 4.41Å; A388-R415 PolarHBondContact O-NH1 2.71Å
389	Q	91.6	Very high	91.5	Very high	124 Å²	124	39.3 Å²	39.3	58%	0.579	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-27.1	175.3	64.2	-176.8	-15.4	0	0	113.6	N387 R415	N387-Q389 PolarHBondContact O-N 2.65Å; Q389-R415 PolarHBondContact O-NH1 2.94Å
390	F	92.6	Very high	91.9	Very high	118 Å²	118	37.6 Å²	37.6	52%	0.518	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-17.7	-176.3	-57	-58.4	0	0	0	113.4	C368 S386 N387 Q392	C368-F390 HydrophobicContact CB-CB 3.99Å; S386-F390 WeakPolarHBondContact O-CE2 3.45Å; N387-F390 PolarHBondContact O-N 2.9Å; F390-Q392 WeakPolarHBondContact O-CG 3.49Å; F390-Q392 PolarHBondContact O-N 2.91Å
391	I	93.4	Very high	91.9	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.005	18%	0.184	C	C	.	.			trans	-60.3	123.8	175.3	-63.6	173.3	0	0	0	109.4	F367 L374 I383 N387 A393 I396 L412 R415	F367-I391 HydrophobicContact CE1-CD1 4.35Å; L374-I391 HydrophobicContact CD2-CD1 4.32Å; L374-I391 HydrophobicContact CD2-CG1 4.48Å; L374-I391 HydrophobicContact CD2-CG2 3.98Å; I383-I391 HydrophobicContact CB-CD1 4.26Å; I383-I391 HydrophobicContact CD1-CD1 3.99Å; I383-I391 HydrophobicContact CG1-CD1 3.76Å; I383-I391 HydrophobicContact CG2-CD1 3.58Å; N387-I391 PolarHBondContact O-N 3.41Å; I391-A393 HydrophobicContact CG2-CB 3.87Å; I391-I396 HydrophobicContact CD1-CD1 4.48Å; I391-I396 HydrophobicContact CG2-CD1 4.09Å; I391-L412 HydrophobicContact CB-CD2 4.34Å; I391-L412 HydrophobicContact CD1-CD2 4.44Å; I391-L412 HydrophobicContact CG2-CD2 4.41Å; I391-R415 VanDerWaalsContact O-CZ 3.26Å; I391-R415 PolarHBondContact O-NH1 3.45Å; I391-R415 PolarHBondContact O-NH2 2.91Å
392	Q	93.1	Very high	92	Very high	105 Å²	105	33 Å²	33	49%	0.491	18%	0.176	S	C	.	.			trans	-99.1	-9.5	179.3	-61.1	-177	53.9	0	0	113	C368 F390	C368-Q392 PolarHBondContact O-NE2 3Å; F390-Q392 WeakPolarHBondContact O-CG 3.49Å; F390-Q392 PolarHBondContact O-N 2.91Å
393	A	95.4	Very high	92	Very high	2 Å²	2	31.9 Å²	31.9	2%	0.017	17%	0.169	C	C	.	.			trans	-57.8	141.1	-179.6	0	0	0	0	0	113.3	C371 L374 I391 I396	C371-A393 WeakPolarHBondContact O-CA 3.48Å; L374-A393 HydrophobicContact CB-CB 3.58Å; I391-A393 HydrophobicContact CG2-CB 3.87Å; A393-I396 HydrophobicContact CB-CG1 4.47Å
394	K	94.5	Very high	92	Very high	96 Å²	96	32 Å²	32	42%	0.417	17%	0.17	S	C	.	.	S	Bend	trans	-88.7	-29.9	178.1	-68.8	-63.1	-174.8	173.3	0	112.9	I287 L289 D372 L418	I287-K394 HydrophobicContact CG2-CB 3.75Å; I287-K394 HydrophobicContact CG2-CD 4.35Å; I287-K394 HydrophobicContact CG2-CG 4.44Å; L289-K394 HydrophobicContact CD1-CB 3.77Å; L289-K394 HydrophobicContact CD1-CG 4.43Å; L289-K394 HydrophobicContact CD2-CG 4.43Å; L289-K394 HydrophobicContact CG-CB 4.24Å; L289-K394 HydrophobicContact CG-CG 4.43Å; D372-K394 PolarHBondContact O-N 3.41Å; K394-L418 PolarHBondContact O-N 3.48Å
395	V	96.4	Very high	92.1	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	137	175.7	-174.8	0	0	0	0	108.8	L274 L278 L289 D372 I373 L374 L418 L420	L274-V395 HydrophobicContact CD2-CG1 4.06Å; L278-V395 HydrophobicContact CD2-CG2 4.08Å; L289-V395 HydrophobicContact CD1-CG2 4.13Å; D372-V395 PolarHBondContact O-N 3.05Å; I373-V395 CarbonylContact C-O 3.58Å; I373-V395 WeakPolarHBondContact CA-O 3.25Å; I373-V395 HydrophobicContact CG1-CB 4.32Å; L374-V395 PolarHBondContact N-O 3.4Å; V395-L418 CarbonylContact C-O 3.59Å; V395-L418 WeakPolarHBondContact CA-O 3.49Å; V395-L418 HydrophobicContact CG1-CB 4.49Å; V395-L418 HydrophobicContact CG1-CD2 4.28Å; V395-L418 HydrophobicContact CG1-CG 4.42Å; V395-L418 HydrophobicContact CG2-CB 4.35Å; V395-L418 HydrophobicContact CG2-CD2 4.41Å; V395-L420 HydrophobicContact CG1-CG 4.45Å
396	I	96.7	Very high	92.2	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	119.5	171.6	-52	-176.5	0	0	0	108.4	L374 P376 I383 I391 A393 I404 L412 V417 L418 I419 L420	L374-I396 HydrophobicContact CB-CG1 4.36Å; L374-I396 CarbonylContact O-C 3.27Å; L374-I396 VanDerWaalsContact O-CA 3.31Å; L374-I396 WeakPolarHBondContact O-CA 3.18Å; P376-I396 HydrophobicContact CG-CG2 3.99Å; I383-I396 HydrophobicContact CD1-CD1 4.16Å; I383-I396 HydrophobicContact CD1-CG2 3.99Å; I391-I396 HydrophobicContact CD1-CD1 4.48Å; I391-I396 HydrophobicContact CG2-CD1 4.09Å; A393-I396 HydrophobicContact CB-CG1 4.47Å; I396-I404 HydrophobicContact CG2-CD1 4.03Å; I396-L412 HydrophobicContact CD1-CD1 3.69Å; I396-L412 HydrophobicContact CD1-CD2 4.05Å; I396-L412 HydrophobicContact CD1-CG 4.49Å; I396-V417 HydrophobicContact CD1-CG1 3.94Å; I396-V417 HydrophobicContact CG1-CG1 3.76Å; I396-L418 PolarHBondContact N-O 3.24Å; I396-I419 WeakPolarHBondContact O-CA 3.42Å; I396-L420 PolarHBondContact O-N 3.38Å
397	A	96.8	Very high	92.2	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	107.1	177.3	0	0	0	0	0	110	V270 L274 L374 I375 P376 A399 L420 T425	V270-A397 HydrophobicContact CG1-CB 4.21Å; L274-A397 HydrophobicContact CD1-CB 3.97Å; L274-A397 HydrophobicContact CD2-CB 3.97Å; L274-A397 HydrophobicContact CG-CB 3.98Å; L374-A397 PolarHBondContact O-N 3.09Å; I375-A397 HydrophobicContact CG1-CB 4.47Å; P376-A397 WeakPolarHBondContact CD-O 3.45Å; A397-A399 PolarHBondContact O-N 3.06Å; A397-L420 HydrophobicContact CB-CD1 4.47Å; A397-T425 HydrophobicContact CB-CG2 4.12Å
398	E	94.9	Very high	92.3	Very high	15 Å²	15	27.9 Å²	27.9	7%	0.07	13%	0.133	C	C	.	.			trans	-70.5	80.3	179	-60.9	-162.8	122.1	0	0	111.1	A400 P403 I404 I419 L420 P421 D422	E398-A400 VanDerWaalsContact C-N 3.31Å; E398-A400 CarbonylContact C-O 3.58Å; E398-A400 VanDerWaalsContact O-O 3.13Å; E398-P403 HydrophobicContact CB-CG 3.79Å; E398-P403 HydrophobicContact CG-CG 3.64Å; E398-P403 WeakPolarHBondContact OE1-CD 3.22Å; E398-P403 VanDerWaalsContact OE1-CG 3.23Å; E398-P403 WeakPolarHBondContact OE1-CG 3.27Å; E398-I404 HydrophobicContact CG-CD1 3.95Å; E398-I404 HydrophobicContact CG-CG1 4.43Å; E398-I404 VanDerWaalsContact OE1-CB 3.32Å; E398-I404 WeakPolarHBondContact OE1-CB 3.42Å; E398-I404 WeakPolarHBondContact OE1-CD1 3.26Å; E398-I404 VanDerWaalsContact OE1-CG1 3.25Å; E398-I404 WeakPolarHBondContact OE1-CG1 3.38Å; E398-I404 PolarHBondContact OE1-N 3.06Å; E398-I419 HydrophobicContact CG-CG2 4.22Å; E398-L420 WeakPolarHBondContact CB-O 3.29Å; E398-L420 PolarHBondContact N-O 3.49Å; E398-P421 VanDerWaalsContact OE2-CA 3.3Å; E398-P421 WeakPolarHBondContact OE2-CA 3.05Å; E398-D422 HydrophobicContact CB-CB 3.84Å; E398-D422 PolarHBondContact OE2-N 2.87Å
399	A	92.1	Very high	92.4	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.138	C	C	.	.			trans	-70.9	-32.7	173.5	0	0	0	0	0	110.8	L140 V270 V306 I375 P376 A377 A397 N426	L140-A399 WeakPolarHBondContact CD2-O 3.26Å; V270-A399 HydrophobicContact CG1-CB 4.23Å; V270-A399 HydrophobicContact CG2-CB 3.75Å; V306-A399 HydrophobicContact CG1-CB 3.86Å; I375-A399 HydrophobicContact CG2-CB 3.65Å; P376-A399 CarbonylContact O-C 3.59Å; P376-A399 WeakPolarHBondContact O-CB 3.42Å; P376-A399 PolarHBondContact O-N 3.13Å; A377-A399 HydrophobicContact CB-CB 3.81Å; A397-A399 PolarHBondContact O-N 3.06Å; A399-N426 WeakPolarHBondContact O-CB 3.35Å; A399-N426 PolarHBondContact O-ND2 3.07Å
