SPRY3_HUMAN Loading...

SPRY domain-containing protein 3

AlphaFold DB , UniProt , Accession Q8NCJ5, Species HUMAN (Homo sapiens, Human), Gene SPRYD3, Length 442 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	43.5	Very low	42.4	Very low	250 Å²	250	203.8 Å²	203.8	100%	1.232	91%	0.914	S	S	*	*				0	120.5	0	-85.9	174.2	165.4	0	0	109.3
2	R	36.9	Very low	42.3	Very low	251 Å²	251	199.7 Å²	199.7	95%	0.947	90%	0.901	S	S	*	*			trans	-70	136.7	-179.9	-73.6	175.3	168.2	-179.3	-4.1	111.1
3	R	40.3	Very low	42.4	Very low	237 Å²	237	191.7 Å²	191.7	89%	0.894	87%	0.871	S	S	*	*			trans	-159.6	99.6	154.9	-109.5	173.5	-175.5	-170.5	1	112.9
4	T	38.8	Very low	43	Very low	133 Å²	133	191.6 Å²	191.6	82%	0.816	87%	0.868	S	S	*	*			trans	15.1	124.9	138.6	49.3	0	0	0	0	120.3
5	R	47.5	Very low	43.2	Very low	258 Å²	258	189.3 Å²	189.3	97%	0.974	86%	0.862	S	S	*	*			trans	-140	141.4	150	-83.5	-167.3	170.7	-174.3	-2.4	111.5
6	R	45.2	Very low	43.7	Very low	241 Å²	241	183.8 Å²	183.8	91%	0.909	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-66.3	159.8	-162.7	-65.6	174.5	173	-177.7	-3.7	115.8
7	P	43.4	Very low	44.2	Very low	128 Å²	128	179.8 Å²	179.8	83%	0.831	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-78.8	136.8	172.7	33.2	-31.1	0	0	0	111.1
8	R	44.8	Very low	44.8	Very low	242 Å²	242	175.7 Å²	175.7	91%	0.913	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-82	126.1	170.6	-84.5	180	167	176	-4.7	109.4
9	F	40.4	Very low	45.7	Very low	212 Å²	212	172.2 Å²	172.2	93%	0.93	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-60.2	127.6	163.5	-102.4	-103.6	0	0	0	109.8
10	V	47.3	Very low	46.4	Very low	110 Å²	110	169.8 Å²	169.8	67%	0.667	79%	0.794	S	S	*	*			trans	-96.2	114.9	167.5	176	0	0	0	0	107.6	M12	V10-M12 HydrophobicContact CG1-CB 4.36Å; V10-M12 HydrophobicContact CG1-CG 3.96Å; V10-M12 HydrophobicContact CG1-SD 3.83Å; V10-M12 PolarHBondContact O-N 3.44Å
11	L	38	Very low	47.3	Very low	180 Å²	180	166.9 Å²	166.9	94%	0.942	78%	0.78	S	S	*	*			trans	-71.1	105.9	162.7	-85.4	146.7	0	0	0	107.5
12	M	41.1	Very low	48.3	Very low	154 Å²	154	161.9 Å²	161.9	76%	0.759	75%	0.749	S	S	*	*			trans	-119.3	119.3	171	-107.1	160.7	115.4	0	0	110.2	V10	V10-M12 HydrophobicContact CG1-CB 4.36Å; V10-M12 HydrophobicContact CG1-CG 3.96Å; V10-M12 HydrophobicContact CG1-SD 3.83Å; V10-M12 PolarHBondContact O-N 3.44Å
13	N	44.6	Very low	49.8	Very low	96 Å²	96	158.8 Å²	158.8	51%	0.513	74%	0.737	S	S	.	*			trans	58.8	84.9	149.9	-64.3	4.5	0	0	0	119.9	M15 D16	N13-M15 VanDerWaalsContact C-N 3.3Å; N13-D16 WeakPolarHBondContact CB-OD2 3.5Å; N13-D16 PolarHBondContact ND2-OD2 3.2Å
14	K	49.6	Very low	51	Low	190 Å²	190	152.8 Å²	152.8	83%	0.826	72%	0.717	S	S	*	*	S	Bend	trans	-80.9	-2.4	152.7	-79.8	-174.4	175	-179.4	0	113.9
15	M	46.3	Very low	52.5	Low	158 Å²	158	149.6 Å²	149.6	78%	0.778	70%	0.695	S	S	*	*	S	Bend	trans	-93.3	-20.2	-173.2	-80.8	169.3	173.3	0	0	114.5	N13	N13-M15 VanDerWaalsContact C-N 3.3Å
16	D	51.8	Low	53.4	Low	101 Å²	101	142 Å²	142	54%	0.54	67%	0.674	S	S	.	*	H	α-helix	trans	-76.3	-32.4	178.2	-65.8	-36.9	0	0	0	112.2	N13 L18 N19 L20	N13-D16 WeakPolarHBondContact CB-OD2 3.5Å; N13-D16 PolarHBondContact ND2-OD2 3.2Å; D16-L18 PolarHBondContact O-N 3.38Å; D16-N19 PolarHBondContact O-N 3.12Å; D16-L20 PolarHBondContact O-N 3.03Å
17	D	52.3	Low	54.5	Low	116 Å²	116	139.1 Å²	139.1	62%	0.62	66%	0.663	S	S	*	*	H	α-helix	trans	-66.3	-35.3	178	-75.4	-27.3	0	0	0	113	H21	D17-H21 VanDerWaalsContact O-CB 3.27Å; D17-H21 WeakPolarHBondContact O-CB 3.42Å; D17-H21 PolarHBondContact O-N 2.81Å
18	L	54	Low	55.8	Low	106 Å²	106	140.4 Å²	140.4	56%	0.555	65%	0.651	S	S	*	*	H	α-helix	trans	-66.3	-40.4	178.6	-89.7	142.3	0	0	0	111.7	D16 H21 Y22	D16-L18 PolarHBondContact O-N 3.38Å; L18-H21 PolarHBondContact O-N 2.93Å; L18-Y22 WeakPolarHBondContact O-CD2 3.46Å; L18-Y22 PolarHBondContact O-N 3.26Å
19	N	62.8	Low	56.8	Low	109 Å²	109	137.1 Å²	137.1	58%	0.583	64%	0.639	S	S	*	*	H	α-helix	trans	-72.3	-37.6	-179.6	-156.8	-2.7	0	0	0	111.4	D16 Y22 R23	D16-N19 PolarHBondContact O-N 3.12Å; N19-Y22 PolarHBondContact O-N 2.83Å; N19-R23 WeakPolarHBondContact O-CG 3.39Å; N19-R23 PolarHBondContact O-N 3.07Å
20	L	59.6	Low	58	Low	123 Å²	123	135.6 Å²	135.6	64%	0.644	63%	0.627	S	S	*	*	H	α-helix	trans	-64.8	-41.4	173.3	-155	79.2	0	0	0	111.6	D16 R23 F24	D16-L20 PolarHBondContact O-N 3.03Å; L20-R23 PolarHBondContact O-N 3.15Å; L20-F24 WeakPolarHBondContact O-CB 3.17Å; L20-F24 PolarHBondContact O-N 3.09Å
21	H	64.6	Low	59	Low	109 Å²	109	133.4 Å²	133.4	51%	0.505	61%	0.611	S	S	.	*	H	α-helix	trans	-62.2	-44.8	176.6	-172.8	77.6	0	0	0	112.4	D17 L18 F24 L25	D17-H21 VanDerWaalsContact O-CB 3.27Å; D17-H21 WeakPolarHBondContact O-CB 3.42Å; D17-H21 PolarHBondContact O-N 2.81Å; L18-H21 PolarHBondContact O-N 2.93Å; H21-F24 PolarHBondContact O-N 2.96Å; H21-L25 WeakPolarHBondContact NE2-CD1 3.32Å; H21-L25 WeakPolarHBondContact O-CG 3.38Å; H21-L25 PolarHBondContact O-N 3.2Å
22	Y	65.2	Low	60	Low	146 Å²	146	132.9 Å²	132.9	57%	0.573	60%	0.596	S	S	*	*	H	α-helix	trans	-63.9	-41.2	175.6	-95.7	-82.5	0	0	0	112.6	L18 N19 F24 L25 N26	L18-Y22 WeakPolarHBondContact O-CD2 3.46Å; L18-Y22 PolarHBondContact O-N 3.26Å; N19-Y22 PolarHBondContact O-N 2.83Å; Y22-F24 VanDerWaalsContact C-N 3.34Å; Y22-F24 PolarHBondContact O-N 3.2Å; Y22-L25 PolarHBondContact O-N 2.71Å; Y22-N26 WeakPolarHBondContact O-CB 3.28Å; Y22-N26 PolarHBondContact O-N 3.06Å
23	R	68.1	Low	60.7	Low	185 Å²	185	131 Å²	131	70%	0.698	59%	0.585	S	S	*	*	H	α-helix	trans	-63.2	-40.4	174.6	-71.6	-176.7	76.4	173.1	4	111.9	N19 L20 N26 W27	N19-R23 WeakPolarHBondContact O-CG 3.39Å; N19-R23 PolarHBondContact O-N 3.07Å; L20-R23 PolarHBondContact O-N 3.15Å; R23-N26 PolarHBondContact O-N 3.07Å; R23-W27 VanDerWaalsContact O-CB 3.28Å; R23-W27 WeakPolarHBondContact O-CB 3.37Å; R23-W27 PolarHBondContact O-N 2.81Å
24	F	66.1	Low	61.4	Low	112 Å²	112	130.1 Å²	130.1	49%	0.491	58%	0.58	S	S	.	*	H	α-helix	trans	-65.7	-42.2	176.2	-174.3	-107.4	0	0	0	112.3	L20 H21 Y22 W27 R28	L20-F24 WeakPolarHBondContact O-CB 3.17Å; L20-F24 PolarHBondContact O-N 3.09Å; H21-F24 PolarHBondContact O-N 2.96Å; Y22-F24 VanDerWaalsContact C-N 3.34Å; Y22-F24 PolarHBondContact O-N 3.2Å; F24-W27 PolarHBondContact O-N 2.99Å; F24-R28 HydrophobicContact CD1-CG 4.44Å; F24-R28 VanDerWaalsContact CE1-CD 3.48Å; F24-R28 HydrophobicContact CE1-CG 4.22Å; F24-R28 HydrophobicContact CZ-CG 4.32Å; F24-R28 WeakPolarHBondContact O-CB 3.47Å; F24-R28 WeakPolarHBondContact O-CG 3.44Å; F24-R28 PolarHBondContact O-N 3.07Å
25	L	69.2	Low	61.6	Low	66 Å²	66	129.7 Å²	129.7	35%	0.346	57%	0.573	S	S	.	*	H	α-helix	trans	-64.1	-43.6	175.3	-75.7	172.9	0	0	0	112.3	H21 Y22 R28 R29	H21-L25 WeakPolarHBondContact NE2-CD1 3.32Å; H21-L25 WeakPolarHBondContact O-CG 3.38Å; H21-L25 PolarHBondContact O-N 3.2Å; Y22-L25 PolarHBondContact O-N 2.71Å; L25-R28 PolarHBondContact O-N 2.84Å; L25-R29 PolarHBondContact O-N 3.39Å
26	N	67.2	Low	62.1	Low	98 Å²	98	127.1 Å²	127.1	52%	0.524	56%	0.559	S	S	.	*	H	α-helix	trans	-64.8	-40.7	175.7	-80.6	-14.1	0	0	0	111.9	Y22 R23 R29 R30	Y22-N26 WeakPolarHBondContact O-CB 3.28Å; Y22-N26 PolarHBondContact O-N 3.06Å; R23-N26 PolarHBondContact O-N 3.07Å; N26-R29 PolarHBondContact O-N 2.61Å; N26-R30 WeakPolarHBondContact O-CB 3.34Å; N26-R30 PolarHBondContact O-N 2.87Å
27	W	68.5	Low	62.4	Low	180 Å²	180	126.1 Å²	126.1	68%	0.682	56%	0.557	S	S	*	*	H	α-helix	trans	-59.7	-46.3	172.3	178.3	-67.1	0	0	0	111.3	R23 F24 R30 I31	R23-W27 VanDerWaalsContact O-CB 3.28Å; R23-W27 WeakPolarHBondContact O-CB 3.37Å; R23-W27 PolarHBondContact O-N 2.81Å; F24-W27 PolarHBondContact O-N 2.99Å; W27-R30 PolarHBondContact O-N 2.57Å; W27-I31 WeakPolarHBondContact O-CG1 3.34Å; W27-I31 PolarHBondContact O-N 3.4Å
28	R	70.7	Confident	62.7	Low	155 Å²	155	128.4 Å²	128.4	59%	0.585	56%	0.557	S	S	*	*	H	α-helix	trans	-63.4	-41.7	177.3	-74.9	-176.8	107.1	169.4	2.8	112.5	F24 L25 I31 R32	F24-R28 HydrophobicContact CD1-CG 4.44Å; F24-R28 VanDerWaalsContact CE1-CD 3.48Å; F24-R28 HydrophobicContact CE1-CG 4.22Å; F24-R28 HydrophobicContact CZ-CG 4.32Å; F24-R28 WeakPolarHBondContact O-CB 3.47Å; F24-R28 WeakPolarHBondContact O-CG 3.44Å; F24-R28 PolarHBondContact O-N 3.07Å; L25-R28 PolarHBondContact O-N 2.84Å; R28-I31 PolarHBondContact O-N 2.82Å; R28-R32 VanDerWaalsContact O-CB 3.3Å; R28-R32 WeakPolarHBondContact O-CB 3.47Å; R28-R32 PolarHBondContact O-N 3.47Å
29	R	64.6	Low	62.7	Low	173 Å²	173	126 Å²	126	65%	0.653	55%	0.553	S	S	*	*	H	α-helix	trans	-60.9	-47	173.9	-77.3	-172.7	-169.6	-171.4	3.8	111.1	L25 N26 I31 R32 E33	L25-R29 PolarHBondContact O-N 3.39Å; N26-R29 PolarHBondContact O-N 2.61Å; R29-I31 PolarHBondContact O-N 3.35Å; R29-R32 CarbonylContact O-C 3.45Å; R29-R32 WeakPolarHBondContact O-CA 3.42Å; R29-R32 WeakPolarHBondContact O-CB 3.35Å; R29-R32 PolarHBondContact O-N 3.22Å; R29-R32 VanDerWaalsContact O-N 3.1Å; R29-E33 WeakPolarHBondContact O-CG 3.26Å; R29-E33 PolarHBondContact O-N 2.66Å
30	R	67.3	Low	62.4	Low	181 Å²	181	128.2 Å²	128.2	68%	0.683	56%	0.557	S	S	*	*	H	α-helix	trans	-65.1	-39.1	178.9	-166.4	166.4	-179.1	152.1	-1.2	112.7	N26 W27 R32 I34	N26-R30 WeakPolarHBondContact O-CB 3.34Å; N26-R30 PolarHBondContact O-N 2.87Å; W27-R30 PolarHBondContact O-N 2.57Å; R30-R32 VanDerWaalsContact C-N 3.34Å; R30-I34 HydrophobicContact CG-CD1 4.1Å; R30-I34 WeakPolarHBondContact O-CB 3.22Å; R30-I34 WeakPolarHBondContact O-CD1 3.25Å; R30-I34 WeakPolarHBondContact O-CG1 3.31Å; R30-I34 PolarHBondContact O-N 3.44Å
31	I	66.7	Low	62.5	Low	64 Å²	64	128.8 Å²	128.8	33%	0.328	55%	0.551	S	S	.	*	H	α-helix	trans	-63.1	-42.1	171.2	-75.3	-168	0	0	0	110.8	W27 R28 R29 I34 R35	W27-I31 WeakPolarHBondContact O-CG1 3.34Å; W27-I31 PolarHBondContact O-N 3.4Å; R28-I31 PolarHBondContact O-N 2.82Å; R29-I31 PolarHBondContact O-N 3.35Å; I31-I34 PolarHBondContact O-N 3.01Å; I31-R35 HydrophobicContact CG2-CG 4.25Å; I31-R35 VanDerWaalsContact O-CB 3.31Å; I31-R35 WeakPolarHBondContact O-CB 3.15Å; I31-R35 VanDerWaalsContact O-CG 3.27Å; I31-R35 WeakPolarHBondContact O-CG 3.4Å; I31-R35 PolarHBondContact O-N 3.4Å
32	R	59.4	Low	62.9	Low	168 Å²	168	129 Å²	129	63%	0.634	55%	0.548	S	S	*	.	H	α-helix	trans	-62.8	-47.4	178.1	-175.2	178.2	-179.6	162.6	6.2	111	R28 R29 R30 I34 R35 E36	R28-R32 VanDerWaalsContact O-CB 3.3Å; R28-R32 WeakPolarHBondContact O-CB 3.47Å; R28-R32 PolarHBondContact O-N 3.47Å; R29-R32 CarbonylContact O-C 3.45Å; R29-R32 WeakPolarHBondContact O-CA 3.42Å; R29-R32 WeakPolarHBondContact O-CB 3.35Å; R29-R32 PolarHBondContact O-N 3.22Å; R29-R32 VanDerWaalsContact O-N 3.1Å; R30-R32 VanDerWaalsContact C-N 3.34Å; R32-I34 PolarHBondContact O-N 3.24Å; R32-R35 CarbonylContact O-C 3.54Å; R32-R35 WeakPolarHBondContact O-CB 3.47Å; R32-R35 PolarHBondContact O-N 3.36Å; R32-E36 HydrophobicContact CG-CG 4.41Å; R32-E36 WeakPolarHBondContact CG-OE1 3.41Å; R32-E36 IonicContact CZ-OE1 3.79Å; R32-E36 IonicContact NE-OE1 2.71Å; R32-E36 PolarHBondContact NE-OE1 3Å; R32-E36 IonicContact NH2-OE1 2.87Å; R32-E36 WeakPolarHBondContact O-CB 3.26Å; R32-E36 WeakPolarHBondContact O-CG 3.13Å; R32-E36 PolarHBondContact O-N 2.88Å
33	E	55.6	Low	63.8	Low	114 Å²	114	127.6 Å²	127.6	53%	0.533	55%	0.547	S	S	.	.	H	α-helix	trans	-59.9	-45.1	174.3	-74.7	170.7	-175.8	0	0	111.7	R29 R35 E36 V37	R29-E33 WeakPolarHBondContact O-CG 3.26Å; R29-E33 PolarHBondContact O-N 2.66Å; E33-R35 VanDerWaalsContact C-N 3.31Å; E33-R35 PolarHBondContact O-N 3.49Å; E33-E36 PolarHBondContact O-N 2.93Å; E33-V37 WeakPolarHBondContact O-CB 3.32Å; E33-V37 VanDerWaalsContact O-CG2 3.23Å; E33-V37 WeakPolarHBondContact O-CG2 3.33Å; E33-V37 PolarHBondContact O-N 3.17Å
34	I	59.3	Low	64.8	Low	78 Å²	78	122.9 Å²	122.9	40%	0.4	53%	0.532	S	S	.	.	H	α-helix	trans	-62.1	-40.8	175.8	-70	164.4	0	0	0	110.9	R30 I31 R32 R38	R30-I34 HydrophobicContact CG-CD1 4.1Å; R30-I34 WeakPolarHBondContact O-CB 3.22Å; R30-I34 WeakPolarHBondContact O-CD1 3.25Å; R30-I34 WeakPolarHBondContact O-CG1 3.31Å; R30-I34 PolarHBondContact O-N 3.44Å; I31-I34 PolarHBondContact O-N 3.01Å; R32-I34 PolarHBondContact O-N 3.24Å; I34-R38 HydrophobicContact CG2-CG 4.38Å; I34-R38 VanDerWaalsContact O-CB 3.22Å; I34-R38 WeakPolarHBondContact O-CB 3.41Å; I34-R38 WeakPolarHBondContact O-CG 3.44Å; I34-R38 PolarHBondContact O-N 3.38Å
35	R	55.4	Low	66.2	Low	182 Å²	182	120.7 Å²	120.7	69%	0.687	52%	0.521	S	S	*	.	H	α-helix	trans	-66.3	-41.8	176.3	-78.6	179.5	177.3	-167.1	-2.1	111.5	I31 R32 E33 R38 A39	I31-R35 HydrophobicContact CG2-CG 4.25Å; I31-R35 VanDerWaalsContact O-CB 3.31Å; I31-R35 WeakPolarHBondContact O-CB 3.15Å; I31-R35 VanDerWaalsContact O-CG 3.27Å; I31-R35 WeakPolarHBondContact O-CG 3.4Å; I31-R35 PolarHBondContact O-N 3.4Å; R32-R35 CarbonylContact O-C 3.54Å; R32-R35 WeakPolarHBondContact O-CB 3.47Å; R32-R35 PolarHBondContact O-N 3.36Å; E33-R35 VanDerWaalsContact C-N 3.31Å; E33-R35 PolarHBondContact O-N 3.49Å; R35-R38 PolarHBondContact O-N 3.17Å; R35-A39 WeakPolarHBondContact O-CB 3.38Å; R35-A39 PolarHBondContact O-N 3.4Å
36	E	56.4	Low	67.5	Low	103 Å²	103	121.7 Å²	121.7	48%	0.481	52%	0.523	S	S	.	.	H	α-helix	trans	-66.8	-44.9	177.9	-75.9	171.5	-173.5	0	0	111	R32 E33 A39 F40	R32-E36 HydrophobicContact CG-CG 4.41Å; R32-E36 WeakPolarHBondContact CG-OE1 3.41Å; R32-E36 IonicContact CZ-OE1 3.79Å; R32-E36 IonicContact NE-OE1 2.71Å; R32-E36 PolarHBondContact NE-OE1 3Å; R32-E36 IonicContact NH2-OE1 2.87Å; R32-E36 WeakPolarHBondContact O-CB 3.26Å; R32-E36 WeakPolarHBondContact O-CG 3.13Å; R32-E36 PolarHBondContact O-N 2.88Å; E33-E36 PolarHBondContact O-N 2.93Å; E36-A39 PolarHBondContact O-N 2.92Å; E36-F40 PolarHBondContact O-N 3.37Å
37	V	57.5	Low	69	Low	80 Å²	80	121 Å²	121	49%	0.485	52%	0.515	S	S	.	.	H	α-helix	trans	-65.1	-40.7	175.8	173.7	0	0	0	0	111.6	E33 R41	E33-V37 WeakPolarHBondContact O-CB 3.32Å; E33-V37 VanDerWaalsContact O-CG2 3.23Å; E33-V37 WeakPolarHBondContact O-CG2 3.33Å; E33-V37 PolarHBondContact O-N 3.17Å; V37-R41 WeakPolarHBondContact O-CG 3.12Å; V37-R41 PolarHBondContact O-N 2.86Å
38	R	57.8	Low	70.3	Confident	164 Å²	164	114.2 Å²	114.2	62%	0.619	49%	0.491	S	S	*	.	H	α-helix	trans	-67.6	-41.4	174.2	-76.2	-179.9	175.6	-165.4	-2.4	111.4	I34 R35 F40 R41 Y42	I34-R38 HydrophobicContact CG2-CG 4.38Å; I34-R38 VanDerWaalsContact O-CB 3.22Å; I34-R38 WeakPolarHBondContact O-CB 3.41Å; I34-R38 WeakPolarHBondContact O-CG 3.44Å; I34-R38 PolarHBondContact O-N 3.38Å; R35-R38 PolarHBondContact O-N 3.17Å; R38-F40 VanDerWaalsContact C-N 3.29Å; R38-F40 PolarHBondContact O-N 3.19Å; R38-R41 PolarHBondContact O-N 2.95Å; R38-R41 VanDerWaalsContact O-N 3.11Å; R38-Y42 WeakPolarHBondContact O-CD2 3.48Å; R38-Y42 PolarHBondContact O-N 2.9Å
39	A	55.3	Low	71.6	Confident	57 Å²	57	107.2 Å²	107.2	47%	0.471	47%	0.465	S	S	.	.	H	α-helix	trans	-60.4	-40.4	177.8	0	0	0	0	0	111.3	R35 E36 R41 Y42 Q43	R35-A39 WeakPolarHBondContact O-CB 3.38Å; R35-A39 PolarHBondContact O-N 3.4Å; E36-A39 PolarHBondContact O-N 2.92Å; A39-R41 VanDerWaalsContact C-N 3.34Å; A39-R41 PolarHBondContact O-N 3.34Å; A39-Y42 PolarHBondContact O-N 3.29Å; A39-Q43 WeakPolarHBondContact O-CG 3.24Å
40	F	55.9	Low	73.1	Confident	154 Å²	154	103.4 Å²	103.4	68%	0.675	46%	0.457	S	S	*	.	H	α-helix	trans	-67.9	-31.8	175.6	-168.3	-98.3	0	0	0	113.2	E36 R38	E36-F40 PolarHBondContact O-N 3.37Å; R38-F40 VanDerWaalsContact C-N 3.29Å; R38-F40 PolarHBondContact O-N 3.19Å
41	R	62.2	Low	74.5	Confident	136 Å²	136	96.9 Å²	96.9	51%	0.513	44%	0.437	S	S	.	.	H	α-helix	trans	-72.9	-25.4	179	-80.6	-176.3	-176.7	-171.7	0.5	114	V37 R38 A39 Q101	V37-R41 WeakPolarHBondContact O-CG 3.12Å; V37-R41 PolarHBondContact O-N 2.86Å; R38-R41 PolarHBondContact O-N 2.95Å; R38-R41 VanDerWaalsContact O-N 3.11Å; A39-R41 VanDerWaalsContact C-N 3.34Å; A39-R41 PolarHBondContact O-N 3.34Å; R41-Q101 PolarHBondContact O-NE2 2.89Å
42	Y	72.2	Confident	75.8	Confident	113 Å²	113	100.3 Å²	100.3	44%	0.443	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.6	50.6	-173.9	-62.1	-71.1	0	0	0	111	R38 A39 S71 F183	R38-Y42 WeakPolarHBondContact O-CD2 3.48Å; R38-Y42 PolarHBondContact O-N 2.9Å; A39-Y42 PolarHBondContact O-N 3.29Å; Y42-S71 CarbonylContact C-O 3.55Å; Y42-S71 WeakPolarHBondContact CA-O 3.2Å; Y42-S71 VanDerWaalsContact CB-O 3.28Å; Y42-S71 WeakPolarHBondContact CB-O 3.43Å; Y42-S71 WeakPolarHBondContact CD1-O 3.34Å; Y42-S71 WeakPolarHBondContact O-CB 3.23Å; Y42-F183 HydrophobicContact CD1-CE1 4.22Å; Y42-F183 HydrophobicContact CD1-CZ 4.43Å; Y42-F183 HydrophobicContact CE1-CE1 4.42Å; Y42-F183 HydrophobicContact CE1-CZ 4.23Å
43	Q	83.6	Confident	77.5	Confident	117 Å²	117	95.3 Å²	95.3	55%	0.547	46%	0.457	S	S	.	.			trans	-101.1	145.3	165.8	-57.9	-166.2	-58.3	0	0	108.7	A39	A39-Q43 WeakPolarHBondContact O-CG 3.24Å