400	A	86.9	Confident	92.5	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	13%	0.13	C	C	.	.	S	Bend	trans	-74.7	170	164.4	0	0	0	0	0	112.4	L140 P376 E398 P403 D422 N426	L140-A400 HydrophobicContact CD1-CB 3.85Å; L140-A400 VanDerWaalsContact CD2-C 3.41Å; P376-A400 VanDerWaalsContact O-CB 3.26Å; P376-A400 WeakPolarHBondContact O-CB 3.27Å; P376-A400 PolarHBondContact O-N 3.15Å; E398-A400 VanDerWaalsContact C-N 3.31Å; E398-A400 CarbonylContact C-O 3.58Å; E398-A400 VanDerWaalsContact O-O 3.13Å; A400-P403 HydrophobicContact CB-CB 3.91Å; A400-P403 HydrophobicContact CB-CG 3.96Å; A400-D422 WeakPolarHBondContact O-CB 3.5Å; A400-N426 VanDerWaalsContact C-ND2 3.35Å; A400-N426 PolarHBondContact O-ND2 3.1Å
401	N	83.8	Confident	92.5	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.12	C	C	.	.	S	Bend	trans	-103.9	127.8	176.2	-54.4	-41.8	0	0	0	107.1	Y44 L140 L158 L161 K165 P403 D422 N426	Y44-N401 PolarHBondContact OH-O 3.29Å; L140-N401 HydrophobicContact CD1-CB 3.7Å; L140-N401 HydrophobicContact CD2-CB 4.26Å; L140-N401 VanDerWaalsContact CD2-CG 3.47Å; L140-N401 VanDerWaalsContact CD2-OD1 3.27Å; L140-N401 WeakPolarHBondContact CD2-OD1 3.38Å; L140-N401 HydrophobicContact CG-CB 4.27Å; L158-N401 HydrophobicContact CD2-CB 4.34Å; L161-N401 HydrophobicContact CD1-CB 4.19Å; K165-N401 PolarHBondContact NZ-OD1 2.98Å; N401-P403 VanDerWaalsContact C-N 3.33Å; N401-D422 VanDerWaalsContact CA-OD2 3.28Å; N401-D422 WeakPolarHBondContact CA-OD2 3.42Å; N401-D422 WeakPolarHBondContact CB-OD2 3.44Å; N401-N426 PolarHBondContact OD1-ND2 2.84Å; N401-N426 PolarHBondContact OD1-OD1 2.87Å
402	G	86	Confident	92.6	Very high	5 Å²	5	23.4 Å²	23.4	5%	0.052	12%	0.12	C	C	.	.	S	Bend	trans	48.4	41	-174.1	0	0	0	0	0	116.2	M47 E380 R381 I404	M47-G402 WeakPolarHBondContact CE-O 3.4Å; E380-G402 WeakPolarHBondContact CA-O 3.46Å; R381-G402 PolarHBondContact N-O 3.26Å; G402-I404 VanDerWaalsContact C-N 3.28Å; G402-I404 PolarHBondContact O-N 3.16Å
403	P	89.7	Confident	92.5	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.115	C	C	.	.			trans	-67.6	-27.3	174.4	29.2	-33.4	0	0	0	112.7	P376 R381 V382 I383 E398 A400 N401	P376-P403 HydrophobicContact CB-CB 3.69Å; P376-P403 HydrophobicContact CB-CG 4.14Å; P376-P403 HydrophobicContact CG-CB 3.89Å; P376-P403 HydrophobicContact CG-CG 3.82Å; R381-P403 CarbonylContact C-O 3.6Å; R381-P403 VanDerWaalsContact C-O 3.24Å; R381-P403 VanDerWaalsContact CA-O 3.28Å; R381-P403 WeakPolarHBondContact CA-O 3.26Å; R381-P403 PolarHBondContact N-O 3.07Å; V382-P403 HydrophobicContact CG2-CB 3.54Å; V382-P403 PolarHBondContact N-O 3.24Å; I383-P403 PolarHBondContact N-O 3.44Å; E398-P403 HydrophobicContact CB-CG 3.79Å; E398-P403 HydrophobicContact CG-CG 3.64Å; E398-P403 WeakPolarHBondContact OE1-CD 3.22Å; E398-P403 VanDerWaalsContact OE1-CG 3.23Å; E398-P403 WeakPolarHBondContact OE1-CG 3.27Å; A400-P403 HydrophobicContact CB-CB 3.91Å; A400-P403 HydrophobicContact CB-CG 3.96Å; N401-P403 VanDerWaalsContact C-N 3.33Å
404	I	92.9	Very high	92.4	Very high	2 Å²	2	30.2 Å²	30.2	1%	0.01	15%	0.151	C	C	.	.	B	Isolated β-bridge	trans	-100.4	120.9	179.3	-58.2	170.2	0	0	0	110.6	M47 I383 I396 E398 G402 A408 D409 L412 I419	M47-I404 WeakPolarHBondContact CE-O 3.18Å; I383-I404 HydrophobicContact CB-CB 4.39Å; I383-I404 HydrophobicContact CB-CG1 3.9Å; I383-I404 HydrophobicContact CD1-CD1 4.36Å; I383-I404 HydrophobicContact CD1-CG1 3.77Å; I383-I404 HydrophobicContact CG1-CG1 4.39Å; I383-I404 HydrophobicContact CG2-CB 4.45Å; I383-I404 HydrophobicContact CG2-CG1 4.04Å; I383-I404 HydrophobicContact CG2-CG2 4.15Å; I383-I404 WeakPolarHBondContact O-CA 3.29Å; I396-I404 HydrophobicContact CG2-CD1 4.03Å; E398-I404 HydrophobicContact CG-CD1 3.95Å; E398-I404 HydrophobicContact CG-CG1 4.43Å; E398-I404 VanDerWaalsContact OE1-CB 3.32Å; E398-I404 WeakPolarHBondContact OE1-CB 3.42Å; E398-I404 WeakPolarHBondContact OE1-CD1 3.26Å; E398-I404 VanDerWaalsContact OE1-CG1 3.25Å; E398-I404 WeakPolarHBondContact OE1-CG1 3.38Å; E398-I404 PolarHBondContact OE1-N 3.06Å; G402-I404 VanDerWaalsContact C-N 3.28Å; G402-I404 PolarHBondContact O-N 3.16Å; I404-A408 HydrophobicContact CG2-CB 3.88Å; I404-D409 HydrophobicContact CG2-CB 3.95Å; I404-L412 HydrophobicContact CD1-CD1 4.3Å; I404-L412 HydrophobicContact CG2-CD1 4.2Å; I404-I419 HydrophobicContact CD1-CB 4.45Å; I404-I419 HydrophobicContact CD1-CD1 3.95Å; I404-I419 HydrophobicContact CD1-CG1 4.03Å; I404-I419 HydrophobicContact CD1-CG2 3.59Å
405	T	92.7	Very high	92.3	Very high	15 Å²	15	30.9 Å²	30.9	9%	0.092	15%	0.151	C	C	.	.			trans	-70.2	156.2	173.4	72.2	0	0	0	0	111.7	R381 I383 N384 I407 A408 D409	R381-T405 HydrophobicContact CB-CG2 3.92Å; R381-T405 HydrophobicContact CG-CG2 4.12Å; I383-T405 PolarHBondContact O-N 3.32Å; N384-T405 HydrophobicContact CB-CG2 3.99Å; T405-I407 VanDerWaalsContact C-N 3.29Å; T405-I407 PolarHBondContact O-N 3.01Å; T405-A408 WeakPolarHBondContact O-CA 3.33Å; T405-A408 WeakPolarHBondContact O-CB 3.26Å; T405-A408 PolarHBondContact O-N 3.01Å; T405-D409 PolarHBondContact O-N 3.4Å
406	P	92	Very high	92.1	Very high	4 Å²	4	36.6 Å²	36.6	3%	0.026	18%	0.182	C	C	.	.	H	α-helix	trans	-57.4	-38	-176.5	-27.6	36	0	0	0	114.1	M42 M47 H50 F51 A408 D409 E410	M42-P406 HydrophobicContact CE-CB 4.14Å; M42-P406 HydrophobicContact CE-CG 3.74Å; M47-P406 HydrophobicContact CG-CG 4.08Å; H50-P406 HydrophobicContact CB-CG 4.42Å; F51-P406 HydrophobicContact CE1-CB 4.31Å; F51-P406 HydrophobicContact CE1-CG 4.3Å; F51-P406 HydrophobicContact CE2-CG 3.9Å; F51-P406 HydrophobicContact CZ-CB 4.15Å; F51-P406 HydrophobicContact CZ-CG 3.79Å; P406-A408 VanDerWaalsContact C-N 3.32Å; P406-A408 PolarHBondContact O-N 3.37Å; P406-D409 PolarHBondContact O-N 3.16Å; P406-E410 WeakPolarHBondContact O-CG 3.16Å; P406-E410 PolarHBondContact O-N 3.41Å
407	I	92.2	Very high	92	Very high	97 Å²	97	37.1 Å²	37.1	50%	0.497	19%	0.185	S	C	.	.	H	α-helix	trans	-64.8	-38.9	176.8	-60.4	172	0	0	0	110.7	A385 T405 E410 A411	A385-I407 HydrophobicContact CB-CB 4.41Å; A385-I407 HydrophobicContact CB-CG2 3.85Å; T405-I407 VanDerWaalsContact C-N 3.29Å; T405-I407 PolarHBondContact O-N 3.01Å; I407-E410 PolarHBondContact O-N 3.41Å; I407-A411 PolarHBondContact O-N 2.88Å; I407-A411 VanDerWaalsContact O-N 3.14Å
408	A	93.4	Very high	91.9	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-71.9	-37.3	178.2	0	0	0	0	0	112.8	I383 A388 I404 T405 P406 E410 A411 L412	I383-A408 HydrophobicContact CG2-CB 3.85Å; A388-A408 HydrophobicContact CB-CB 3.74Å; I404-A408 HydrophobicContact CG2-CB 3.88Å; T405-A408 WeakPolarHBondContact O-CA 3.33Å; T405-A408 WeakPolarHBondContact O-CB 3.26Å; T405-A408 PolarHBondContact O-N 3.01Å; P406-A408 VanDerWaalsContact C-N 3.32Å; P406-A408 PolarHBondContact O-N 3.37Å; A408-E410 VanDerWaalsContact C-N 3.28Å; A408-E410 PolarHBondContact O-N 2.62Å; A408-A411 PolarHBondContact O-N 2.88Å; A408-L412 WeakPolarHBondContact O-CB 3.21Å; A408-L412 VanDerWaalsContact O-CG 3.26Å; A408-L412 WeakPolarHBondContact O-CG 3.46Å; A408-L412 PolarHBondContact O-N 3.27Å