44	E	89.9	Confident	79.3	Confident	85 Å²	85	94.7 Å²	94.7	40%	0.397	46%	0.457	S	S	.	.			trans	-61.7	147.6	166.3	64	-173.3	178.4	0	0	109.8	F46 Y68 V69	E44-F46 HydrophobicContact CG-CD1 4.38Å; E44-F46 HydrophobicContact CG-CE1 4.29Å; E44-Y68 HydrophobicContact CB-CE2 4.03Å; E44-Y68 HydrophobicContact CG-CE2 4.45Å; E44-Y68 WeakPolarHBondContact OE2-CE2 3.38Å; E44-Y68 PolarHBondContact OE2-OH 2.71Å; E44-V69 WeakPolarHBondContact CA-O 3.4Å
45	R	95.7	Very high	81.1	Confident	67 Å²	67	92.7 Å²	92.7	25%	0.253	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	129.5	-179.2	-57.8	-173.9	-58.6	124.9	12.6	108.2	Y68 V69 Q101 Y103 L105	R45-Y68 CarbonylContact O-C 3.57Å; R45-V69 PolarHBondContact N-O 3.39Å; R45-V69 PolarHBondContact O-N 2.74Å; R45-Q101 PolarHBondContact NE-O 3.24Å; R45-Q101 PolarHBondContact NH2-O 3.36Å; R45-Y103 PolarHBondContact NH1-O 2.83Å; R45-Y103 VanDerWaalsContact NH2-N 3.16Å; R45-Y103 PolarHBondContact NH2-O 2.88Å; R45-Y103 VanDerWaalsContact NH2-O 3.1Å; R45-L105 HydrophobicContact CB-CD1 4.13Å; R45-L105 HydrophobicContact CB-CD2 4.17Å
46	F	96.8	Very high	83.1	Confident	87 Å²	87	84.1 Å²	84.1	38%	0.382	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	158.2	178.7	58.1	-91.8	0	0	0	112.9	E44 I49 V51 C67 Y68	E44-F46 HydrophobicContact CG-CD1 4.38Å; E44-F46 HydrophobicContact CG-CE1 4.29Å; F46-I49 VanDerWaalsContact CD2-O 3.27Å; F46-I49 WeakPolarHBondContact CD2-O 3.35Å; F46-V51 HydrophobicContact CD1-CG2 3.84Å; F46-V51 HydrophobicContact CD2-CG2 4.09Å; F46-V51 HydrophobicContact CE1-CG2 3.82Å; F46-V51 HydrophobicContact CE2-CG2 4.07Å; F46-V51 HydrophobicContact CG-CG2 3.98Å; F46-V51 HydrophobicContact CZ-CG2 3.94Å; F46-C67 CarbonylContact C-O 3.5Å; F46-C67 WeakPolarHBondContact CA-O 3.37Å; F46-C67 WeakPolarHBondContact CB-O 3.32Å; F46-Y68 HydrophobicContact CB-CD2 3.85Å; F46-Y68 HydrophobicContact CB-CG 4.45Å; F46-Y68 HydrophobicContact CD1-CD2 4.1Å; F46-Y68 HydrophobicContact CD1-CE2 4.3Å; F46-Y68 HydrophobicContact CG-CD2 4.28Å
47	K	97.4	Very high	85.1	Confident	83 Å²	83	80.5 Å²	80.5	36%	0.361	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	143.4	174.3	-159.8	-168.3	-176.7	-142.2	0	109	I49 G66 C67 L105 D106	K47-I49 PolarHBondContact O-N 3.43Å; K47-I49 VanDerWaalsContact O-N 3.1Å; K47-G66 WeakPolarHBondContact O-CA 3.32Å; K47-C67 PolarHBondContact N-O 2.76Å; K47-C67 PolarHBondContact O-N 2.84Å; K47-C67 VanDerWaalsContact O-N 3.09Å; K47-L105 HydrophobicContact CB-CB 3.71Å; K47-L105 HydrophobicContact CB-CD1 4.3Å; K47-D106 WeakPolarHBondContact CD-OD1 3.47Å; K47-D106 WeakPolarHBondContact CE-OD1 3.37Å; K47-D106 IonicContact NZ-OD1 3.2Å; K47-D106 PolarHBondContact NZ-OD1 3.29Å
48	H	97.3	Very high	87	Confident	38 Å²	38	77.7 Å²	77.7	18%	0.176	38%	0.384	C	S	.	.	S	Bend	trans	52.2	28.8	-178.9	-51.7	-71	0	0	0	114.6	H59 E64 V65	H48-H59 CarbonylContact O-C 3.57Å; H48-H59 PolarHBondContact O-N 2.87Å; H48-E64 IonicContact CE1-OE1 3.79Å; H48-E64 PolarHBondContact CE1-OE1 3.39Å; H48-E64 VanDerWaalsContact CE1-OE1 3.23Å; H48-E64 IonicContact CE1-OE2 3.34Å; H48-E64 PolarHBondContact CE1-OE2 2.78Å; H48-E64 IonicContact ND1-OE2 3.02Å; H48-E64 PolarHBondContact ND1-OE2 3.08Å; H48-E64 IonicContact NE2-OE1 3.97Å; H48-V65 PolarHBondContact CD2-O 3.45Å
49	I	97.5	Very high	88.8	Confident	7 Å²	7	75.5 Å²	75.5	4%	0.036	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	131.6	175.9	-64.1	-177	0	0	0	107.1	F46 K47 V51 L56 S57 M188	F46-I49 VanDerWaalsContact CD2-O 3.27Å; F46-I49 WeakPolarHBondContact CD2-O 3.35Å; K47-I49 PolarHBondContact O-N 3.43Å; K47-I49 VanDerWaalsContact O-N 3.1Å; I49-V51 HydrophobicContact CG2-CG2 4.35Å; I49-L56 HydrophobicContact CG2-CB 3.94Å; I49-L56 HydrophobicContact CG2-CD2 4.01Å; I49-S57 CarbonylContact C-O 3.55Å; I49-S57 WeakPolarHBondContact CA-O 3.39Å; I49-M188 HydrophobicContact CB-CE 4.34Å; I49-M188 HydrophobicContact CD1-CE 3.54Å; I49-M188 HydrophobicContact CG1-CE 3.73Å; I49-M188 HydrophobicContact CG2-CE 3.75Å
50	L	96.4	Very high	90.5	Very high	94 Å²	94	73.2 Å²	73.2	49%	0.492	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	137.2	165.9	-69	176.1	0	0	0	108.8	L56 S57 H59	L50-L56 WeakPolarHBondContact O-CA 3.25Å; L50-S57 PolarHBondContact N-O 3.06Å; L50-S57 PolarHBondContact O-N 2.64Å; L50-H59 HydrophobicContact CD1-CB 4.13Å; L50-H59 WeakPolarHBondContact CD1-CD2 3.24Å; L50-H59 HydrophobicContact CG-CB 3.71Å
51	V	96.7	Very high	92.1	Very high	44 Å²	44	71.6 Å²	71.6	27%	0.267	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	115.8	-179.8	-173.1	0	0	0	0	108	F46 I49 L56 Y68	F46-V51 HydrophobicContact CD1-CG2 3.84Å; F46-V51 HydrophobicContact CD2-CG2 4.09Å; F46-V51 HydrophobicContact CE1-CG2 3.82Å; F46-V51 HydrophobicContact CE2-CG2 4.07Å; F46-V51 HydrophobicContact CG-CG2 3.98Å; F46-V51 HydrophobicContact CZ-CG2 3.94Å; I49-V51 HydrophobicContact CG2-CG2 4.35Å; V51-L56 HydrophobicContact CB-CD2 4.21Å; V51-L56 HydrophobicContact CG1-CD2 3.94Å; V51-L56 HydrophobicContact CG2-CD2 3.68Å; V51-Y68 HydrophobicContact CG2-CD2 4.03Å; V51-Y68 HydrophobicContact CG2-CE2 4.16Å
52	D	93.6	Very high	92.9	Very high	135 Å²	135	71.5 Å²	71.5	72%	0.722	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.4	98.4	173.9	-173.7	16	0	0	0	109.6	D54 T55	D52-D54 PolarHBondContact O-N 3.38Å; D52-T55 PolarHBondContact N-O 2.66Å; D52-T55 WeakPolarHBondContact O-CB 3.22Å; D52-T55 PolarHBondContact O-N 2.8Å
53	G	94.4	Very high	93.5	Very high	64 Å²	64	68.9 Å²	68.9	66%	0.66	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.2	-119.7	-169.7	0	0	0	0	0	111.2
54	D	94.6	Very high	94.1	Very high	101 Å²	101	66.3 Å²	66.3	54%	0.54	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-2.5	177.4	-61.9	-43.8	0	0	0	112.8	D52 R196 L197	D52-D54 PolarHBondContact O-N 3.38Å; D54-R196 CarbonylContact O-C 3.35Å; D54-R196 WeakPolarHBondContact O-CA 3.41Å; D54-L197 PolarHBondContact O-N 3.09Å
55	T	96.8	Very high	94.4	Very high	35 Å²	35	62.9 Å²	62.9	22%	0.215	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	130.1	179.5	-57.7	0	0	0	0	110.5	D52 E194 V195	D52-T55 PolarHBondContact N-O 2.66Å; D52-T55 WeakPolarHBondContact O-CB 3.22Å; D52-T55 PolarHBondContact O-N 2.8Å; T55-E194 HydrophobicContact CG2-CG 3.68Å; T55-V195 CarbonylContact C-O 3.57Å; T55-V195 WeakPolarHBondContact CA-O 3.09Å
56	L	98.1	Very high	94.5	Very high	2 Å²	2	59.7 Å²	59.7	1%	0.01	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	120.5	177	-58.5	169.7	0	0	0	108.4	I49 L50 V51 Y68 V186 M188 E194 V195 L197	I49-L56 HydrophobicContact CG2-CB 3.94Å; I49-L56 HydrophobicContact CG2-CD2 4.01Å; L50-L56 WeakPolarHBondContact O-CA 3.25Å; V51-L56 HydrophobicContact CB-CD2 4.21Å; V51-L56 HydrophobicContact CG1-CD2 3.94Å; V51-L56 HydrophobicContact CG2-CD2 3.68Å; L56-Y68 HydrophobicContact CD1-CD1 4.1Å; L56-Y68 HydrophobicContact CD1-CG 4.1Å; L56-Y68 HydrophobicContact CD2-CD2 3.64Å; L56-Y68 HydrophobicContact CD2-CE2 3.99Å; L56-Y68 HydrophobicContact CD2-CG 3.95Å; L56-V186 HydrophobicContact CD1-CB 4.07Å; L56-V186 HydrophobicContact CD1-CG1 4.35Å; L56-V186 HydrophobicContact CD1-CG2 4.01Å; L56-M188 HydrophobicContact CB-CE 3.88Å; L56-E194 WeakPolarHBondContact O-CA 3.36Å; L56-V195 HydrophobicContact CB-CG2 3.8Å; L56-V195 HydrophobicContact CD1-CG2 4.04Å; L56-V195 HydrophobicContact CG-CG2 4.39Å; L56-V195 PolarHBondContact N-O 2.68Å; L56-V195 PolarHBondContact O-N 3.44Å; L56-L197 HydrophobicContact CD1-CB 4.16Å; L56-L197 HydrophobicContact CD1-CD2 4.43Å
57	S	97.3	Very high	94.6	Very high	28 Å²	28	55.6 Å²	55.6	20%	0.196	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	135.6	-179.7	-40	0	0	0	0	110.6	I49 L50 H59 E194	I49-S57 CarbonylContact C-O 3.55Å; I49-S57 WeakPolarHBondContact CA-O 3.39Å; L50-S57 PolarHBondContact N-O 3.06Å; L50-S57 PolarHBondContact O-N 2.64Å; S57-H59 PolarHBondContact O-N 2.93Å; S57-E194 PolarHBondContact OG-OE2 2.97Å
58	Y	97.2	Very high	94.6	Very high	21 Å²	21	52.1 Å²	52.1	8%	0.082	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	132.8	177.4	177.8	-97.5	0	0	0	111.4	G60 N61 E64 M188 S190 L191 E193	Y58-G60 VanDerWaalsContact CE1-O 3.28Å; Y58-G60 WeakPolarHBondContact CE1-O 3.29Å; Y58-G60 VanDerWaalsContact CZ-CA 3.46Å; Y58-G60 WeakPolarHBondContact OH-CA 3.46Å; Y58-N61 PolarHBondContact OH-O 3.48Å; Y58-N61 VanDerWaalsContact OH-O 3.11Å; Y58-E64 VanDerWaalsContact CE2-O 3.3Å; Y58-E64 WeakPolarHBondContact CE2-O 3.47Å; Y58-E64 PolarHBondContact OH-O 3.1Å; Y58-M188 HydrophobicContact CD2-CB 3.82Å; Y58-M188 HydrophobicContact CG-CB 4.38Å; Y58-S190 WeakPolarHBondContact CB-O 3.15Å; Y58-S190 VanDerWaalsContact CD1-C 3.42Å; Y58-S190 WeakPolarHBondContact CD1-O 3.1Å; Y58-S190 VanDerWaalsContact CG-O 3.29Å; Y58-L191 HydrophobicContact CD1-CD2 4.25Å; Y58-L191 HydrophobicContact CE1-CD2 4.04Å; Y58-E193 PolarHBondContact N-O 2.93Å