409	D	93.8	Very high	91.9	Very high	23 Å²	23	39.2 Å²	39.2	12%	0.123	20%	0.196	C	C	.	.	H	α-helix	trans	-55.4	-43.8	170.6	160.5	69	0	0	0	111.1	F51 K54 I404 T405 P406 R413	F51-D409 HydrophobicContact CE1-CB 4.35Å; K54-D409 IonicContact NZ-OD2 2.74Å; K54-D409 PolarHBondContact NZ-OD2 3.34Å; I404-D409 HydrophobicContact CG2-CB 3.95Å; T405-D409 PolarHBondContact O-N 3.4Å; P406-D409 PolarHBondContact O-N 3.16Å; D409-R413 WeakPolarHBondContact O-CB 3.31Å; D409-R413 WeakPolarHBondContact O-CG 3.34Å; D409-R413 PolarHBondContact O-N 3.34Å; D409-R413 PolarHBondContact O-NE 2.96Å; D409-R413 WeakPolarHBondContact OD1-CD 3.32Å; D409-R413 IonicContact OD1-CZ 2.78Å; D409-R413 IonicContact OD1-NE 3.9Å; D409-R413 PolarHBondContact OD1-NE 3.42Å; D409-R413 IonicContact OD2-CZ 3.93Å; D409-R413 VanDerWaalsContact OD2-CZ 3.26Å; D409-R413 IonicContact OD2-NE 3.26Å; D409-R413 PolarHBondContact OD2-NE 3.37Å; D409-R413 IonicContact OD2-NH2 3.29Å; D409-R413 PolarHBondContact OD2-NH2 3.22Å
410	E	92.7	Very high	92.1	Very high	90 Å²	90	39.3 Å²	39.3	42%	0.421	20%	0.197	S	C	.	.	H	α-helix	trans	-63.7	-48.4	177.6	-50	-113.6	107.1	0	0	111.6	K54 P406 I407 A408 L412 R413 L414	K54-E410 IonicContact NZ-OE1 3.55Å; K54-E410 PolarHBondContact NZ-OE1 3.03Å; P406-E410 WeakPolarHBondContact O-CG 3.16Å; P406-E410 PolarHBondContact O-N 3.41Å; I407-E410 PolarHBondContact O-N 3.41Å; A408-E410 VanDerWaalsContact C-N 3.28Å; A408-E410 PolarHBondContact O-N 2.62Å; E410-L412 PolarHBondContact O-N 3.12Å; E410-R413 PolarHBondContact O-N 3.49Å; E410-R413 IonicContact OE1-CZ 2.69Å; E410-R413 IonicContact OE1-NH2 2.67Å; E410-R413 PolarHBondContact OE1-NH2 2.77Å; E410-L414 VanDerWaalsContact O-CG 3.32Å; E410-L414 WeakPolarHBondContact O-CG 3.49Å; E410-L414 PolarHBondContact O-N 3.46Å; E410-L414 VanDerWaalsContact O-N 3.07Å
411	A	93.6	Very high	92.5	Very high	37 Å²	37	42 Å²	42	31%	0.306	21%	0.214	S	C	.	.	H	α-helix	trans	-62.5	-40	179.7	0	0	0	0	0	113	A388 I407 A408 R415	A388-A411 HydrophobicContact CB-CB 4.28Å; I407-A411 PolarHBondContact O-N 2.88Å; I407-A411 VanDerWaalsContact O-N 3.14Å; A408-A411 PolarHBondContact O-N 2.88Å; A411-R415 WeakPolarHBondContact O-CG 2.8Å; A411-R415 PolarHBondContact O-N 3.38Å
412	L	94.1	Very high	92.8	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-71.6	-42.2	178.8	-73.3	168.4	0	0	0	112.3	I383 A388 I391 I396 I404 A408 E410 L414 R415 N416 V417 I419	I383-L412 HydrophobicContact CG2-CD1 3.81Å; A388-L412 HydrophobicContact CB-CG 4.41Å; I391-L412 HydrophobicContact CB-CD2 4.34Å; I391-L412 HydrophobicContact CD1-CD2 4.44Å; I391-L412 HydrophobicContact CG2-CD2 4.41Å; I396-L412 HydrophobicContact CD1-CD1 3.69Å; I396-L412 HydrophobicContact CD1-CD2 4.05Å; I396-L412 HydrophobicContact CD1-CG 4.49Å; I404-L412 HydrophobicContact CD1-CD1 4.3Å; I404-L412 HydrophobicContact CG2-CD1 4.2Å; A408-L412 WeakPolarHBondContact O-CB 3.21Å; A408-L412 VanDerWaalsContact O-CG 3.26Å; A408-L412 WeakPolarHBondContact O-CG 3.46Å; A408-L412 PolarHBondContact O-N 3.27Å; E410-L412 PolarHBondContact O-N 3.12Å; L412-L414 VanDerWaalsContact C-N 3.33Å; L412-L414 PolarHBondContact O-N 2.89Å; L412-R415 CarbonylContact O-C 3.56Å; L412-R415 WeakPolarHBondContact O-CA 3.31Å; L412-R415 PolarHBondContact O-N 3.36Å; L412-N416 PolarHBondContact O-N 2.81Å; L412-V417 HydrophobicContact CB-CB 4.27Å; L412-V417 HydrophobicContact CD2-CB 4.39Å; L412-V417 HydrophobicContact CD2-CG1 4.42Å; L412-V417 HydrophobicContact CD2-CG2 4.12Å; L412-V417 WeakPolarHBondContact O-CB 3.37Å; L412-V417 PolarHBondContact O-N 3.22Å; L412-I419 HydrophobicContact CB-CD1 3.95Å; L412-I419 HydrophobicContact CD1-CD1 4.14Å
413	R	92.4	Very high	93.1	Very high	102 Å²	102	43.3 Å²	43.3	39%	0.385	22%	0.221	S	C	.	.	H	α-helix	trans	-63.6	-37.2	175.7	-76.1	-173.3	-68.9	95.1	5.3	112.3	D409 E410 R415 N416 I419	D409-R413 WeakPolarHBondContact O-CB 3.31Å; D409-R413 WeakPolarHBondContact O-CG 3.34Å; D409-R413 PolarHBondContact O-N 3.34Å; D409-R413 PolarHBondContact O-NE 2.96Å; D409-R413 WeakPolarHBondContact OD1-CD 3.32Å; D409-R413 IonicContact OD1-CZ 2.78Å; D409-R413 IonicContact OD1-NE 3.9Å; D409-R413 PolarHBondContact OD1-NE 3.42Å; D409-R413 IonicContact OD2-CZ 3.93Å; D409-R413 VanDerWaalsContact OD2-CZ 3.26Å; D409-R413 IonicContact OD2-NE 3.26Å; D409-R413 PolarHBondContact OD2-NE 3.37Å; D409-R413 IonicContact OD2-NH2 3.29Å; D409-R413 PolarHBondContact OD2-NH2 3.22Å; E410-R413 PolarHBondContact O-N 3.49Å; E410-R413 IonicContact OE1-CZ 2.69Å; E410-R413 IonicContact OE1-NH2 2.67Å; E410-R413 PolarHBondContact OE1-NH2 2.77Å; R413-R415 PolarHBondContact O-N 2.86Å; R413-N416 PolarHBondContact O-N 3.37Å; R413-N416 VanDerWaalsContact O-N 3.09Å; R413-I419 HydrophobicContact CG-CD1 4.4Å
414	L	92.7	Very high	93.3	Very high	148 Å²	148	47.1 Å²	47.1	78%	0.775	24%	0.236	S	C	*	.	H	α-helix	trans	-62.2	-23.2	173.3	-73.9	170.4	0	0	0	113.2	E410 L412	E410-L414 VanDerWaalsContact O-CG 3.32Å; E410-L414 WeakPolarHBondContact O-CG 3.49Å; E410-L414 PolarHBondContact O-N 3.46Å; E410-L414 VanDerWaalsContact O-N 3.07Å; L412-L414 VanDerWaalsContact C-N 3.33Å; L412-L414 PolarHBondContact O-N 2.89Å
415	R	91.8	Very high	93.3	Very high	110 Å²	110	47.1 Å²	47.1	42%	0.415	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	10.8	176.5	-65.3	173.4	65.6	-144.7	-5.9	113.5	A388 Q389 I391 A411 L412 R413 V417	A388-R415 PolarHBondContact O-NH1 2.71Å; Q389-R415 PolarHBondContact O-NH1 2.94Å; I391-R415 VanDerWaalsContact O-CZ 3.26Å; I391-R415 PolarHBondContact O-NH1 3.45Å; I391-R415 PolarHBondContact O-NH2 2.91Å; A411-R415 WeakPolarHBondContact O-CG 2.8Å; A411-R415 PolarHBondContact O-N 3.38Å; L412-R415 CarbonylContact O-C 3.56Å; L412-R415 WeakPolarHBondContact O-CA 3.31Å; L412-R415 PolarHBondContact O-N 3.36Å; R413-R415 PolarHBondContact O-N 2.86Å; R415-V417 HydrophobicContact CB-CG2 4.21Å; R415-V417 PolarHBondContact O-N 3.44Å
416	N	92.1	Very high	93.2	Very high	120 Å²	120	46.4 Å²	46.4	64%	0.642	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.4	31.3	-175.7	-66.2	-36.3	0	0	0	114.5	L412 R413	L412-N416 PolarHBondContact O-N 2.81Å; R413-N416 PolarHBondContact O-N 3.37Å; R413-N416 VanDerWaalsContact O-N 3.09Å
417	V	94.5	Very high	93.1	Very high	12 Å²	12	46.2 Å²	46.2	7%	0.073	23%	0.23	C	C	.	.			trans	-78.7	130.3	172	-179.2	0	0	0	0	109.4	I396 L412 R415 I419	I396-V417 HydrophobicContact CD1-CG1 3.94Å; I396-V417 HydrophobicContact CG1-CG1 3.76Å; L412-V417 HydrophobicContact CB-CB 4.27Å; L412-V417 HydrophobicContact CD2-CB 4.39Å; L412-V417 HydrophobicContact CD2-CG1 4.42Å; L412-V417 HydrophobicContact CD2-CG2 4.12Å; L412-V417 WeakPolarHBondContact O-CB 3.37Å; L412-V417 PolarHBondContact O-N 3.22Å; R415-V417 HydrophobicContact CB-CG2 4.21Å; R415-V417 PolarHBondContact O-N 3.44Å; V417-I419 PolarHBondContact O-N 3.33Å
418	L	95.4	Very high	92.9	Very high	31 Å²	31	42.4 Å²	42.4	16%	0.162	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	112.9	175.5	174.8	64.2	0	0	0	110.3	F277 M284 I287 K394 V395 I396 L420	F277-L418 HydrophobicContact CB-CD2 4.45Å; M284-L418 HydrophobicContact CE-CD2 4.14Å; I287-L418 HydrophobicContact CD1-CB 3.52Å; I287-L418 HydrophobicContact CD1-CD2 3.62Å; I287-L418 HydrophobicContact CD1-CG 4.11Å; I287-L418 HydrophobicContact CG1-CB 4.18Å; K394-L418 PolarHBondContact O-N 3.48Å; V395-L418 CarbonylContact C-O 3.59Å; V395-L418 WeakPolarHBondContact CA-O 3.49Å; V395-L418 HydrophobicContact CG1-CB 4.49Å; V395-L418 HydrophobicContact CG1-CD2 4.28Å; V395-L418 HydrophobicContact CG1-CG 4.42Å; V395-L418 HydrophobicContact CG2-CB 4.35Å; V395-L418 HydrophobicContact CG2-CD2 4.41Å; I396-L418 PolarHBondContact N-O 3.24Å; L418-L420 HydrophobicContact CD1-CD2 4.1Å; L418-L420 HydrophobicContact CD2-CD2 3.96Å; L418-L420 HydrophobicContact CG-CD2 3.88Å
419	I	95.6	Very high	92.6	Very high	28 Å²	28	42.4 Å²	42.4	14%	0.144	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	123.7	173	-59.1	168.5	0	0	0	108.8	I396 E398 I404 L412 R413 V417	I396-I419 WeakPolarHBondContact O-CA 3.42Å; E398-I419 HydrophobicContact CG-CG2 4.22Å; I404-I419 HydrophobicContact CD1-CB 4.45Å; I404-I419 HydrophobicContact CD1-CD1 3.95Å; I404-I419 HydrophobicContact CD1-CG1 4.03Å; I404-I419 HydrophobicContact CD1-CG2 3.59Å; L412-I419 HydrophobicContact CB-CD1 3.95Å; L412-I419 HydrophobicContact CD1-CD1 4.14Å; R413-I419 HydrophobicContact CG-CD1 4.4Å; V417-I419 PolarHBondContact O-N 3.33Å
420	L	95.8	Very high	92.2	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.005	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	106	170.2	-53.1	-173.4	0	0	0	108.8	L274 F277 V395 I396 A397 E398 L418 T425	L274-L420 HydrophobicContact CD2-CD1 3.83Å; L274-L420 HydrophobicContact CG-CD1 4.16Å; F277-L420 HydrophobicContact CB-CD1 4.35Å; F277-L420 HydrophobicContact CB-CD2 4Å; F277-L420 HydrophobicContact CD1-CD2 4.25Å; F277-L420 HydrophobicContact CD2-CD1 3.85Å; F277-L420 HydrophobicContact CD2-CD2 3.35Å; F277-L420 HydrophobicContact CD2-CG 4.18Å; F277-L420 HydrophobicContact CE2-CD2 3.78Å; F277-L420 HydrophobicContact CG-CD1 4.44Å; F277-L420 HydrophobicContact CG-CD2 3.61Å; F277-L420 HydrophobicContact CZ-CD2 4.4Å; V395-L420 HydrophobicContact CG1-CG 4.45Å; I396-L420 PolarHBondContact O-N 3.38Å; A397-L420 HydrophobicContact CB-CD1 4.47Å; E398-L420 WeakPolarHBondContact CB-O 3.29Å; E398-L420 PolarHBondContact N-O 3.49Å; L418-L420 HydrophobicContact CD1-CD2 4.1Å; L418-L420 HydrophobicContact CD2-CD2 3.96Å; L418-L420 HydrophobicContact CG-CD2 3.88Å; L420-T425 HydrophobicContact CB-CG2 4.4Å; L420-T425 WeakPolarHBondContact CB-OG1 3.47Å; L420-T425 PolarHBondContact O-OG1 3.43Å
421	P	94.4	Very high	92.2	Very high	56 Å²	56	38.8 Å²	38.8	36%	0.364	20%	0.2	S	C	.	.			trans	-71.5	148.1	-163.3	29	-36.9	0	0	0	113.4	E398 V423 Y424 T425	E398-P421 VanDerWaalsContact OE2-CA 3.3Å; E398-P421 WeakPolarHBondContact OE2-CA 3.05Å; P421-V423 HydrophobicContact CB-CG2 4.2Å; P421-V423 HydrophobicContact CG-CG2 4.48Å; P421-V423 PolarHBondContact O-N 2.92Å; P421-V423 VanDerWaalsContact O-N 3.16Å; P421-Y424 PolarHBondContact O-N 3.4Å; P421-T425 PolarHBondContact O-N 2.74Å; P421-T425 PolarHBondContact O-OG1 3.33Å; P421-T425 VanDerWaalsContact O-OG1 3.05Å
422	D	91.9	Very high	92.1	Very high	12 Å²	12	38.3 Å²	38.3	6%	0.064	19%	0.193	C	C	.	.	H	α-helix	trans	-56.5	-37.2	-173	88.9	-63.3	0	0	0	113.6	K165 E398 A400 N401 Y424 N426	K165-D422 WeakPolarHBondContact CE-O 3.41Å; K165-D422 PolarHBondContact NZ-O 3.11Å; K165-D422 IonicContact NZ-OD2 3.7Å; K165-D422 PolarHBondContact NZ-OD2 3.39Å; E398-D422 HydrophobicContact CB-CB 3.84Å; E398-D422 PolarHBondContact OE2-N 2.87Å; A400-D422 WeakPolarHBondContact O-CB 3.5Å; N401-D422 VanDerWaalsContact CA-OD2 3.28Å; N401-D422 WeakPolarHBondContact CA-OD2 3.42Å; N401-D422 WeakPolarHBondContact CB-OD2 3.44Å; D422-Y424 PolarHBondContact O-N 3.07Å; D422-N426 PolarHBondContact O-N 3.07Å; D422-N426 PolarHBondContact O-ND2 2.57Å; D422-N426 PolarHBondContact O-OD1 3.28Å; D422-N426 VanDerWaalsContact O-OD1 3.1Å
423	V	91.1	Very high	91.9	Very high	21 Å²	21	38.3 Å²	38.3	13%	0.127	19%	0.193	C	C	.	.	H	α-helix	trans	-60.1	-22.5	178.3	-70.6	0	0	0	0	113.5	L161 I164 I168 P421	L161-V423 HydrophobicContact CD2-CG1 3.96Å; I164-V423 HydrophobicContact CB-CG1 4.29Å; I164-V423 HydrophobicContact CG2-CB 4.18Å; I164-V423 HydrophobicContact CG2-CG1 3.95Å; I164-V423 HydrophobicContact CG2-CG2 4.43Å; I168-V423 HydrophobicContact CD1-CB 3.83Å; I168-V423 HydrophobicContact CD1-CG2 3.49Å; I168-V423 VanDerWaalsContact CD1-CG2 3.49Å; P421-V423 HydrophobicContact CB-CG2 4.2Å; P421-V423 HydrophobicContact CG-CG2 4.48Å; P421-V423 PolarHBondContact O-N 2.92Å; P421-V423 VanDerWaalsContact O-N 3.16Å
424	Y	94.1	Very high	91.9	Very high	81 Å²	81	36 Å²	36	32%	0.318	18%	0.184	S	C	.	.	H	α-helix	trans	-105.3	-58.6	172.9	177.5	-100.3	0	0	0	111.7	I168 A273 F277 P421 D422 N426 A427	I168-Y424 HydrophobicContact CG2-CD2 3.8Å; I168-Y424 HydrophobicContact CG2-CG 4.48Å; A273-Y424 HydrophobicContact CB-CD1 4.03Å; A273-Y424 HydrophobicContact CB-CE1 3.57Å; F277-Y424 HydrophobicContact CD2-CE1 4.4Å; F277-Y424 AromaticContact CE2-CD1 3.97Å; F277-Y424 HydrophobicContact CE2-CD1 3.97Å; F277-Y424 AromaticContact CE2-CE1 3.59Å; F277-Y424 HydrophobicContact CE2-CE1 3.59Å; F277-Y424 HydrophobicContact CZ-CE1 4.42Å; P421-Y424 PolarHBondContact O-N 3.4Å; D422-Y424 PolarHBondContact O-N 3.07Å; Y424-N426 VanDerWaalsContact C-N 3.25Å; Y424-N426 PolarHBondContact O-N 3.27Å; Y424-N426 VanDerWaalsContact O-N 3.1Å; Y424-A427 WeakPolarHBondContact O-CB 3.44Å; Y424-A427 PolarHBondContact O-N 2.83Å
425	T	93.5	Very high	92	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.006	17%	0.168	C	C	.	.	H	α-helix	trans	-56.3	-37.8	-166	-55.6	0	0	0	0	113.1	G269 V270 A273 A397 L420 P421	G269-T425 CarbonylContact C-O 3.57Å; V270-T425 WeakPolarHBondContact CA-O 3.22Å; V270-T425 HydrophobicContact CB-CG2 4.29Å; V270-T425 HydrophobicContact CG1-CG2 3.9Å; V270-T425 HydrophobicContact CG2-CG2 4.19Å; V270-T425 PolarHBondContact N-O 2.76Å; A273-T425 HydrophobicContact CB-CG2 4.23Å; A397-T425 HydrophobicContact CB-CG2 4.12Å; L420-T425 HydrophobicContact CB-CG2 4.4Å; L420-T425 WeakPolarHBondContact CB-OG1 3.47Å; L420-T425 PolarHBondContact O-OG1 3.43Å; P421-T425 PolarHBondContact O-N 2.74Å; P421-T425 PolarHBondContact O-OG1 3.33Å; P421-T425 VanDerWaalsContact O-OG1 3.05Å
426	N	90.1	Very high	92	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.2	9.5	-176.2	78.6	45	0	0	0	113.6	K128 K165 T266 A399 A400 N401 D422 Y424 G428	K128-N426 WeakPolarHBondContact CE-O 3.4Å; K128-N426 VanDerWaalsContact NZ-CB 3.3Å; K128-N426 PolarHBondContact NZ-O 3.11Å; K128-N426 PolarHBondContact NZ-OD1 2.89Å; K165-N426 VanDerWaalsContact CE-OD1 3.22Å; K165-N426 WeakPolarHBondContact CE-OD1 3.4Å; K165-N426 PolarHBondContact NZ-OD1 2.87Å; T266-N426 HydrophobicContact CG2-CB 4.3Å; A399-N426 WeakPolarHBondContact O-CB 3.35Å; A399-N426 PolarHBondContact O-ND2 3.07Å; A400-N426 VanDerWaalsContact C-ND2 3.35Å; A400-N426 PolarHBondContact O-ND2 3.1Å; N401-N426 PolarHBondContact OD1-ND2 2.84Å; N401-N426 PolarHBondContact OD1-OD1 2.87Å; D422-N426 PolarHBondContact O-N 3.07Å; D422-N426 PolarHBondContact O-ND2 2.57Å; D422-N426 PolarHBondContact O-OD1 3.28Å; D422-N426 VanDerWaalsContact O-OD1 3.1Å; Y424-N426 VanDerWaalsContact C-N 3.25Å; Y424-N426 PolarHBondContact O-N 3.27Å; Y424-N426 VanDerWaalsContact O-N 3.1Å; N426-G428 VanDerWaalsContact C-N 3.33Å; N426-G428 PolarHBondContact O-N 2.92Å