59	H	95.8	Very high	94.7	Very high	118 Å²	118	50.5 Å²	50.5	55%	0.546	31%	0.308	S	S	.	.			trans	-144.3	49.7	-178.6	-167.9	-81.8	0	0	0	110.8	H48 L50 S57	H48-H59 CarbonylContact O-C 3.57Å; H48-H59 PolarHBondContact O-N 2.87Å; L50-H59 HydrophobicContact CD1-CB 4.13Å; L50-H59 WeakPolarHBondContact CD1-CD2 3.24Å; L50-H59 HydrophobicContact CG-CB 3.71Å; S57-H59 PolarHBondContact O-N 2.93Å
60	G	91.4	Very high	94.6	Very high	9 Å²	9	50.3 Å²	50.3	9%	0.093	31%	0.307	C	S	.	.			trans	-106.9	162.8	172.3	0	0	0	0	0	112.8	Y58	Y58-G60 VanDerWaalsContact CE1-O 3.28Å; Y58-G60 WeakPolarHBondContact CE1-O 3.29Å; Y58-G60 VanDerWaalsContact CZ-CA 3.46Å; Y58-G60 WeakPolarHBondContact OH-CA 3.46Å
61	N	89.8	Confident	94.5	Very high	119 Å²	119	47.7 Å²	47.7	64%	0.636	30%	0.297	S	S	*	.			trans	-84.1	172.1	168.5	-59.2	-69.2	0	0	0	110.9	Y58 G63 E64	Y58-N61 PolarHBondContact OH-O 3.48Å; Y58-N61 VanDerWaalsContact OH-O 3.11Å; N61-G63 PolarHBondContact O-N 3.34Å; N61-E64 HydrophobicContact CB-CG 4.44Å; N61-E64 WeakPolarHBondContact CB-OE2 3.48Å; N61-E64 PolarHBondContact N-OE2 3.22Å; N61-E64 PolarHBondContact ND2-OE2 3.27Å; N61-E64 VanDerWaalsContact ND2-OE2 3.09Å; N61-E64 PolarHBondContact O-N 2.85Å
62	S	77.9	Confident	94.3	Very high	135 Å²	135	54.4 Å²	54.4	94%	0.944	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.6	113.8	-178	-167.5	0	0	0	0	112.6
63	G	84.6	Confident	94.3	Very high	57 Å²	57	49 Å²	49	59%	0.588	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.3	-8.6	177	0	0	0	0	0	115.9	N61 H189	N61-G63 PolarHBondContact O-N 3.34Å; G63-H189 VanDerWaalsContact C-NE2 3.33Å; G63-H189 PolarHBondContact O-NE2 2.7Å
64	E	96	Very high	94.3	Very high	64 Å²	64	46.2 Å²	46.2	30%	0.299	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-77.8	132.6	178.6	-63	-176.1	132.2	0	0	111.4	H48 Y58 N61 H189	H48-E64 IonicContact CE1-OE1 3.79Å; H48-E64 PolarHBondContact CE1-OE1 3.39Å; H48-E64 VanDerWaalsContact CE1-OE1 3.23Å; H48-E64 IonicContact CE1-OE2 3.34Å; H48-E64 PolarHBondContact CE1-OE2 2.78Å; H48-E64 IonicContact ND1-OE2 3.02Å; H48-E64 PolarHBondContact ND1-OE2 3.08Å; H48-E64 IonicContact NE2-OE1 3.97Å; Y58-E64 VanDerWaalsContact CE2-O 3.3Å; Y58-E64 WeakPolarHBondContact CE2-O 3.47Å; Y58-E64 PolarHBondContact OH-O 3.1Å; N61-E64 HydrophobicContact CB-CG 4.44Å; N61-E64 WeakPolarHBondContact CB-OE2 3.48Å; N61-E64 PolarHBondContact N-OE2 3.22Å; N61-E64 PolarHBondContact ND2-OE2 3.27Å; N61-E64 VanDerWaalsContact ND2-OE2 3.09Å; N61-E64 PolarHBondContact O-N 2.85Å; E64-H189 PolarHBondContact O-CD2 2.83Å
65	V	97.3	Very high	94.2	Very high	13 Å²	13	44.4 Å²	44.4	8%	0.079	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-84.9	129.6	173.5	177.6	0	0	0	0	109.4	H48 Q108 W111	H48-V65 PolarHBondContact CD2-O 3.45Å; V65-Q108 HydrophobicContact CG1-CG 3.95Å; V65-W111 HydrophobicContact CG2-CZ3 4.36Å
66	G	97.5	Very high	93.9	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	139.6	165.3	0	0	0	0	0	111.2	K47 G187 M188	K47-G66 WeakPolarHBondContact O-CA 3.32Å; G66-G187 CarbonylContact O-C 3.41Å; G66-G187 WeakPolarHBondContact O-CA 3.14Å; G66-M188 WeakPolarHBondContact CA-O 3.3Å; G66-M188 PolarHBondContact N-O 2.82Å; G66-M188 PolarHBondContact O-N 2.85Å
67	C	98.5	Very high	93.5	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	136	176.2	-177.4	0	0	0	0	109.7	F46 K47 L105 V186	F46-C67 CarbonylContact C-O 3.5Å; F46-C67 WeakPolarHBondContact CA-O 3.37Å; F46-C67 WeakPolarHBondContact CB-O 3.32Å; K47-C67 PolarHBondContact N-O 2.76Å; K47-C67 PolarHBondContact O-N 2.84Å; K47-C67 VanDerWaalsContact O-N 3.09Å; C67-L105 HydrophobicContact CB-CB 4.43Å; C67-L105 HydrophobicContact CB-CD2 4.44Å; C67-L105 WeakPolarHBondContact CB-O 3.47Å; C67-V186 CarbonylContact C-O 3.49Å; C67-V186 WeakPolarHBondContact CA-O 3.47Å
68	Y	98.5	Very high	93.2	Very high	11 Å²	11	55.6 Å²	55.6	4%	0.043	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	135.4	174.2	173.5	-85.7	0	0	0	108.6	E44 R45 F46 V51 L56 A70 A185 V186 L197	E44-Y68 HydrophobicContact CB-CE2 4.03Å; E44-Y68 HydrophobicContact CG-CE2 4.45Å; E44-Y68 WeakPolarHBondContact OE2-CE2 3.38Å; E44-Y68 PolarHBondContact OE2-OH 2.71Å; R45-Y68 CarbonylContact O-C 3.57Å; F46-Y68 HydrophobicContact CB-CD2 3.85Å; F46-Y68 HydrophobicContact CB-CG 4.45Å; F46-Y68 HydrophobicContact CD1-CD2 4.1Å; F46-Y68 HydrophobicContact CD1-CE2 4.3Å; F46-Y68 HydrophobicContact CG-CD2 4.28Å; V51-Y68 HydrophobicContact CG2-CD2 4.03Å; V51-Y68 HydrophobicContact CG2-CE2 4.16Å; L56-Y68 HydrophobicContact CD1-CD1 4.1Å; L56-Y68 HydrophobicContact CD1-CG 4.1Å; L56-Y68 HydrophobicContact CD2-CD2 3.64Å; L56-Y68 HydrophobicContact CD2-CE2 3.99Å; L56-Y68 HydrophobicContact CD2-CG 3.95Å; Y68-A70 HydrophobicContact CE1-CB 4.05Å; Y68-A185 CarbonylContact O-C 3.46Å; Y68-A185 WeakPolarHBondContact O-CA 3.41Å; Y68-A185 WeakPolarHBondContact O-CB 3.44Å; Y68-V186 PolarHBondContact N-O 2.88Å; Y68-V186 PolarHBondContact O-N 2.85Å; Y68-L197 HydrophobicContact CD1-CD2 4.33Å; Y68-L197 HydrophobicContact CE1-CD2 3.6Å
69	V	97.9	Very high	93.1	Very high	3 Å²	3	56 Å²	56	2%	0.018	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	122.9	174	-175.3	0	0	0	0	108.1	E44 R45 V99 L105 F183 A185	E44-V69 WeakPolarHBondContact CA-O 3.4Å; R45-V69 PolarHBondContact N-O 3.39Å; R45-V69 PolarHBondContact O-N 2.74Å; V69-V99 HydrophobicContact CB-CG2 4.41Å; V69-V99 HydrophobicContact CG1-CG2 3.68Å; V69-V99 HydrophobicContact CG2-CG2 3.85Å; V69-L105 HydrophobicContact CG2-CD2 3.94Å; V69-F183 HydrophobicContact CG1-CB 3.73Å; V69-F183 HydrophobicContact CG1-CG 4.37Å; V69-A185 HydrophobicContact CG2-CB 4.31Å
70	A	96.8	Very high	93.1	Very high	3 Å²	3	50.7 Å²	50.7	3%	0.025	29%	0.287	C	S	.	.			trans	-62.5	159	-178.5	0	0	0	0	0	112.1	Y68 R72 F183 P184 L199	Y68-A70 HydrophobicContact CE1-CB 4.05Å; A70-R72 VanDerWaalsContact C-N 3.33Å; A70-R72 PolarHBondContact O-N 3.17Å; A70-F183 WeakPolarHBondContact O-CD1 3.1Å; A70-P184 HydrophobicContact CB-CB 3.89Å; A70-P184 HydrophobicContact CB-CG 4.25Å; A70-P184 WeakPolarHBondContact CB-O 3.43Å; A70-P184 PolarHBondContact N-O 2.91Å; A70-L199 HydrophobicContact CB-CD2 4.3Å
71	S	93.5	Very high	93.4	Very high	39 Å²	39	50.3 Å²	50.3	27%	0.273	28%	0.283	S	S	.	.	S	Bend	trans	-71	-22.7	-176.1	60	0	0	0	0	114.5	Y42	Y42-S71 CarbonylContact C-O 3.55Å; Y42-S71 WeakPolarHBondContact CA-O 3.2Å; Y42-S71 VanDerWaalsContact CB-O 3.28Å; Y42-S71 WeakPolarHBondContact CB-O 3.43Å; Y42-S71 WeakPolarHBondContact CD1-O 3.34Å; Y42-S71 WeakPolarHBondContact O-CB 3.23Å
72	R	92.8	Very high	93.8	Very high	185 Å²	185	45.3 Å²	45.3	70%	0.698	26%	0.256	S	S	*	.	S	Bend	trans	-129.9	145.6	-175	-65.3	-171.7	179.3	-166.1	3.2	111.6	A70 P184	A70-R72 VanDerWaalsContact C-N 3.33Å; A70-R72 PolarHBondContact O-N 3.17Å; R72-P184 WeakPolarHBondContact O-CD 3.47Å
73	P	94.5	Very high	94.8	Very high	23 Å²	23	38.9 Å²	38.9	15%	0.149	21%	0.211	C	C	.	.			trans	-71.7	161.7	171.2	33.4	-34.1	0	0	0	110.2	L182 F183	P73-L182 CarbonylContact C-O 3.55Å; P73-L182 WeakPolarHBondContact CA-O 3.49Å; P73-L182 WeakPolarHBondContact CB-O 3.4Å; P73-F183 HydrophobicContact CB-CD1 4.36Å; P73-F183 HydrophobicContact CB-CD2 4.18Å; P73-F183 HydrophobicContact CB-CE1 4.25Å; P73-F183 HydrophobicContact CB-CE2 4.01Å; P73-F183 HydrophobicContact CB-CG 4.34Å; P73-F183 HydrophobicContact CB-CZ 4.06Å; P73-F183 VanDerWaalsContact CD-CE1 3.47Å; P73-F183 HydrophobicContact CG-CE1 4.34Å; P73-F183 HydrophobicContact CG-CZ 4.13Å
74	L	94.3	Very high	95.4	Very high	5 Å²	5	37.7 Å²	37.7	3%	0.026	19%	0.193	C	C	.	.			trans	-62.9	147.5	166.9	-66	-176.1	0	0	0	110.1	S78 F81 L98 I149 F154 L182 P184	L74-S78 WeakPolarHBondContact CA-O 3.39Å; L74-S78 WeakPolarHBondContact CD2-O 3.2Å; L74-F81 HydrophobicContact CD1-CD1 4.3Å; L74-F81 HydrophobicContact CD2-CD1 4.18Å; L74-L98 HydrophobicContact CD1-CD1 4.04Å; L74-L98 HydrophobicContact CD1-CD2 3.61Å; L74-L98 HydrophobicContact CD1-CG 4.42Å; L74-L98 HydrophobicContact CG-CD2 3.99Å; L74-I149 HydrophobicContact CB-CD1 4.2Å; L74-I149 HydrophobicContact CD1-CD1 4.16Å; L74-I149 HydrophobicContact CD1-CG1 4.02Å; L74-F154 HydrophobicContact CB-CZ 4.44Å; L74-L182 PolarHBondContact N-O 3.23Å; L74-P184 HydrophobicContact CD2-CG 3.72Å; L74-P184 HydrophobicContact CG-CG 4.08Å