427	A	90.3	Very high	92.1	Very high	1 Å²	1	24.4 Å²	24.4	1%	0.008	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-22.5	-175.2	0	0	0	0	0	114.4	K165 V169 Y424 G429 V430 T431	K165-A427 HydrophobicContact CG-CB 3.98Å; V169-A427 HydrophobicContact CB-CB 4.48Å; V169-A427 HydrophobicContact CG1-CB 3.63Å; V169-A427 HydrophobicContact CG2-CB 4.01Å; Y424-A427 WeakPolarHBondContact O-CB 3.44Å; Y424-A427 PolarHBondContact O-N 2.83Å; A427-G429 CarbonylContact O-C 3.6Å; A427-G429 PolarHBondContact O-N 3.19Å; A427-V430 HydrophobicContact CB-CG1 4.36Å; A427-V430 WeakPolarHBondContact O-CG1 3.03Å; A427-V430 PolarHBondContact O-N 2.95Å; A427-T431 PolarHBondContact O-N 2.76Å; A427-T431 VanDerWaalsContact O-N 3.13Å; A427-T431 PolarHBondContact O-OG1 3.05Å
428	G	88.8	Confident	92.1	Very high	16 Å²	16	27 Å²	27	17%	0.165	14%	0.137	C	C	.	.	H	α-helix	trans	-52.8	-25.8	179.3	0	0	0	0	0	114.7	A265 N426 V432	A265-G428 CarbonylContact O-C 3.6Å; N426-G428 VanDerWaalsContact C-N 3.33Å; N426-G428 PolarHBondContact O-N 2.92Å; G428-V432 PolarHBondContact O-N 3.44Å; G428-V432 VanDerWaalsContact O-N 3.13Å
429	G	85.6	Confident	92	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-62.3	-48.5	169.3	0	0	0	0	0	113.6	R262 A427 T431 S433	R262-G429 PolarHBondContact NE-O 3.44Å; R262-G429 VanDerWaalsContact NH2-C 3.34Å; R262-G429 PolarHBondContact NH2-O 3.28Å; A427-G429 CarbonylContact O-C 3.6Å; A427-G429 PolarHBondContact O-N 3.19Å; G429-T431 VanDerWaalsContact C-N 3.35Å; G429-S433 PolarHBondContact O-N 3.29Å; G429-S433 VanDerWaalsContact O-N 3.11Å; G429-S433 PolarHBondContact O-OG 3.18Å; G429-S433 VanDerWaalsContact O-OG 3.12Å
430	V	86.8	Confident	91.9	Very high	2 Å²	2	27.9 Å²	27.9	1%	0.012	14%	0.14	C	C	.	.	H	α-helix	trans	-70.1	-33.7	177.3	60.4	0	0	0	0	111.3	K125 M162 K165 I171 A427 V432 S433 Y434	K125-V430 HydrophobicContact CG-CG2 4.21Å; M162-V430 HydrophobicContact CE-CB 4.14Å; M162-V430 HydrophobicContact CE-CG2 3.8Å; K165-V430 HydrophobicContact CG-CG1 4.03Å; I171-V430 HydrophobicContact CD1-CB 4.32Å; I171-V430 HydrophobicContact CD1-CG1 3.79Å; I171-V430 HydrophobicContact CD1-CG2 4.04Å; A427-V430 HydrophobicContact CB-CG1 4.36Å; A427-V430 WeakPolarHBondContact O-CG1 3.03Å; A427-V430 PolarHBondContact O-N 2.95Å; V430-V432 PolarHBondContact O-N 3.3Å; V430-S433 CarbonylContact O-C 3.56Å; V430-S433 WeakPolarHBondContact O-CA 3.48Å; V430-S433 WeakPolarHBondContact O-CB 3.42Å; V430-S433 PolarHBondContact O-N 3.02Å; V430-S433 VanDerWaalsContact O-N 3.12Å; V430-Y434 PolarHBondContact O-N 2.93Å
431	T	92.2	Very high	91.7	Very high	36 Å²	36	30.6 Å²	30.6	22%	0.221	15%	0.153	C	C	.	.	H	α-helix	trans	-56.8	-48.2	174.3	-42.5	0	0	0	0	112.3	I171 A427 G429 S433 Y434 F435	I171-T431 VanDerWaalsContact CD1-CA 3.46Å; I171-T431 HydrophobicContact CD1-CG2 4.5Å; A427-T431 PolarHBondContact O-N 2.76Å; A427-T431 VanDerWaalsContact O-N 3.13Å; A427-T431 PolarHBondContact O-OG1 3.05Å; G429-T431 VanDerWaalsContact C-N 3.35Å; T431-S433 VanDerWaalsContact C-N 3.35Å; T431-Y434 WeakPolarHBondContact O-CB 3.32Å; T431-Y434 PolarHBondContact O-N 3.14Å; T431-F435 HydrophobicContact CG2-CE1 4.22Å; T431-F435 HydrophobicContact CG2-CE2 3.94Å; T431-F435 HydrophobicContact CG2-CZ 3.66Å; T431-F435 WeakPolarHBondContact O-CG 3.49Å; T431-F435 PolarHBondContact O-N 3.05Å
432	V	91.4	Very high	91.6	Very high	27 Å²	27	30.8 Å²	30.8	16%	0.164	16%	0.156	C	C	.	.	H	α-helix	trans	-76.1	-23.7	177.7	-177.7	0	0	0	0	112.2	I259 R262 A265 G428 V430 Y434 F435 E436	I259-V432 HydrophobicContact CG2-CG1 3.58Å; R262-V432 HydrophobicContact CB-CG1 4.04Å; R262-V432 HydrophobicContact CG-CG1 4.49Å; A265-V432 HydrophobicContact CB-CB 3.64Å; A265-V432 HydrophobicContact CB-CG1 4.19Å; A265-V432 HydrophobicContact CB-CG2 3.44Å; A265-V432 VanDerWaalsContact CB-CG2 3.44Å; G428-V432 PolarHBondContact O-N 3.44Å; G428-V432 VanDerWaalsContact O-N 3.13Å; V430-V432 PolarHBondContact O-N 3.3Å; V432-Y434 VanDerWaalsContact C-N 3.35Å; V432-F435 HydrophobicContact CG2-CD2 4.14Å; V432-F435 HydrophobicContact CG2-CE2 4.47Å; V432-F435 PolarHBondContact O-N 2.92Å; V432-E436 PolarHBondContact O-N 3Å
433	S	89.7	Confident	91.5	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-65.7	-36	166	-60.9	0	0	0	0	112.3	T250 R262 G429 V430 T431 E436 W437	T250-S433 WeakPolarHBondContact CG2-O 3.47Å; R262-S433 PolarHBondContact NE-OG 3.35Å; R262-S433 PolarHBondContact NH2-OG 3.39Å; G429-S433 PolarHBondContact O-N 3.29Å; G429-S433 VanDerWaalsContact O-N 3.11Å; G429-S433 PolarHBondContact O-OG 3.18Å; G429-S433 VanDerWaalsContact O-OG 3.12Å; V430-S433 CarbonylContact O-C 3.56Å; V430-S433 WeakPolarHBondContact O-CA 3.48Å; V430-S433 WeakPolarHBondContact O-CB 3.42Å; V430-S433 PolarHBondContact O-N 3.02Å; V430-S433 VanDerWaalsContact O-N 3.12Å; T431-S433 VanDerWaalsContact C-N 3.35Å; S433-E436 PolarHBondContact O-N 2.79Å; S433-W437 PolarHBondContact O-N 2.9Å
434	Y	92.7	Very high	91.4	Very high	52 Å²	52	37.9 Å²	37.9	20%	0.204	19%	0.188	C	C	.	.	H	α-helix	trans	-66	-43	173.6	172	-127.1	0	0	0	111.1	I171 P172 F173 V430 T431 V432 E436 W437 L438	I171-Y434 HydrophobicContact CG1-CD1 4.32Å; I171-Y434 HydrophobicContact CG2-CD1 4.44Å; I171-Y434 HydrophobicContact CG2-CD2 4.32Å; I171-Y434 HydrophobicContact CG2-CG 4.01Å; P172-Y434 HydrophobicContact CG-CE2 3.78Å; F173-Y434 HydrophobicContact CE1-CD2 4.24Å; F173-Y434 AromaticContact CE2-CD2 3.81Å; F173-Y434 HydrophobicContact CE2-CD2 3.81Å; F173-Y434 HydrophobicContact CE2-CG 4.2Å; F173-Y434 AromaticContact CZ-CD2 3.55Å; F173-Y434 HydrophobicContact CZ-CD2 3.55Å; F173-Y434 HydrophobicContact CZ-CE2 4.39Å; F173-Y434 HydrophobicContact CZ-CG 4.37Å; V430-Y434 PolarHBondContact O-N 2.93Å; T431-Y434 WeakPolarHBondContact O-CB 3.32Å; T431-Y434 PolarHBondContact O-N 3.14Å; V432-Y434 VanDerWaalsContact C-N 3.35Å; Y434-E436 VanDerWaalsContact C-N 3.32Å; Y434-E436 PolarHBondContact O-N 3.41Å; Y434-W437 HydrophobicContact CD2-CE3 4.11Å; Y434-W437 HydrophobicContact CE2-CE3 4.07Å; Y434-W437 HydrophobicContact CE2-CZ3 4.23Å; Y434-W437 WeakPolarHBondContact O-CB 3.46Å; Y434-W437 PolarHBondContact O-N 3.32Å; Y434-W437 VanDerWaalsContact O-N 3.14Å; Y434-L438 HydrophobicContact CD1-CD1 4.26Å; Y434-L438 HydrophobicContact CD2-CD1 4.41Å; Y434-L438 HydrophobicContact CD2-CG 4.1Å; Y434-L438 HydrophobicContact CE1-CD1 3.77Å; Y434-L438 HydrophobicContact CE1-CG 4.45Å; Y434-L438 HydrophobicContact CE2-CD1 3.93Å; Y434-L438 HydrophobicContact CE2-CD2 3.85Å; Y434-L438 HydrophobicContact CE2-CG 3.72Å; Y434-L438 WeakPolarHBondContact O-CG 3.21Å; Y434-L438 PolarHBondContact O-N 2.91Å
435	F	93.7	Very high	91	Very high	101 Å²	101	37 Å²	37	44%	0.443	19%	0.194	S	C	.	.	H	α-helix	trans	-62.9	-36.1	173.2	-57.8	-23.4	0	0	0	112.9	I259 T431 V432 K439	I259-F435 HydrophobicContact CD1-CB 3.66Å; T431-F435 HydrophobicContact CG2-CE1 4.22Å; T431-F435 HydrophobicContact CG2-CE2 3.94Å; T431-F435 HydrophobicContact CG2-CZ 3.66Å; T431-F435 WeakPolarHBondContact O-CG 3.49Å; T431-F435 PolarHBondContact O-N 3.05Å; V432-F435 HydrophobicContact CG2-CD2 4.14Å; V432-F435 HydrophobicContact CG2-CE2 4.47Å; V432-F435 PolarHBondContact O-N 2.92Å; F435-K439 WeakPolarHBondContact O-CB 3.4Å; F435-K439 PolarHBondContact O-N 3.46Å
436	E	93.5	Very high	90.7	Very high	1 Å²	1	47.4 Å²	47.4	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-62.7	-46.1	170.8	-167.5	-176.8	140.6	0	0	111.4	T250 G251 K252 I259 V432 S433 Y434 K439 N440	T250-E436 VanDerWaalsContact CA-OE1 3.23Å; T250-E436 WeakPolarHBondContact CA-OE1 3.45Å; T250-E436 HydrophobicContact CG2-CB 4.24Å; T250-E436 HydrophobicContact CG2-CG 4.44Å; G251-E436 WeakPolarHBondContact CA-OE2 3.43Å; G251-E436 PolarHBondContact N-OE1 3.42Å; G251-E436 PolarHBondContact N-OE2 3.19Å; K252-E436 PolarHBondContact N-OE1 3.45Å; K252-E436 VanDerWaalsContact N-OE1 3.14Å; K252-E436 IonicContact NZ-OE1 2.95Å; K252-E436 PolarHBondContact NZ-OE1 3.31Å; I259-E436 HydrophobicContact CB-CB 4Å; I259-E436 HydrophobicContact CB-CG 4.11Å; I259-E436 HydrophobicContact CG2-CB 3.66Å; I259-E436 HydrophobicContact CG2-CG 4.11Å; V432-E436 PolarHBondContact O-N 3Å; S433-E436 PolarHBondContact O-N 2.79Å; Y434-E436 VanDerWaalsContact C-N 3.32Å; Y434-E436 PolarHBondContact O-N 3.41Å; E436-K439 WeakPolarHBondContact O-CB 3.43Å; E436-K439 PolarHBondContact O-N 3.47Å; E436-N440 PolarHBondContact O-N 3.26Å; E436-N440 VanDerWaalsContact O-N 3.08Å; E436-N440 PolarHBondContact O-ND2 2.63Å
437	W	93.8	Very high	90.6	Very high	34 Å²	34	48.4 Å²	48.4	13%	0.129	25%	0.25	C	C	.	.	H	α-helix	trans	-59.3	-50.7	177.4	-176.5	80.3	0	0	0	111.1	P123 F173 P211 A247 T250 S433 Y434 K439 N440 M441	P123-W437 HydrophobicContact CG-CZ2 4.01Å; F173-W437 HydrophobicContact CE1-CD2 4.05Å; F173-W437 HydrophobicContact CE1-CE3 4.02Å; F173-W437 HydrophobicContact CE1-CZ3 4.31Å; F173-W437 HydrophobicContact CZ-CB 4.18Å; F173-W437 AromaticContact CZ-CD2 3.95Å; F173-W437 HydrophobicContact CZ-CD2 3.95Å; F173-W437 AromaticContact CZ-CE3 3.97Å; F173-W437 HydrophobicContact CZ-CE3 3.97Å; F173-W437 HydrophobicContact CZ-CG 4.06Å; P211-W437 PolarHBondContact O-NE1 3.39Å; P211-W437 VanDerWaalsContact O-NE1 3.14Å; A247-W437 VanDerWaalsContact O-CD1 3.28Å; T250-W437 HydrophobicContact CG2-CB 4.07Å; S433-W437 PolarHBondContact O-N 2.9Å; Y434-W437 HydrophobicContact CD2-CE3 4.11Å; Y434-W437 HydrophobicContact CE2-CE3 4.07Å; Y434-W437 HydrophobicContact CE2-CZ3 4.23Å; Y434-W437 WeakPolarHBondContact O-CB 3.46Å; Y434-W437 PolarHBondContact O-N 3.32Å; Y434-W437 VanDerWaalsContact O-N 3.14Å; W437-K439 VanDerWaalsContact C-N 3.32Å; W437-K439 PolarHBondContact O-N 3.49Å; W437-N440 PolarHBondContact O-N 2.97Å; W437-M441 HydrophobicContact CD2-CG 3.91Å; W437-M441 HydrophobicContact CE3-CG 4.1Å; W437-M441 HydrophobicContact CH2-CG 4.12Å; W437-M441 HydrophobicContact CZ2-CE 4.26Å; W437-M441 HydrophobicContact CZ2-CG 3.92Å; W437-M441 HydrophobicContact CZ2-SD 3.88Å; W437-M441 HydrophobicContact CZ3-CG 4.21Å; W437-M441 WeakPolarHBondContact O-CG 3.3Å; W437-M441 PolarHBondContact O-N 2.71Å
438	L	93.7	Very high	90.5	Very high	66 Å²	66	57.9 Å²	57.9	35%	0.346	29%	0.286	S	S	.	.	H	α-helix	trans	-55.7	-41.8	174.6	-71.6	179.5	0	0	0	113.1	Y434 N440 M441 S442	Y434-L438 HydrophobicContact CD1-CD1 4.26Å; Y434-L438 HydrophobicContact CD2-CD1 4.41Å; Y434-L438 HydrophobicContact CD2-CG 4.1Å; Y434-L438 HydrophobicContact CE1-CD1 3.77Å; Y434-L438 HydrophobicContact CE1-CG 4.45Å; Y434-L438 HydrophobicContact CE2-CD1 3.93Å; Y434-L438 HydrophobicContact CE2-CD2 3.85Å; Y434-L438 HydrophobicContact CE2-CG 3.72Å; Y434-L438 WeakPolarHBondContact O-CG 3.21Å; Y434-L438 PolarHBondContact O-N 2.91Å; L438-N440 VanDerWaalsContact C-N 3.3Å; L438-N440 PolarHBondContact O-N 3.34Å; L438-M441 PolarHBondContact O-N 3.34Å; L438-S442 WeakPolarHBondContact O-CB 3.43Å; L438-S442 PolarHBondContact O-N 2.86Å; L438-S442 PolarHBondContact O-OG 3.21Å
439	K	93.4	Very high	90.4	Very high	62 Å²	62	64 Å²	64	27%	0.27	31%	0.312	S	S	.	.	H	α-helix	trans	-59.2	-40.7	174.9	177.4	-169.1	166.6	-173.9	0	111.8	G258 F435 E436 W437 S442 H443	G258-K439 PolarHBondContact O-NZ 2.96Å; F435-K439 WeakPolarHBondContact O-CB 3.4Å; F435-K439 PolarHBondContact O-N 3.46Å; E436-K439 WeakPolarHBondContact O-CB 3.43Å; E436-K439 PolarHBondContact O-N 3.47Å; W437-K439 VanDerWaalsContact C-N 3.32Å; W437-K439 PolarHBondContact O-N 3.49Å; K439-S442 PolarHBondContact O-OG 3.02Å; K439-S442 VanDerWaalsContact O-OG 3.12Å; K439-H443 PolarHBondContact O-N 3.01Å
440	N	93.2	Very high	90.5	Very high	16 Å²	16	67.2 Å²	67.2	9%	0.086	33%	0.331	C	S	.	.	H	α-helix	trans	-73.4	-36.3	178.4	-71.6	-90.4	0	0	0	111.2	A247 K252 G257 E436 W437 L438 S442 H443	A247-N440 HydrophobicContact CB-CB 3.71Å; K252-N440 WeakPolarHBondContact CE-OD1 3.15Å; K252-N440 PolarHBondContact NZ-ND2 3.12Å; K252-N440 VanDerWaalsContact NZ-ND2 3.1Å; G257-N440 PolarHBondContact O-ND2 2.68Å; E436-N440 PolarHBondContact O-N 3.26Å; E436-N440 VanDerWaalsContact O-N 3.08Å; E436-N440 PolarHBondContact O-ND2 2.63Å; W437-N440 PolarHBondContact O-N 2.97Å; L438-N440 VanDerWaalsContact C-N 3.3Å; L438-N440 PolarHBondContact O-N 3.34Å; N440-S442 VanDerWaalsContact C-N 3.34Å; N440-H443 PolarHBondContact O-CE1 2.58Å; N440-H443 VanDerWaalsContact O-CE1 3.24Å; N440-H443 PolarHBondContact O-NE2 3.27Å
441	M	92.1	Very high	90.5	Very high	57 Å²	57	70.6 Å²	70.6	28%	0.281	35%	0.352	S	S	.	.	H	α-helix	trans	-67.7	-30.5	174.1	-62.3	-60.5	-64.9	0	0	113.3	D244 A247 W437 L438 H443	D244-M441 HydrophobicContact CB-CE 4.18Å; D244-M441 HydrophobicContact CB-SD 3.74Å; D244-M441 WeakPolarHBondContact OD2-CE 3.2Å; A247-M441 HydrophobicContact CB-CG 4.38Å; A247-M441 HydrophobicContact CB-SD 3.76Å; W437-M441 HydrophobicContact CD2-CG 3.91Å; W437-M441 HydrophobicContact CE3-CG 4.1Å; W437-M441 HydrophobicContact CH2-CG 4.12Å; W437-M441 HydrophobicContact CZ2-CE 4.26Å; W437-M441 HydrophobicContact CZ2-CG 3.92Å; W437-M441 HydrophobicContact CZ2-SD 3.88Å; W437-M441 HydrophobicContact CZ3-CG 4.21Å; W437-M441 WeakPolarHBondContact O-CG 3.3Å; W437-M441 PolarHBondContact O-N 2.71Å; L438-M441 PolarHBondContact O-N 3.34Å; M441-H443 PolarHBondContact O-CD2 3.03Å
442	S	91.7	Very high	90.2	Very high	61 Å²	61	76.5 Å²	76.5	43%	0.427	37%	0.374	S	S	.	.	H	α-helix	trans	-85.2	-15.1	-178	73	0	0	0	0	114.3	L438 K439 N440 I444	L438-S442 WeakPolarHBondContact O-CB 3.43Å; L438-S442 PolarHBondContact O-N 2.86Å; L438-S442 PolarHBondContact O-OG 3.21Å; K439-S442 PolarHBondContact O-OG 3.02Å; K439-S442 VanDerWaalsContact O-OG 3.12Å; N440-S442 VanDerWaalsContact C-N 3.34Å; S442-I444 WeakPolarHBondContact O-CG1 3.34Å; S442-I444 PolarHBondContact O-N 3.23Å; S442-I444 PolarHBondContact OG-O 3.33Å
443	H	90	Very high	89.8	Confident	115 Å²	115	81.3 Å²	81.3	53%	0.532	40%	0.395	S	S	.	.			trans	55.8	11.9	-177	-62.8	-76.5	0	0	0	115.7	K243 D244 K439 N440 M441	K243-H443 PolarHBondContact O-CE1 3.11Å; K243-H443 PolarHBondContact O-NE2 3.13Å; D244-H443 IonicContact OD1-CD2 3.77Å; D244-H443 IonicContact OD1-CE1 2.86Å; D244-H443 IonicContact OD1-NE2 2.84Å; D244-H443 PolarHBondContact OD1-NE2 3.25Å; K439-H443 PolarHBondContact O-N 3.01Å; N440-H443 PolarHBondContact O-CE1 2.58Å; N440-H443 VanDerWaalsContact O-CE1 3.24Å; N440-H443 PolarHBondContact O-NE2 3.27Å; M441-H443 PolarHBondContact O-CD2 3.03Å