75	T	92.6	Very high	95.5	Very high	63 Å²	63	34.8 Å²	34.8	39%	0.387	18%	0.18	S	C	.	.			trans	-124.6	172.1	178.4	69	0	0	0	0	109.8	D77 S78 N79 F154	T75-D77 PolarHBondContact O-N 2.95Å; T75-D77 PolarHBondContact OG1-N 2.87Å; T75-S78 PolarHBondContact N-O 2.94Å; T75-S78 CarbonylContact O-C 3.37Å; T75-S78 PolarHBondContact O-N 3.25Å; T75-S78 PolarHBondContact OG1-N 3.06Å; T75-S78 VanDerWaalsContact OG1-N 3.09Å; T75-N79 WeakPolarHBondContact O-CA 3.49Å; T75-N79 WeakPolarHBondContact O-CB 3.45Å; T75-N79 PolarHBondContact O-N 3.04Å; T75-F154 WeakPolarHBondContact O-CZ 3.35Å
76	K	90.6	Very high	95.4	Very high	94 Å²	94	37.3 Å²	37.3	41%	0.409	20%	0.195	S	C	.	.	S	Bend	trans	-56.9	-34.4	175.6	-166.6	173.5	-166.1	164.2	0	113.3	F154 D155	K76-F154 HydrophobicContact CB-CB 4.2Å; K76-F154 HydrophobicContact CB-CD2 4.17Å; K76-F154 HydrophobicContact CB-CG 4.08Å; K76-F154 HydrophobicContact CD-CB 4.47Å; K76-F154 HydrophobicContact CG-CB 4.36Å; K76-F154 HydrophobicContact CG-CD2 4.39Å; K76-D155 IonicContact NZ-OD1 2.82Å; K76-D155 PolarHBondContact NZ-OD1 2.85Å; K76-D155 IonicContact NZ-OD2 2.72Å; K76-D155 PolarHBondContact NZ-OD2 3.33Å
77	D	88.8	Confident	95.2	Very high	156 Å²	156	40.9 Å²	40.9	83%	0.834	21%	0.214	S	C	*	.	S	Bend	trans	-87.7	-31.3	-178.9	-57.5	-38.3	0	0	0	112.7	T75	T75-D77 PolarHBondContact O-N 2.95Å; T75-D77 PolarHBondContact OG1-N 2.87Å
78	S	91.3	Very high	95	Very high	49 Å²	49	41.9 Å²	41.9	34%	0.343	22%	0.221	S	C	.	.	S	Bend	trans	-121.5	71	176.4	179.5	0	0	0	0	107.4	L74 T75	L74-S78 WeakPolarHBondContact CA-O 3.39Å; L74-S78 WeakPolarHBondContact CD2-O 3.2Å; T75-S78 PolarHBondContact N-O 2.94Å; T75-S78 CarbonylContact O-C 3.37Å; T75-S78 PolarHBondContact O-N 3.25Å; T75-S78 PolarHBondContact OG1-N 3.06Å; T75-S78 VanDerWaalsContact OG1-N 3.09Å
79	N	93.9	Very high	94.8	Very high	31 Å²	31	42.4 Å²	42.4	17%	0.166	23%	0.23	C	C	.	.			trans	-99.1	6	-171.5	69	-54.6	0	0	0	113	T75 G148 I149 F154	T75-N79 WeakPolarHBondContact O-CA 3.49Å; T75-N79 WeakPolarHBondContact O-CB 3.45Å; T75-N79 PolarHBondContact O-N 3.04Å; N79-G148 CarbonylContact O-C 3.58Å; N79-G148 WeakPolarHBondContact O-CA 3.39Å; N79-I149 PolarHBondContact ND2-O 2.79Å; N79-I149 PolarHBondContact O-N 2.9Å; N79-F154 HydrophobicContact CB-CE2 3.83Å; N79-F154 HydrophobicContact CB-CZ 4.31Å
80	Y	96.6	Very high	94.5	Very high	6 Å²	6	47.9 Å²	47.9	2%	0.024	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	140.2	-174.9	-178.4	-111.1	0	0	0	109.6	E82 C147 F162 T164 A201 L203	Y80-E82 HydrophobicContact CE1-CB 4.19Å; Y80-E82 VanDerWaalsContact CE1-CD 3.46Å; Y80-E82 HydrophobicContact CE1-CG 3.71Å; Y80-E82 WeakPolarHBondContact OH-CG 3.35Å; Y80-E82 PolarHBondContact OH-OE1 2.82Å; Y80-C147 WeakPolarHBondContact CD2-O 3.2Å; Y80-F162 AromaticContact CD2-CE2 3.66Å; Y80-F162 HydrophobicContact CD2-CE2 3.66Å; Y80-F162 AromaticContact CD2-CZ 3.78Å; Y80-F162 HydrophobicContact CD2-CZ 3.78Å; Y80-F162 AromaticContact CE2-CE2 3.75Å; Y80-F162 HydrophobicContact CE2-CE2 3.75Å; Y80-F162 HydrophobicContact CE2-CZ 4.34Å; Y80-T164 HydrophobicContact CE2-CG2 4.08Å; Y80-T164 PolarHBondContact OH-OG1 3.45Å; Y80-A201 HydrophobicContact CD1-CB 3.99Å; Y80-A201 HydrophobicContact CE1-CB 4.02Å; Y80-L203 HydrophobicContact CD1-CB 4.19Å; Y80-L203 HydrophobicContact CE1-CB 4.09Å; Y80-L203 HydrophobicContact CE1-CD1 4.08Å; Y80-L203 HydrophobicContact CE2-CD1 4.17Å; Y80-L203 WeakPolarHBondContact OH-CD1 3.28Å
81	F	97.9	Very high	94.3	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	168.1	171	80.2	-78.2	0	0	0	109.3	L74 V83 V96 G97 L98 G146 C147 P184 L197 L199	L74-F81 HydrophobicContact CD1-CD1 4.3Å; L74-F81 HydrophobicContact CD2-CD1 4.18Å; F81-V83 HydrophobicContact CD2-CG2 4.18Å; F81-V83 HydrophobicContact CE2-CG2 3.85Å; F81-V96 HydrophobicContact CE2-CG1 3.74Å; F81-V96 HydrophobicContact CZ-CG1 3.82Å; F81-G97 WeakPolarHBondContact CZ-O 3.1Å; F81-L98 HydrophobicContact CE1-CD2 3.95Å; F81-G146 WeakPolarHBondContact O-CA 3.39Å; F81-C147 HydrophobicContact CD1-CB 4.23Å; F81-C147 VanDerWaalsContact CD1-O 3.28Å; F81-C147 WeakPolarHBondContact CD1-O 3.34Å; F81-C147 HydrophobicContact CE1-CB 3.54Å; F81-C147 HydrophobicContact CZ-CB 3.88Å; F81-C147 PolarHBondContact N-O 2.86Å; F81-C147 PolarHBondContact O-N 3.27Å; F81-P184 HydrophobicContact CD1-CB 3.82Å; F81-P184 HydrophobicContact CD1-CG 3.82Å; F81-P184 HydrophobicContact CD2-CB 3.98Å; F81-P184 HydrophobicContact CE1-CB 3.72Å; F81-P184 HydrophobicContact CE1-CG 4.07Å; F81-P184 HydrophobicContact CE2-CB 3.9Å; F81-P184 HydrophobicContact CG-CB 3.93Å; F81-P184 HydrophobicContact CG-CG 4.11Å; F81-P184 HydrophobicContact CZ-CB 3.77Å; F81-L197 HydrophobicContact CD2-CD1 3.75Å; F81-L197 HydrophobicContact CE2-CD1 4.11Å; F81-L199 HydrophobicContact CB-CD2 4.19Å
82	E	98.2	Very high	94.4	Very high	15 Å²	15	52.6 Å²	52.6	7%	0.07	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	140.5	-161.9	-131.2	-174.5	-167.5	0	0	109.3	Y80 R144 I145 H198 A201	Y80-E82 HydrophobicContact CE1-CB 4.19Å; Y80-E82 VanDerWaalsContact CE1-CD 3.46Å; Y80-E82 HydrophobicContact CE1-CG 3.71Å; Y80-E82 WeakPolarHBondContact OH-CG 3.35Å; Y80-E82 PolarHBondContact OH-OE1 2.82Å; E82-R144 VanDerWaalsContact CB-CZ 3.41Å; E82-R144 VanDerWaalsContact CD-NE 3.33Å; E82-R144 HydrophobicContact CG-CG 4Å; E82-R144 WeakPolarHBondContact OE1-CD 3.12Å; E82-R144 IonicContact OE1-CZ 2.83Å; E82-R144 IonicContact OE1-NE 3.75Å; E82-R144 IonicContact OE2-CZ 3.14Å; E82-R144 IonicContact OE2-NE 3.23Å; E82-R144 PolarHBondContact OE2-NE 2.63Å; E82-R144 IonicContact OE2-NH1 3.74Å; E82-R144 PolarHBondContact OE2-NH1 3.27Å; E82-R144 IonicContact OE2-NH2 3.27Å; E82-R144 PolarHBondContact OE2-NH2 3.11Å; E82-I145 CarbonylContact C-O 3.58Å; E82-I145 WeakPolarHBondContact CA-O 3.18Å; E82-H198 HydrophobicContact CB-CB 4.43Å; E82-H198 PolarHBondContact N-O 2.94Å; E82-H198 WeakPolarHBondContact O-CA 3.35Å; E82-H198 VanDerWaalsContact O-CB 3.3Å; E82-H198 WeakPolarHBondContact O-CB 3.31Å; E82-H198 PolarHBondContact O-CD2 3.16Å; E82-H198 PolarHBondContact O-N 2.87Å; E82-A201 HydrophobicContact CB-CB 3.4Å; E82-A201 HydrophobicContact CG-CB 4.23Å; E82-A201 WeakPolarHBondContact OE2-CB 3.42Å
83	V	98.5	Very high	94.6	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	122.2	-173.8	178.5	0	0	0	0	109	F81 V96 R144 I145 V186 V195 R196 L197	F81-V83 HydrophobicContact CD2-CG2 4.18Å; F81-V83 HydrophobicContact CE2-CG2 3.85Å; V83-V96 HydrophobicContact CB-CG1 4.22Å; V83-V96 HydrophobicContact CB-CG2 3.87Å; V83-V96 HydrophobicContact CG1-CG2 4.06Å; V83-V96 HydrophobicContact CG2-CG1 3.68Å; V83-V96 HydrophobicContact CG2-CG2 3.97Å; V83-R144 CarbonylContact O-C 3.58Å; V83-R144 VanDerWaalsContact O-CA 3.26Å; V83-R144 WeakPolarHBondContact O-CA 3.49Å; V83-I145 PolarHBondContact N-O 2.97Å; V83-I145 PolarHBondContact O-N 2.65Å; V83-V186 HydrophobicContact CG2-CG2 3.85Å; V83-V195 HydrophobicContact CG1-CB 3.58Å; V83-V195 HydrophobicContact CG1-CG1 3.98Å; V83-V195 HydrophobicContact CG1-CG2 3.7Å; V83-R196 CarbonylContact C-O 3.52Å; V83-R196 WeakPolarHBondContact CA-O 3.14Å; V83-L197 HydrophobicContact CG2-CD1 3.8Å
84	S	98	Very high	94.8	Very high	31 Å²	31	43.1 Å²	43.1	22%	0.217	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	126.5	174.9	-61.5	0	0	0	0	109.8	V86 V195 R196 H198	S84-V86 PolarHBondContact O-N 3.33Å; S84-V195 CarbonylContact O-C 3.46Å; S84-V195 WeakPolarHBondContact O-CA 3.4Å; S84-V195 WeakPolarHBondContact O-CB 3.42Å; S84-R196 PolarHBondContact N-O 3.37Å; S84-R196 PolarHBondContact O-N 2.8Å; S84-H198 PolarHBondContact OG-NE2 2.73Å
85	I	97.2	Very high	95	Very high	4 Å²	4	42.9 Å²	42.9	2%	0.021	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	109.9	176.6	-55.4	176.1	0	0	0	108.2	I94 A120 C139 G142 D143 I145 V195	I85-I94 HydrophobicContact CD1-CD1 4.43Å; I85-I94 HydrophobicContact CG1-CD1 4.31Å; I85-I94 HydrophobicContact CG2-CD1 3.7Å; I85-A120 HydrophobicContact CD1-CB 4.11Å; I85-C139 HydrophobicContact CD1-CB 3.7Å; I85-G142 PolarHBondContact O-N 3.01Å; I85-D143 PolarHBondContact N-O 3.23Å; I85-I145 HydrophobicContact CD1-CD1 4.23Å; I85-V195 HydrophobicContact CG1-CG1 4.47Å