444	I	88.8	Confident	89.5	Confident	67 Å²	67	85.8 Å²	85.8	34%	0.344	42%	0.419	S	S	.	.	S	Bend	trans	-132.2	132.5	-172.7	-62.7	171.1	0	0	0	110.3	S442 F446 R448 M449	S442-I444 WeakPolarHBondContact O-CG1 3.34Å; S442-I444 PolarHBondContact O-N 3.23Å; S442-I444 PolarHBondContact OG-O 3.33Å; I444-F446 PolarHBondContact O-N 2.8Å; I444-R448 HydrophobicContact CG2-CB 4.35Å; I444-M449 HydrophobicContact CD1-CE 3.71Å; I444-M449 HydrophobicContact CD1-SD 3.82Å; I444-M449 HydrophobicContact CG2-CG 4.34Å
445	S	87.1	Confident	89	Confident	63 Å²	63	89.3 Å²	89.3	44%	0.441	44%	0.435	S	S	.	.			trans	-63.5	124.4	168.9	-64.3	0	0	0	0	110.3	G447 R448	S445-G447 PolarHBondContact O-N 2.74Å; S445-R448 WeakPolarHBondContact O-CB 3.17Å; S445-R448 PolarHBondContact O-N 3.24Å
446	F	86.8	Confident	88.4	Confident	218 Å²	218	87.4 Å²	87.4	96%	0.956	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	135.4	-179	-166.4	-93.6	0	0	0	111.9	I444 R448	I444-F446 PolarHBondContact O-N 2.8Å; F446-R448 VanDerWaalsContact C-N 3.28Å; F446-R448 PolarHBondContact O-N 2.95Å
447	G	87.5	Confident	87.7	Confident	21 Å²	21	90.3 Å²	90.3	22%	0.216	45%	0.448	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.3	-20.9	-174.5	0	0	0	0	0	115.9	S445 M449 T450 T451	S445-G447 PolarHBondContact O-N 2.74Å; G447-M449 VanDerWaalsContact C-N 3.26Å; G447-M449 PolarHBondContact O-N 2.94Å; G447-T450 PolarHBondContact O-N 3.45Å; G447-T450 PolarHBondContact O-OG1 2.9Å; G447-T451 PolarHBondContact O-N 3.34Å; G447-T451 PolarHBondContact O-OG1 2.94Å
448	R	87.2	Confident	87.1	Confident	201 Å²	201	95.6 Å²	95.6	76%	0.758	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-35.6	-170.6	-175.8	174.9	-178.7	165.1	2.2	114.9	I444 S445 F446	I444-R448 HydrophobicContact CG2-CB 4.35Å; S445-R448 WeakPolarHBondContact O-CB 3.17Å; S445-R448 PolarHBondContact O-N 3.24Å; F446-R448 VanDerWaalsContact C-N 3.28Å; F446-R448 PolarHBondContact O-N 2.95Å
449	M	87.5	Confident	86.2	Confident	145 Å²	145	99.2 Å²	99.2	71%	0.714	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-25.4	178	-62.8	-169.2	-64.9	0	0	113.5	I444 G447	I444-M449 HydrophobicContact CD1-CE 3.71Å; I444-M449 HydrophobicContact CD1-SD 3.82Å; I444-M449 HydrophobicContact CG2-CG 4.34Å; G447-M449 VanDerWaalsContact C-N 3.26Å; G447-M449 PolarHBondContact O-N 2.94Å
450	T	88.7	Confident	85.6	Confident	67 Å²	67	102 Å²	102	41%	0.411	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105	-18.6	-169.5	54.3	0	0	0	0	113.9	G447 K452 H453 N454	G447-T450 PolarHBondContact O-N 3.45Å; G447-T450 PolarHBondContact O-OG1 2.9Å; T450-K452 VanDerWaalsContact C-N 3.35Å; T450-K452 PolarHBondContact O-N 3.39Å; T450-H453 PolarHBondContact O-N 2.98Å; T450-H453 VanDerWaalsContact O-N 3.08Å; T450-N454 WeakPolarHBondContact O-CB 3.39Å; T450-N454 VanDerWaalsContact O-CG 3.27Å; T450-N454 PolarHBondContact O-N 3.23Å; T450-N454 PolarHBondContact O-OD1 2.88Å
451	T	86.1	Confident	84.9	Confident	73 Å²	73	106.4 Å²	106.4	45%	0.448	52%	0.522	S	S	.	.	H	α-helix	trans	-50.6	-50.1	-176.3	-60.8	0	0	0	0	112.6	G447 N454 F455	G447-T451 PolarHBondContact O-N 3.34Å; G447-T451 PolarHBondContact O-OG1 2.94Å; T451-N454 PolarHBondContact O-N 3.5Å; T451-F455 HydrophobicContact CG2-CD2 3.95Å; T451-F455 HydrophobicContact CG2-CE2 3.74Å; T451-F455 WeakPolarHBondContact O-CD2 3.39Å; T451-F455 PolarHBondContact O-N 2.92Å
452	K	85.1	Confident	84.3	Confident	159 Å²	159	105.9 Å²	105.9	69%	0.691	53%	0.527	S	S	*	.	H	α-helix	trans	-63.3	-46.9	178.7	-177.9	178.1	173.9	-177.4	0	112	T450 N454 F455 D456	T450-K452 VanDerWaalsContact C-N 3.35Å; T450-K452 PolarHBondContact O-N 3.39Å; K452-N454 VanDerWaalsContact C-N 3.26Å; K452-N454 PolarHBondContact O-N 3.02Å; K452-F455 CarbonylContact O-C 3.59Å; K452-F455 WeakPolarHBondContact O-CA 3.33Å; K452-F455 WeakPolarHBondContact O-CB 3.26Å; K452-F455 PolarHBondContact O-N 3.06Å; K452-D456 PolarHBondContact O-N 2.98Å
453	H	83.8	Confident	83.7	Confident	129 Å²	129	105.2 Å²	105.2	60%	0.597	53%	0.53	S	S	*	.	H	α-helix	trans	-61.4	-35.9	178.7	-174.4	60	0	0	0	112.2	T450 F455 D456 V457	T450-H453 PolarHBondContact O-N 2.98Å; T450-H453 VanDerWaalsContact O-N 3.08Å; H453-F455 VanDerWaalsContact C-N 3.32Å; H453-F455 PolarHBondContact O-N 2.88Å; H453-D456 WeakPolarHBondContact O-CA 3.22Å; H453-D456 WeakPolarHBondContact O-CB 3.24Å; H453-D456 PolarHBondContact O-N 3.06Å; H453-D456 VanDerWaalsContact O-N 3.09Å; H453-V457 PolarHBondContact O-N 3.07Å
454	N	83.5	Confident	83.2	Confident	94 Å²	94	105.1 Å²	105.1	50%	0.503	53%	0.532	S	S	.	.	H	α-helix	trans	-68.5	-28.6	172.8	-66.9	-1.3	0	0	0	112.4	T450 T451 K452 V457	T450-N454 WeakPolarHBondContact O-CB 3.39Å; T450-N454 VanDerWaalsContact O-CG 3.27Å; T450-N454 PolarHBondContact O-N 3.23Å; T450-N454 PolarHBondContact O-OD1 2.88Å; T451-N454 PolarHBondContact O-N 3.5Å; K452-N454 VanDerWaalsContact C-N 3.26Å; K452-N454 PolarHBondContact O-N 3.02Å; N454-V457 WeakPolarHBondContact O-CB 3.28Å
455	F	81.6	Confident	82.5	Confident	125 Å²	125	106.9 Å²	106.9	55%	0.548	54%	0.541	S	S	.	.	H	α-helix	trans	-72.1	-33.9	166.5	-83.1	-76.4	0	0	0	111.8	T451 K452 H453 V457 Y458	T451-F455 HydrophobicContact CG2-CD2 3.95Å; T451-F455 HydrophobicContact CG2-CE2 3.74Å; T451-F455 WeakPolarHBondContact O-CD2 3.39Å; T451-F455 PolarHBondContact O-N 2.92Å; K452-F455 CarbonylContact O-C 3.59Å; K452-F455 WeakPolarHBondContact O-CA 3.33Å; K452-F455 WeakPolarHBondContact O-CB 3.26Å; K452-F455 PolarHBondContact O-N 3.06Å; H453-F455 VanDerWaalsContact C-N 3.32Å; H453-F455 PolarHBondContact O-N 2.88Å; F455-V457 PolarHBondContact O-N 3.48Å; F455-Y458 HydrophobicContact CB-CD2 4.4Å; F455-Y458 AromaticContact CD1-CD2 3.73Å; F455-Y458 HydrophobicContact CD1-CD2 3.73Å; F455-Y458 AromaticContact CD1-CE2 3.46Å; F455-Y458 HydrophobicContact CD1-CE2 3.46Å; F455-Y458 VanDerWaalsContact CD1-CE2 3.46Å; F455-Y458 AromaticContact CE1-CE2 3.85Å; F455-Y458 HydrophobicContact CE1-CE2 3.85Å; F455-Y458 HydrophobicContact CG-CD2 4.48Å; F455-Y458 HydrophobicContact CG-CE2 4.38Å; F455-Y458 VanDerWaalsContact O-CB 3.3Å; F455-Y458 WeakPolarHBondContact O-CB 3.42Å; F455-Y458 VanDerWaalsContact O-CD2 3.24Å; F455-Y458 WeakPolarHBondContact O-CD2 3.34Å; F455-Y458 PolarHBondContact O-N 2.96Å
456	D	80.6	Confident	81.4	Confident	61 Å²	61	108.4 Å²	108.4	33%	0.326	55%	0.548	S	S	.	.	H	α-helix	trans	-65.3	-19.8	174.6	-58.3	-40.6	0	0	0	111.8	K452 H453 Y458 Q459	K452-D456 PolarHBondContact O-N 2.98Å; H453-D456 WeakPolarHBondContact O-CA 3.22Å; H453-D456 WeakPolarHBondContact O-CB 3.24Å; H453-D456 PolarHBondContact O-N 3.06Å; H453-D456 VanDerWaalsContact O-N 3.09Å; D456-Y458 PolarHBondContact O-N 2.7Å; D456-Q459 WeakPolarHBondContact O-CB 3.37Å; D456-Q459 WeakPolarHBondContact O-CG 3.36Å; D456-Q459 PolarHBondContact O-N 2.73Å
457	V	80.2	Confident	80.2	Confident	62 Å²	62	100.8 Å²	100.8	38%	0.376	52%	0.52	S	S	.	.	H	α-helix	trans	-62.5	-20.2	168	179.7	0	0	0	0	112.7	H453 N454 F455 Q459 L460 M461	H453-V457 PolarHBondContact O-N 3.07Å; N454-V457 WeakPolarHBondContact O-CB 3.28Å; F455-V457 PolarHBondContact O-N 3.48Å; V457-Q459 PolarHBondContact O-N 3.05Å; V457-L460 HydrophobicContact CG1-CB 4.47Å; V457-L460 HydrophobicContact CG1-CD1 4.14Å; V457-L460 HydrophobicContact CG2-CD1 4.46Å; V457-L460 WeakPolarHBondContact O-CB 3.5Å; V457-L460 PolarHBondContact O-N 2.96Å; V457-M461 PolarHBondContact O-N 2.76Å