86	V	95	Very high	95.3	Very high	66 Å²	66	39.9 Å²	39.9	40%	0.4	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	-50.5	176.7	-179.9	0	0	0	0	109	S84 E194 R196	S84-V86 PolarHBondContact O-N 3.33Å; V86-E194 WeakPolarHBondContact CA-O 3.45Å; V86-E194 HydrophobicContact CB-CB 4.26Å; V86-E194 HydrophobicContact CB-CG 4.08Å; V86-E194 WeakPolarHBondContact CB-O 3.49Å; V86-E194 HydrophobicContact CG1-CG 4.44Å; V86-E194 HydrophobicContact CG2-CG 4.46Å; V86-E194 PolarHBondContact N-O 2.91Å; V86-R196 HydrophobicContact CG2-CB 4.49Å; V86-R196 HydrophobicContact CG2-CG 3.75Å
87	D	93.9	Very high	95.7	Very high	74 Å²	74	35.4 Å²	35.4	40%	0.396	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	130.8	175.3	-166.1	-16.5	0	0	0	109.7	G89 G192 E193 E194	D87-G89 VanDerWaalsContact C-N 3.25Å; D87-G89 PolarHBondContact OD1-N 2.91Å; D87-G192 VanDerWaalsContact CB-O 3.3Å; D87-G192 WeakPolarHBondContact CB-O 3.18Å; D87-E193 WeakPolarHBondContact O-CA 3.4Å; D87-E194 HydrophobicContact CB-CB 4.34Å; D87-E194 PolarHBondContact N-O 2.91Å; D87-E194 PolarHBondContact O-N 2.83Å
88	S	94.6	Very high	96.1	Very high	21 Å²	21	28 Å²	28	15%	0.147	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	-11.1	176.5	52.8	0	0	0	0	112.6	G92 S141 E193	S88-G92 WeakPolarHBondContact O-CA 3.3Å; S88-G92 PolarHBondContact O-N 2.89Å; S88-S141 PolarHBondContact N-OG 2.9Å; S88-S141 PolarHBondContact OG-OG 2.92Å; S88-E193 WeakPolarHBondContact O-CG 3.34Å
89	G	93.1	Very high	96.4	Very high	23 Å²	23	25.7 Å²	25.7	24%	0.237	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.2	-155.7	-178.9	0	0	0	0	0	113	D87 R91 L191 G192	D87-G89 VanDerWaalsContact C-N 3.25Å; D87-G89 PolarHBondContact OD1-N 2.91Å; G89-R91 PolarHBondContact O-N 2.91Å; G89-L191 CarbonylContact C-O 3.51Å; G89-L191 WeakPolarHBondContact CA-O 3.28Å; G89-G192 VanDerWaalsContact CA-C 3.5Å
90	V	92.8	Very high	96.5	Very high	117 Å²	117	25.8 Å²	25.8	71%	0.709	15%	0.146	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70	-33.5	-174	177.9	0	0	0	0	112.8	S190 L191	V90-S190 PolarHBondContact N-OG 3.43Å; V90-L191 HydrophobicContact CG2-CB 4.29Å; V90-L191 PolarHBondContact N-O 2.76Å
91	R	92.6	Very high	96.3	Very high	136 Å²	136	27.7 Å²	27.7	51%	0.513	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-123.3	-14.5	-171.6	-61.6	172	60.6	-146.2	-0.1	114.9	G89 T93 H189 S190	G89-R91 PolarHBondContact O-N 2.91Å; R91-T93 HydrophobicContact CB-CG2 3.84Å; R91-T93 PolarHBondContact O-N 3.34Å; R91-H189 PolarHBondContact NH1-ND1 2.84Å; R91-H189 PolarHBondContact NH1-O 3.06Å; R91-S190 PolarHBondContact N-OG 3.39Å
92	G	94.5	Very high	96	Very high	5 Å²	5	35.3 Å²	35.3	5%	0.052	19%	0.185	C	C	.	.			trans	66	20.9	-175.5	0	0	0	0	0	114.1	S88 I94 D121	S88-G92 WeakPolarHBondContact O-CA 3.3Å; S88-G92 PolarHBondContact O-N 2.89Å; G92-I94 PolarHBondContact O-N 2.94Å; G92-D121 WeakPolarHBondContact O-CB 3.41Å; G92-D121 PolarHBondContact O-N 2.82Å
93	T	97.4	Very high	95.9	Very high	10 Å²	10	35 Å²	35	6%	0.061	18%	0.183	C	C	.	.			trans	-80.6	55.8	-173.3	40.9	0	0	0	0	112.7	R91 Q108 D121 H189 E193	R91-T93 HydrophobicContact CB-CG2 3.84Å; R91-T93 PolarHBondContact O-N 3.34Å; T93-Q108 PolarHBondContact O-NE2 2.77Å; T93-D121 HydrophobicContact CG2-CB 4.02Å; T93-H189 PolarHBondContact O-N 3.33Å; T93-H189 WeakPolarHBondContact OG1-CB 3.46Å; T93-E193 WeakPolarHBondContact CA-OE1 3.42Å; T93-E193 PolarHBondContact N-OE1 2.75Å; T93-E193 PolarHBondContact OG1-OE1 2.84Å
94	I	98.6	Very high	95.8	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.196	C	C	.	.			trans	-99	126.6	-178.9	-59.3	168.3	0	0	0	109	I85 G92 V96 A120 G187 M188 E193 V195	I85-I94 HydrophobicContact CD1-CD1 4.43Å; I85-I94 HydrophobicContact CG1-CD1 4.31Å; I85-I94 HydrophobicContact CG2-CD1 3.7Å; G92-I94 PolarHBondContact O-N 2.94Å; I94-V96 HydrophobicContact CG2-CG2 4.41Å; I94-A120 HydrophobicContact CB-CB 4.12Å; I94-A120 WeakPolarHBondContact O-CB 3.31Å; I94-A120 PolarHBondContact O-N 3.24Å; I94-G187 CarbonylContact C-O 3.59Å; I94-G187 VanDerWaalsContact CA-O 3.28Å; I94-G187 WeakPolarHBondContact CA-O 3.26Å; I94-M188 HydrophobicContact CG1-CG 4.23Å; I94-E193 HydrophobicContact CD1-CB 4.35Å; I94-E193 HydrophobicContact CD1-CG 4.18Å; I94-E193 HydrophobicContact CG1-CB 4.25Å; I94-E193 HydrophobicContact CG1-CG 3.96Å; I94-V195 HydrophobicContact CD1-CG1 3.87Å; I94-V195 HydrophobicContact CG2-CG1 3.97Å
95	A	98.8	Very high	95.8	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	136.5	175.5	0	0	0	0	0	111	Q108 A117 H119 V186 G187	A95-Q108 HydrophobicContact CB-CB 4.41Å; A95-A117 HydrophobicContact CB-CB 4.42Å; A95-H119 VanDerWaalsContact CB-CD2 3.48Å; A95-H119 WeakPolarHBondContact CB-CD2 3.45Å; A95-H119 VanDerWaalsContact CB-NE2 3.33Å; A95-H119 WeakPolarHBondContact CB-NE2 3.44Å; A95-V186 CarbonylContact O-C 3.59Å; A95-V186 VanDerWaalsContact O-CA 3.26Å; A95-V186 WeakPolarHBondContact O-CA 3.49Å; A95-G187 PolarHBondContact N-O 3.27Å; A95-G187 PolarHBondContact O-N 3.14Å
96	V	98.8	Very high	95.7	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	129.4	178.4	-179.4	0	0	0	0	109.2	F81 V83 I94 A117 Y118 I145 F163	F81-V96 HydrophobicContact CE2-CG1 3.74Å; F81-V96 HydrophobicContact CZ-CG1 3.82Å; V83-V96 HydrophobicContact CB-CG1 4.22Å; V83-V96 HydrophobicContact CB-CG2 3.87Å; V83-V96 HydrophobicContact CG1-CG2 4.06Å; V83-V96 HydrophobicContact CG2-CG1 3.68Å; V83-V96 HydrophobicContact CG2-CG2 3.97Å; I94-V96 HydrophobicContact CG2-CG2 4.41Å; V96-A117 CarbonylContact O-C 3.59Å; V96-A117 VanDerWaalsContact O-CA 3.29Å; V96-A117 WeakPolarHBondContact O-CA 3.32Å; V96-A117 WeakPolarHBondContact O-CB 3.39Å; V96-Y118 PolarHBondContact N-O 2.92Å; V96-Y118 PolarHBondContact O-N 3.4Å; V96-I145 HydrophobicContact CB-CB 4.28Å; V96-I145 HydrophobicContact CB-CG2 3.79Å; V96-I145 HydrophobicContact CG1-CB 4.5Å; V96-I145 HydrophobicContact CG1-CG2 4.03Å; V96-I145 HydrophobicContact CG2-CB 4.13Å; V96-I145 HydrophobicContact CG2-CD1 4.1Å; V96-I145 HydrophobicContact CG2-CG2 4.19Å; V96-F163 WeakPolarHBondContact O-CE1 3.14Å
97	G	98.5	Very high	95.9	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	179.4	-156.3	-177.9	0	0	0	0	0	115.8	F81 V116 A185	F81-G97 WeakPolarHBondContact CZ-O 3.1Å; G97-V116 CarbonylContact C-O 3.57Å; G97-V116 VanDerWaalsContact CA-O 3.25Å; G97-V116 WeakPolarHBondContact CA-O 3.39Å; G97-A185 PolarHBondContact N-O 3.01Å; G97-A185 PolarHBondContact O-N 2.97Å
98	L	98.5	Very high	96.1	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	136.5	-175.8	-66.6	171.9	0	0	0	111.1	L74 F81 S115 V116 I149 I161 L182 F183 P184	L74-L98 HydrophobicContact CD1-CD1 4.04Å; L74-L98 HydrophobicContact CD1-CD2 3.61Å; L74-L98 HydrophobicContact CD1-CG 4.42Å; L74-L98 HydrophobicContact CG-CD2 3.99Å; F81-L98 HydrophobicContact CE1-CD2 3.95Å; L98-S115 VanDerWaalsContact O-CA 3.3Å; L98-S115 WeakPolarHBondContact O-CA 3.49Å; L98-S115 WeakPolarHBondContact O-CB 3.38Å; L98-V116 HydrophobicContact CB-CG1 4.31Å; L98-V116 PolarHBondContact N-O 3.1Å; L98-V116 PolarHBondContact O-N 2.91Å; L98-I149 HydrophobicContact CD1-CD1 3.91Å; L98-I149 HydrophobicContact CD1-CG1 3.73Å; L98-I161 HydrophobicContact CD1-CD1 4.1Å; L98-I161 HydrophobicContact CD1-CG1 4.14Å; L98-I161 HydrophobicContact CD1-CG2 3.97Å; L98-L182 HydrophobicContact CB-CB 4.17Å; L98-L182 HydrophobicContact CB-CD2 4.38Å; L98-L182 HydrophobicContact CD1-CB 4.32Å; L98-L182 HydrophobicContact CD1-CD1 4.3Å; L98-L182 HydrophobicContact CD2-CB 4.43Å; L98-F183 WeakPolarHBondContact CA-O 3.38Å; L98-P184 HydrophobicContact CD2-CG 4.49Å
99	V	97.8	Very high	96.3	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	-134.9	158.2	-177.3	-58.4	0	0	0	0	111.1	V69 Y103 P109 F183 A185	V69-V99 HydrophobicContact CB-CG2 4.41Å; V69-V99 HydrophobicContact CG1-CG2 3.68Å; V69-V99 HydrophobicContact CG2-CG2 3.85Å; V99-Y103 HydrophobicContact CB-CD1 4.2Å; V99-Y103 HydrophobicContact CB-CD2 3.85Å; V99-Y103 HydrophobicContact CB-CE2 4.41Å; V99-Y103 HydrophobicContact CB-CG 3.69Å; V99-Y103 HydrophobicContact CG1-CD1 3.83Å; V99-Y103 HydrophobicContact CG1-CD2 4.01Å; V99-Y103 HydrophobicContact CG1-CE1 4.02Å; V99-Y103 HydrophobicContact CG1-CE2 4.14Å; V99-Y103 HydrophobicContact CG1-CG 3.81Å; V99-Y103 HydrophobicContact CG2-CG 4.23Å; V99-P109 HydrophobicContact CG1-CB 3.87Å; V99-P109 HydrophobicContact CG1-CG 4.25Å; V99-F183 HydrophobicContact CG2-CB 4.37Å; V99-F183 PolarHBondContact N-O 2.99Å; V99-F183 PolarHBondContact O-N 3.31Å; V99-A185 HydrophobicContact CB-CB 4.3Å; V99-A185 HydrophobicContact CG1-CB 3.68Å; V99-A185 HydrophobicContact CG2-CB 3.66Å