458	Y	80.4	Confident	78.7	Confident	146 Å²	146	109.2 Å²	109.2	57%	0.573	55%	0.545	S	S	*	.	H	α-helix	trans	-63.2	-22.3	167.7	-71	-69.9	0	0	0	112.4	F455 D456 M461 A462	F455-Y458 HydrophobicContact CB-CD2 4.4Å; F455-Y458 AromaticContact CD1-CD2 3.73Å; F455-Y458 HydrophobicContact CD1-CD2 3.73Å; F455-Y458 AromaticContact CD1-CE2 3.46Å; F455-Y458 HydrophobicContact CD1-CE2 3.46Å; F455-Y458 VanDerWaalsContact CD1-CE2 3.46Å; F455-Y458 AromaticContact CE1-CE2 3.85Å; F455-Y458 HydrophobicContact CE1-CE2 3.85Å; F455-Y458 HydrophobicContact CG-CD2 4.48Å; F455-Y458 HydrophobicContact CG-CE2 4.38Å; F455-Y458 VanDerWaalsContact O-CB 3.3Å; F455-Y458 WeakPolarHBondContact O-CB 3.42Å; F455-Y458 VanDerWaalsContact O-CD2 3.24Å; F455-Y458 WeakPolarHBondContact O-CD2 3.34Å; F455-Y458 PolarHBondContact O-N 2.96Å; D456-Y458 PolarHBondContact O-N 2.7Å; Y458-M461 HydrophobicContact CD1-SD 3.81Å; Y458-M461 HydrophobicContact CE1-SD 4.08Å; Y458-M461 PolarHBondContact O-N 2.99Å; Y458-A462 WeakPolarHBondContact O-CB 3.45Å; Y458-A462 PolarHBondContact O-N 3.38Å
459	Q	75.4	Confident	77.2	Confident	142 Å²	142	109 Å²	109	66%	0.664	55%	0.545	S	S	*	.	H	α-helix	trans	-68.9	-33.7	170.3	-56.5	-176.6	-0.2	0	0	111.8	D456 V457 A462 G463	D456-Q459 WeakPolarHBondContact O-CB 3.37Å; D456-Q459 WeakPolarHBondContact O-CG 3.36Å; D456-Q459 PolarHBondContact O-N 2.73Å; V457-Q459 PolarHBondContact O-N 3.05Å; Q459-A462 PolarHBondContact O-N 3.18Å; Q459-G463 PolarHBondContact O-N 2.85Å
460	L	79.8	Confident	75.8	Confident	121 Å²	121	106.8 Å²	106.8	63%	0.634	54%	0.539	S	S	*	.	H	α-helix	trans	-65.2	-40.5	170.8	-73.8	161.4	0	0	0	110.9	V457 G463 I464	V457-L460 HydrophobicContact CG1-CB 4.47Å; V457-L460 HydrophobicContact CG1-CD1 4.14Å; V457-L460 HydrophobicContact CG2-CD1 4.46Å; V457-L460 WeakPolarHBondContact O-CB 3.5Å; V457-L460 PolarHBondContact O-N 2.96Å; L460-G463 PolarHBondContact O-N 2.64Å; L460-I464 WeakPolarHBondContact O-CG1 3.33Å; L460-I464 PolarHBondContact O-N 3.01Å
461	M	79.9	Confident	74.3	Confident	107 Å²	107	111.6 Å²	111.6	53%	0.527	56%	0.559	S	S	.	*	H	α-helix	trans	-64.2	-43	173.9	-59.2	-171.6	101.6	0	0	111.8	V457 Y458 G463 I464 I465	V457-M461 PolarHBondContact O-N 2.76Å; Y458-M461 HydrophobicContact CD1-SD 3.81Å; Y458-M461 HydrophobicContact CE1-SD 4.08Å; Y458-M461 PolarHBondContact O-N 2.99Å; M461-G463 VanDerWaalsContact C-N 3.33Å; M461-G463 PolarHBondContact O-N 2.89Å; M461-I464 PolarHBondContact O-N 3.35Å; M461-I464 VanDerWaalsContact O-N 3.16Å; M461-I465 WeakPolarHBondContact O-CD1 3.2Å; M461-I465 WeakPolarHBondContact O-CG1 3.32Å; M461-I465 PolarHBondContact O-N 2.81Å; M461-I465 VanDerWaalsContact O-N 3.07Å
462	A	79.2	Confident	72.9	Confident	46 Å²	46	112.8 Å²	112.8	38%	0.38	57%	0.57	S	S	.	*	H	α-helix	trans	-61.4	-40.9	174.5	0	0	0	0	0	111.9	Y458 Q459 I464 I465 V466	Y458-A462 WeakPolarHBondContact O-CB 3.45Å; Y458-A462 PolarHBondContact O-N 3.38Å; Q459-A462 PolarHBondContact O-N 3.18Å; A462-I464 PolarHBondContact O-N 3.44Å; A462-I465 PolarHBondContact O-N 3.11Å; A462-I465 VanDerWaalsContact O-N 3.13Å; A462-V466 WeakPolarHBondContact O-CG2 3.22Å; A462-V466 PolarHBondContact O-N 2.55Å
463	G	78.2	Confident	71	Confident	48 Å²	48	112.1 Å²	112.1	50%	0.495	59%	0.586	S	S	.	*	H	α-helix	trans	-63.7	-21.3	175.1	0	0	0	0	0	114.6	Q459 L460 M461 P467	Q459-G463 PolarHBondContact O-N 2.85Å; L460-G463 PolarHBondContact O-N 2.64Å; M461-G463 VanDerWaalsContact C-N 3.33Å; M461-G463 PolarHBondContact O-N 2.89Å; G463-P467 WeakPolarHBondContact O-CD 3.28Å; G463-P467 VanDerWaalsContact O-CG 3.25Å; G463-P467 WeakPolarHBondContact O-CG 3.48Å
464	I	79.6	Confident	70.3	Confident	113 Å²	113	111.3 Å²	111.3	58%	0.579	59%	0.586	S	S	*	*	H	α-helix	trans	-84.9	-38.3	171.1	-65.4	164.6	0	0	0	110.9	L460 M461 A462 W468	L460-I464 WeakPolarHBondContact O-CG1 3.33Å; L460-I464 PolarHBondContact O-N 3.01Å; M461-I464 PolarHBondContact O-N 3.35Å; M461-I464 VanDerWaalsContact O-N 3.16Å; A462-I464 PolarHBondContact O-N 3.44Å; I464-W468 VanDerWaalsContact O-CD1 3.31Å
465	I	73.7	Confident	69.6	Low	103 Å²	103	112.2 Å²	112.2	53%	0.528	59%	0.59	S	S	.	*	H	α-helix	trans	-76.2	-36.2	-175.4	-67.1	162.1	0	0	0	112.6	M461 A462 W468	M461-I465 WeakPolarHBondContact O-CD1 3.2Å; M461-I465 WeakPolarHBondContact O-CG1 3.32Å; M461-I465 PolarHBondContact O-N 2.81Å; M461-I465 VanDerWaalsContact O-N 3.07Å; A462-I465 PolarHBondContact O-N 3.11Å; A462-I465 VanDerWaalsContact O-N 3.13Å; I465-W468 PolarHBondContact O-N 3.02Å
466	V	64.9	Low	69	Low	96 Å²	96	111.5 Å²	111.5	58%	0.582	59%	0.592	S	S	*	*	H	α-helix	trans	-65.8	-46.9	-176.2	170.5	0	0	0	0	112.8	A462 W468 R469	A462-V466 WeakPolarHBondContact O-CG2 3.22Å; A462-V466 PolarHBondContact O-N 2.55Å; V466-W468 VanDerWaalsContact C-N 3.28Å; V466-W468 PolarHBondContact O-N 3.42Å; V466-R469 PolarHBondContact O-N 3.41Å
467	P	61	Low	68.3	Low	57 Å²	57	114.5 Å²	114.5	37%	0.37	61%	0.608	S	S	.	*	H	α-helix	trans	-63	-31.6	175.7	-23.8	35.2	0	0	0	113.7	G463 R469 T470 M471	G463-P467 WeakPolarHBondContact O-CD 3.28Å; G463-P467 VanDerWaalsContact O-CG 3.25Å; G463-P467 WeakPolarHBondContact O-CG 3.48Å; P467-R469 VanDerWaalsContact C-N 3.26Å; P467-R469 PolarHBondContact O-N 3.27Å; P467-T470 WeakPolarHBondContact CA-OG1 3.35Å; P467-T470 PolarHBondContact O-N 2.64Å; P467-T470 VanDerWaalsContact O-N 3.12Å; P467-T470 PolarHBondContact O-OG1 2.75Å; P467-T470 VanDerWaalsContact O-OG1 3.09Å; P467-M471 WeakPolarHBondContact O-CG 3.44Å; P467-M471 PolarHBondContact O-N 2.86Å
468	W	55.5	Low	67.5	Low	198 Å²	198	117.8 Å²	117.8	75%	0.75	62%	0.622	S	S	*	*	H	α-helix	trans	-62.4	-32.8	177.7	-96.3	78.7	0	0	0	112.7	I464 I465 V466 S472	I464-W468 VanDerWaalsContact O-CD1 3.31Å; I465-W468 PolarHBondContact O-N 3.02Å; V466-W468 VanDerWaalsContact C-N 3.28Å; V466-W468 PolarHBondContact O-N 3.42Å; W468-S472 PolarHBondContact O-N 3.46Å; W468-S472 PolarHBondContact O-OG 3.32Å
469	R	56.5	Low	66.7	Low	197 Å²	197	115.9 Å²	115.9	74%	0.743	63%	0.626	S	S	*	*	H	α-helix	trans	-75.2	-20.5	175.5	-75.4	-171.2	173.2	-166.6	-1.9	114.2	V466 P467	V466-R469 PolarHBondContact O-N 3.41Å; P467-R469 VanDerWaalsContact C-N 3.26Å; P467-R469 PolarHBondContact O-N 3.27Å
470	T	58.4	Low	66.1	Low	98 Å²	98	114 Å²	114	60%	0.601	62%	0.623	S	S	*	*	H	α-helix	trans	-98.5	-6.5	177.3	45.8	0	0	0	0	113.7	P467	P467-T470 WeakPolarHBondContact CA-OG1 3.35Å; P467-T470 PolarHBondContact O-N 2.64Å; P467-T470 VanDerWaalsContact O-N 3.12Å; P467-T470 PolarHBondContact O-OG1 2.75Å; P467-T470 VanDerWaalsContact O-OG1 3.09Å
471	M	57.2	Low	65	Low	169 Å²	169	113.5 Å²	113.5	83%	0.833	62%	0.622	S	S	*	*	S	Bend	trans	-99.6	-6.4	168.7	-63.5	-171	80.8	0	0	113.4	P467	P467-M471 WeakPolarHBondContact O-CG 3.44Å; P467-M471 PolarHBondContact O-N 2.86Å
472	S	55.5	Low	63.8	Low	97 Å²	97	114 Å²	114	68%	0.678	63%	0.63	S	S	*	*			trans	-106	13.6	178.1	71	0	0	0	0	113.8	W468	W468-S472 PolarHBondContact O-N 3.46Å; W468-S472 PolarHBondContact O-OG 3.32Å
473	S	45.5	Very low	62.4	Low	146 Å²	146	120.2 Å²	120.2	100%	1.021	65%	0.653	S	S	*	*			trans	-128.8	0	179.3	62.2	0	0	0	0	109.8

Retrieved 473 of 473 residues in 254 ms (Link to these results)

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