100	P	95	Very high	96.5	Very high	33 Å²	33	35.1 Å²	35.1	21%	0.214	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	160.9	170.8	31.5	-36.7	0	0	0	111.2	Y102 Y103 D114	P100-Y102 PolarHBondContact O-N 3Å; P100-Y103 HydrophobicContact CG-CD2 4.06Å; P100-Y103 PolarHBondContact O-N 2.97Å; P100-Y103 VanDerWaalsContact O-N 3.12Å; P100-D114 WeakPolarHBondContact CD-O 3.34Å; P100-D114 HydrophobicContact CG-CB 4.43Å
101	Q	92.1	Very high	96.8	Very high	47 Å²	47	32.7 Å²	32.7	22%	0.22	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.4	-36.7	-177.4	-173.1	177.5	13.2	0	0	114.7	R41 R45 F183	R41-Q101 PolarHBondContact O-NE2 2.89Å; R45-Q101 PolarHBondContact NE-O 3.24Å; R45-Q101 PolarHBondContact NH2-O 3.36Å; Q101-F183 HydrophobicContact CB-CD2 4.25Å; Q101-F183 HydrophobicContact CB-CE2 3.61Å; Q101-F183 HydrophobicContact CB-CZ 4.05Å; Q101-F183 HydrophobicContact CG-CE2 4.1Å; Q101-F183 HydrophobicContact CG-CZ 4.02Å
102	Y	91.8	Very high	97	Very high	160 Å²	160	28.6 Å²	28.6	63%	0.627	14%	0.138	S	C	*	.	T	Hydrogen-bonded Turn	trans	-112.1	41.5	-175.9	-60.9	-67.8	0	0	0	112.9	P100	P100-Y102 PolarHBondContact O-N 3Å
103	Y	96.2	Very high	97.1	Very high	7 Å²	7	32.3 Å²	32.3	3%	0.027	16%	0.162	C	C	.	.			trans	-61.9	147.1	171.2	-155.1	-110.7	0	0	0	112.6	R45 V99 P100 Q108 G110 W111 L112 S115	R45-Y103 PolarHBondContact NH1-O 2.83Å; R45-Y103 VanDerWaalsContact NH2-N 3.16Å; R45-Y103 PolarHBondContact NH2-O 2.88Å; R45-Y103 VanDerWaalsContact NH2-O 3.1Å; V99-Y103 HydrophobicContact CB-CD1 4.2Å; V99-Y103 HydrophobicContact CB-CD2 3.85Å; V99-Y103 HydrophobicContact CB-CE2 4.41Å; V99-Y103 HydrophobicContact CB-CG 3.69Å; V99-Y103 HydrophobicContact CG1-CD1 3.83Å; V99-Y103 HydrophobicContact CG1-CD2 4.01Å; V99-Y103 HydrophobicContact CG1-CE1 4.02Å; V99-Y103 HydrophobicContact CG1-CE2 4.14Å; V99-Y103 HydrophobicContact CG1-CG 3.81Å; V99-Y103 HydrophobicContact CG2-CG 4.23Å; P100-Y103 HydrophobicContact CG-CD2 4.06Å; P100-Y103 PolarHBondContact O-N 2.97Å; P100-Y103 VanDerWaalsContact O-N 3.12Å; Y103-Q108 PolarHBondContact OH-O 2.86Å; Y103-G110 PolarHBondContact OH-N 2.98Å; Y103-W111 PolarHBondContact OH-N 2.82Å; Y103-L112 HydrophobicContact CE2-CB 3.66Å; Y103-L112 HydrophobicContact CE2-CD1 4.33Å; Y103-L112 HydrophobicContact CE2-CG 4.4Å; Y103-L112 PolarHBondContact OH-N 2.87Å; Y103-L112 VanDerWaalsContact OH-N 3.08Å; Y103-S115 VanDerWaalsContact CE2-CB 3.42Å; Y103-S115 VanDerWaalsContact CE2-OG 3.22Å; Y103-S115 WeakPolarHBondContact CE2-OG 3.41Å; Y103-S115 PolarHBondContact OH-OG 2.92Å
104	S	96.8	Very high	97	Very high	38 Å²	38	36.6 Å²	36.6	27%	0.266	18%	0.184	S	C	.	.			trans	-67.6	134.7	172.6	172.1	0	0	0	0	109.9	D106 H107	S104-D106 VanDerWaalsContact C-N 3.28Å; S104-D106 PolarHBondContact OG-N 3.03Å; S104-H107 PolarHBondContact OG-ND1 2.9Å
105	L	97.3	Very high	96.9	Very high	34 Å²	34	36.6 Å²	36.6	18%	0.178	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.1	3.3	179.3	-57.4	174.6	0	0	0	113.2	R45 K47 C67 V69	R45-L105 HydrophobicContact CB-CD1 4.13Å; R45-L105 HydrophobicContact CB-CD2 4.17Å; K47-L105 HydrophobicContact CB-CB 3.71Å; K47-L105 HydrophobicContact CB-CD1 4.3Å; C67-L105 HydrophobicContact CB-CB 4.43Å; C67-L105 HydrophobicContact CB-CD2 4.44Å; C67-L105 WeakPolarHBondContact CB-O 3.47Å; V69-L105 HydrophobicContact CG2-CD2 3.94Å
106	D	96.2	Very high	96.9	Very high	78 Å²	78	36.6 Å²	36.6	42%	0.417	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.3	7.4	-179.7	-52.2	-69.1	0	0	0	112.3	K47 S104	K47-D106 WeakPolarHBondContact CD-OD1 3.47Å; K47-D106 WeakPolarHBondContact CE-OD1 3.37Å; K47-D106 IonicContact NZ-OD1 3.2Å; K47-D106 PolarHBondContact NZ-OD1 3.29Å; S104-D106 VanDerWaalsContact C-N 3.28Å; S104-D106 PolarHBondContact OG-N 3.03Å
107	H	98.1	Very high	96.9	Very high	70 Å²	70	36.6 Å²	36.6	32%	0.324	19%	0.185	S	C	.	.	S	Bend	trans	-132.3	146.4	-177.6	-66.5	80.2	0	0	0	110.1	S104 W111 L112	S104-H107 PolarHBondContact OG-ND1 2.9Å; H107-W111 HydrophobicContact CB-CE3 4.48Å; H107-L112 HydrophobicContact CB-CD1 3.89Å; H107-L112 HydrophobicContact CB-CG 4.04Å
108	Q	98.4	Very high	96.9	Very high	3 Å²	3	36.6 Å²	36.6	1%	0.014	19%	0.185	C	C	.	.			trans	-65.6	139.6	172.9	-70.1	-73.2	-4.2	0	0	109.9	V65 T93 A95 Y103 G110 W111 G187 M188	V65-Q108 HydrophobicContact CG1-CG 3.95Å; T93-Q108 PolarHBondContact O-NE2 2.77Å; A95-Q108 HydrophobicContact CB-CB 4.41Å; Y103-Q108 PolarHBondContact OH-O 2.86Å; Q108-G110 PolarHBondContact O-N 3.03Å; Q108-W111 HydrophobicContact CB-CD2 3.71Å; Q108-W111 HydrophobicContact CB-CE3 4.07Å; Q108-W111 HydrophobicContact CB-CG 4.05Å; Q108-W111 HydrophobicContact CB-CH2 4.35Å; Q108-W111 HydrophobicContact CB-CZ2 4.01Å; Q108-W111 HydrophobicContact CB-CZ3 4.38Å; Q108-W111 HydrophobicContact CG-CD2 4.28Å; Q108-W111 HydrophobicContact CG-CE3 4.36Å; Q108-W111 HydrophobicContact CG-CH2 3.84Å; Q108-W111 HydrophobicContact CG-CZ2 3.74Å; Q108-W111 HydrophobicContact CG-CZ3 4.16Å; Q108-W111 WeakPolarHBondContact O-CB 3.5Å; Q108-W111 PolarHBondContact O-N 2.83Å; Q108-W111 VanDerWaalsContact O-N 3.12Å; Q108-G187 PolarHBondContact OE1-O 3.23Å; Q108-M188 PolarHBondContact NE2-O 3.45Å
109	P	98.5	Very high	96.9	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-46.4	138.8	166.8	-29.7	37.1	0	0	0	111.7	V99 A117 H119 A185	V99-P109 HydrophobicContact CG1-CB 3.87Å; V99-P109 HydrophobicContact CG1-CG 4.25Å; P109-A117 VanDerWaalsContact C-CB 3.44Å; P109-A117 HydrophobicContact CB-CB 3.7Å; P109-A117 WeakPolarHBondContact O-CB 3.3Å; P109-H119 PolarHBondContact O-NE2 2.86Å; P109-A185 HydrophobicContact CB-CB 4.31Å; P109-A185 HydrophobicContact CG-CB 3.76Å
110	G	98.2	Very high	96.9	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.4	-14.5	-176.5	0	0	0	0	0	115.5	Y103 Q108 S115 Y126 N127 G128 R129	Y103-G110 PolarHBondContact OH-N 2.98Å; Q108-G110 PolarHBondContact O-N 3.03Å; G110-S115 VanDerWaalsContact CA-OG 3.23Å; G110-S115 WeakPolarHBondContact CA-OG 3.34Å; G110-S115 PolarHBondContact N-OG 3.02Å; G110-Y126 WeakPolarHBondContact CA-O 3.49Å; G110-Y126 CarbonylContact O-C 3.44Å; G110-N127 PolarHBondContact O-N 3.14Å; G110-G128 PolarHBondContact O-N 2.85Å; G110-R129 PolarHBondContact O-N 3.24Å
111	W	98.2	Very high	97	Very high	66 Å²	66	37.7 Å²	37.7	25%	0.25	19%	0.188	C	C	.	.	S	Bend	trans	-80.7	-29.3	-179.9	-74.8	7	0	0	0	114.6	V65 Y103 H107 Q108 H119 Y126 G128 R129 A130	V65-W111 HydrophobicContact CG2-CZ3 4.36Å; Y103-W111 PolarHBondContact OH-N 2.82Å; H107-W111 HydrophobicContact CB-CE3 4.48Å; Q108-W111 HydrophobicContact CB-CD2 3.71Å; Q108-W111 HydrophobicContact CB-CE3 4.07Å; Q108-W111 HydrophobicContact CB-CG 4.05Å; Q108-W111 HydrophobicContact CB-CH2 4.35Å; Q108-W111 HydrophobicContact CB-CZ2 4.01Å; Q108-W111 HydrophobicContact CB-CZ3 4.38Å; Q108-W111 HydrophobicContact CG-CD2 4.28Å; Q108-W111 HydrophobicContact CG-CE3 4.36Å; Q108-W111 HydrophobicContact CG-CH2 3.84Å; Q108-W111 HydrophobicContact CG-CZ2 3.74Å; Q108-W111 HydrophobicContact CG-CZ3 4.16Å; Q108-W111 WeakPolarHBondContact O-CB 3.5Å; Q108-W111 PolarHBondContact O-N 2.83Å; Q108-W111 VanDerWaalsContact O-N 3.12Å; W111-H119 AromaticContact CD1-CE1 3.82Å; W111-H119 AromaticContact NE1-CE1 3.29Å; W111-H119 PolarHBondContact NE1-CE1 2.79Å; W111-H119 VanDerWaalsContact NE1-CE1 3.29Å; W111-H119 AromaticContact NE1-ND1 4Å; W111-Y126 AromaticContact CD1-CD1 3.54Å; W111-Y126 AromaticContact NE1-CD1 3.65Å; W111-Y126 AromaticContact NE1-CE1 3.73Å; W111-G128 CarbonylContact O-C 3.52Å; W111-R129 CarbonylContact O-C 3.45Å; W111-R129 WeakPolarHBondContact O-CA 3.5Å; W111-R129 PolarHBondContact O-N 2.86Å; W111-R129 VanDerWaalsContact O-N 3.14Å; W111-A130 HydrophobicContact CD2-CB 4.27Å; W111-A130 HydrophobicContact CG-CB 4.17Å
112	L	97.9	Very high	97.3	Very high	49 Å²	49	36.5 Å²	36.5	26%	0.257	18%	0.183	S	C	.	.	S	Bend	trans	-106.6	156.7	178.7	-56.9	176.7	0	0	0	111.6	Y103 H107 S115 G128	Y103-L112 HydrophobicContact CE2-CB 3.66Å; Y103-L112 HydrophobicContact CE2-CD1 4.33Å; Y103-L112 HydrophobicContact CE2-CG 4.4Å; Y103-L112 PolarHBondContact OH-N 2.87Å; Y103-L112 VanDerWaalsContact OH-N 3.08Å; H107-L112 HydrophobicContact CB-CD1 3.89Å; H107-L112 HydrophobicContact CB-CG 4.04Å; L112-S115 PolarHBondContact O-OG 2.8Å; L112-G128 VanDerWaalsContact O-CA 3.32Å; L112-G128 WeakPolarHBondContact O-CA 3.34Å
113	P	96.1	Very high	97.5	Very high	84 Å²	84	28.9 Å²	28.9	55%	0.545	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.1	156.5	-179.1	-29.6	36.4	0	0	0	114.9	S115	P113-S115 PolarHBondContact O-N 3.04Å; P113-S115 VanDerWaalsContact O-N 3.09Å
114	D	94.9	Very high	97.6	Very high	99 Å²	99	31.6 Å²	31.6	53%	0.529	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.8	19.1	178	-50	-40.8	0	0	0	114.7	P100 M175 M177	P100-D114 WeakPolarHBondContact CD-O 3.34Å; P100-D114 HydrophobicContact CG-CB 4.43Å; D114-M175 WeakPolarHBondContact O-CE 3.34Å; D114-M177 HydrophobicContact CB-CE 4.22Å; D114-M177 HydrophobicContact CB-SD 3.93Å
115	S	97.6	Very high	97.6	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.007	15%	0.154	C	C	.	.			trans	-126.1	156.1	173.4	70.8	0	0	0	0	112	L98 Y103 G110 L112 P113 N127 G128	L98-S115 VanDerWaalsContact O-CA 3.3Å; L98-S115 WeakPolarHBondContact O-CA 3.49Å; L98-S115 WeakPolarHBondContact O-CB 3.38Å; Y103-S115 VanDerWaalsContact CE2-CB 3.42Å; Y103-S115 VanDerWaalsContact CE2-OG 3.22Å; Y103-S115 WeakPolarHBondContact CE2-OG 3.41Å; Y103-S115 PolarHBondContact OH-OG 2.92Å; G110-S115 VanDerWaalsContact CA-OG 3.23Å; G110-S115 WeakPolarHBondContact CA-OG 3.34Å; G110-S115 PolarHBondContact N-OG 3.02Å; L112-S115 PolarHBondContact O-OG 2.8Å; P113-S115 PolarHBondContact O-N 3.04Å; P113-S115 VanDerWaalsContact O-N 3.09Å; S115-N127 CarbonylContact O-C 3.51Å; S115-N127 WeakPolarHBondContact O-CA 3.21Å; S115-G128 PolarHBondContact O-N 3.05Å
116	V	98.4	Very high	97.7	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	141	174.6	63.3	0	0	0	0	110.3	G97 L98 L125 Y126 N127 I161 F163 T173 M175	G97-V116 CarbonylContact C-O 3.57Å; G97-V116 VanDerWaalsContact CA-O 3.25Å; G97-V116 WeakPolarHBondContact CA-O 3.39Å; L98-V116 HydrophobicContact CB-CG1 4.31Å; L98-V116 PolarHBondContact N-O 3.1Å; L98-V116 PolarHBondContact O-N 2.91Å; V116-L125 HydrophobicContact CG2-CD1 3.64Å; V116-L125 HydrophobicContact CG2-CG 4.25Å; V116-Y126 CarbonylContact C-O 3.57Å; V116-Y126 VanDerWaalsContact CA-O 3.24Å; V116-Y126 WeakPolarHBondContact CA-O 3.13Å; V116-N127 HydrophobicContact CB-CB 4.49Å; V116-N127 HydrophobicContact CG2-CB 4.18Å; V116-I161 HydrophobicContact CG1-CB 4.5Å; V116-I161 HydrophobicContact CG1-CD1 3.45Å; V116-I161 VanDerWaalsContact CG1-CD1 3.45Å; V116-I161 HydrophobicContact CG1-CG2 4.03Å; V116-F163 HydrophobicContact CG1-CZ 4.31Å; V116-F163 HydrophobicContact CG2-CE2 3.94Å; V116-F163 HydrophobicContact CG2-CZ 4.01Å; V116-T173 HydrophobicContact CG2-CG2 3.88Å; V116-M175 HydrophobicContact CB-SD 3.77Å; V116-M175 HydrophobicContact CG1-SD 3.61Å
117	A	98.8	Very high	97.7	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	154.4	175.4	0	0	0	0	0	113.1	A95 V96 P109 Y126	A95-A117 HydrophobicContact CB-CB 4.42Å; V96-A117 CarbonylContact O-C 3.59Å; V96-A117 VanDerWaalsContact O-CA 3.29Å; V96-A117 WeakPolarHBondContact O-CA 3.32Å; V96-A117 WeakPolarHBondContact O-CB 3.39Å; P109-A117 VanDerWaalsContact C-CB 3.44Å; P109-A117 HydrophobicContact CB-CB 3.7Å; P109-A117 WeakPolarHBondContact O-CB 3.3Å; A117-Y126 PolarHBondContact N-O 3.05Å; A117-Y126 PolarHBondContact O-N 3.21Å
118	Y	98.6	Very high	97.5	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	127.9	169.2	-174.6	-119.1	0	0	0	109.6	V96 G123 F135 G136 S137 I145	V96-Y118 PolarHBondContact N-O 2.92Å; V96-Y118 PolarHBondContact O-N 3.4Å; Y118-G123 VanDerWaalsContact CE2-O 3.29Å; Y118-G123 WeakPolarHBondContact CE2-O 3.29Å; Y118-F135 AromaticContact CD2-CD1 3.65Å; Y118-F135 HydrophobicContact CD2-CD1 3.65Å; Y118-F135 HydrophobicContact CD2-CE1 4.21Å; Y118-F135 AromaticContact CE2-CD1 3.7Å; Y118-F135 HydrophobicContact CE2-CD1 3.7Å; Y118-F135 HydrophobicContact CE2-CE1 4.47Å; Y118-G136 VanDerWaalsContact OH-C 3.31Å; Y118-G136 WeakPolarHBondContact OH-CA 3.38Å; Y118-S137 PolarHBondContact OH-N 2.84Å; Y118-S137 VanDerWaalsContact OH-N 3.14Å; Y118-S137 PolarHBondContact OH-O 2.95Å; Y118-I145 HydrophobicContact CD1-CD1 4.08Å; Y118-I145 HydrophobicContact CD1-CG1 4.24Å; Y118-I145 HydrophobicContact CD1-CG2 3.77Å; Y118-I145 HydrophobicContact CE1-CD1 4.46Å; Y118-I145 HydrophobicContact CE1-CG1 4.48Å
119	H	98.6	Very high	97.3	Very high	6 Å²	6	34.3 Å²	34.3	3%	0.028	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	128.7	-174.1	-75	-141.5	0	0	0	110.4	A95 P109 W111 G123 K124 Y126	A95-H119 VanDerWaalsContact CB-CD2 3.48Å; A95-H119 WeakPolarHBondContact CB-CD2 3.45Å; A95-H119 VanDerWaalsContact CB-NE2 3.33Å; A95-H119 WeakPolarHBondContact CB-NE2 3.44Å; P109-H119 PolarHBondContact O-NE2 2.86Å; W111-H119 AromaticContact CD1-CE1 3.82Å; W111-H119 AromaticContact NE1-CE1 3.29Å; W111-H119 PolarHBondContact NE1-CE1 2.79Å; W111-H119 VanDerWaalsContact NE1-CE1 3.29Å; W111-H119 AromaticContact NE1-ND1 4Å; H119-G123 VanDerWaalsContact O-CA 3.29Å; H119-G123 WeakPolarHBondContact O-CA 3.48Å; H119-G123 PolarHBondContact O-N 3.12Å; H119-K124 PolarHBondContact N-O 3.27Å; H119-K124 VanDerWaalsContact N-O 3.07Å; H119-Y126 HydrophobicContact CB-CD2 4.05Å; H119-Y126 HydrophobicContact CB-CE2 3.85Å; H119-Y126 AromaticContact CD2-CD2 3.46Å; H119-Y126 VanDerWaalsContact CD2-CD2 3.46Å; H119-Y126 WeakPolarHBondContact CD2-CD2 3.5Å; H119-Y126 AromaticContact CE1-CD2 3.84Å; H119-Y126 AromaticContact CG-CD2 3.44Å; H119-Y126 VanDerWaalsContact CG-CD2 3.44Å; H119-Y126 AromaticContact CG-CE2 3.55Å; H119-Y126 AromaticContact ND1-CD2 3.67Å; H119-Y126 AromaticContact ND1-CE2 3.57Å; H119-Y126 AromaticContact NE2-CD2 3.71Å; H119-Y126 AromaticContact NE2-CG 3.92Å
120	A	98	Very high	97.1	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-37.3	-172.5	0	0	0	0	0	113.2	I85 I94 D122 K138 C139 I145	I85-A120 HydrophobicContact CD1-CB 4.11Å; I94-A120 HydrophobicContact CB-CB 4.12Å; I94-A120 WeakPolarHBondContact O-CB 3.31Å; I94-A120 PolarHBondContact O-N 3.24Å; A120-D122 VanDerWaalsContact C-N 3.33Å; A120-D122 PolarHBondContact O-N 2.91Å; A120-K138 CarbonylContact O-C 3.57Å; A120-K138 WeakPolarHBondContact O-CA 3.43Å; A120-K138 WeakPolarHBondContact O-CB 3.35Å; A120-C139 HydrophobicContact CB-CB 3.82Å; A120-C139 PolarHBondContact O-N 3.34Å; A120-I145 HydrophobicContact CB-CD1 4.14Å
121	D	97.3	Very high	97	Very high	49 Å²	49	45.4 Å²	45.4	26%	0.262	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-29.1	-174	62.2	-54.7	0	0	0	113.6	G92 T93 K138	G92-D121 WeakPolarHBondContact O-CB 3.41Å; G92-D121 PolarHBondContact O-N 2.82Å; T93-D121 HydrophobicContact CG2-CB 4.02Å; D121-K138 WeakPolarHBondContact O-CD 3.24Å; D121-K138 WeakPolarHBondContact O-CE 3.32Å; D121-K138 WeakPolarHBondContact O-CG 3.47Å; D121-K138 PolarHBondContact O-NZ 2.96Å
122	D	97.1	Very high	96.8	Very high	22 Å²	22	43.1 Å²	43.1	12%	0.118	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-126.2	-8.7	-176.2	74.8	-1.5	0	0	0	115.1	A120 K124 Y126	A120-D122 VanDerWaalsContact C-N 3.33Å; A120-D122 PolarHBondContact O-N 2.91Å; D122-K124 HydrophobicContact CB-CG 4.25Å; D122-K124 PolarHBondContact O-N 2.81Å; D122-K124 VanDerWaalsContact OD1-CB 3.31Å; D122-K124 WeakPolarHBondContact OD1-CB 3.43Å; D122-K124 PolarHBondContact OD1-N 3.23Å; D122-K124 WeakPolarHBondContact OD2-CD 3.3Å; D122-K124 WeakPolarHBondContact OD2-CG 3.27Å; D122-K124 IonicContact OD2-NZ 3.54Å; D122-K124 PolarHBondContact OD2-NZ 3.09Å; D122-Y126 PolarHBondContact OD2-OH 2.87Å
123	G	96.5	Very high	96.7	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.25	C	S	.	.			trans	67.1	20.5	-178.7	0	0	0	0	0	113.4	Y118 H119 G136	Y118-G123 VanDerWaalsContact CE2-O 3.29Å; Y118-G123 WeakPolarHBondContact CE2-O 3.29Å; H119-G123 VanDerWaalsContact O-CA 3.29Å; H119-G123 WeakPolarHBondContact O-CA 3.48Å; H119-G123 PolarHBondContact O-N 3.12Å; G123-G136 CarbonylContact O-C 3.5Å; G123-G136 PolarHBondContact O-N 3.02Å; G123-G136 VanDerWaalsContact O-O 3.09Å
124	K	98.4	Very high	96.7	Very high	65 Å²	65	51.5 Å²	51.5	28%	0.283	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	155.9	-178.1	-60.8	-168.6	-158	108.5	0	112.6	H119 D122 Y126 R133	H119-K124 PolarHBondContact N-O 3.27Å; H119-K124 VanDerWaalsContact N-O 3.07Å; D122-K124 HydrophobicContact CB-CG 4.25Å; D122-K124 PolarHBondContact O-N 2.81Å; D122-K124 VanDerWaalsContact OD1-CB 3.31Å; D122-K124 WeakPolarHBondContact OD1-CB 3.43Å; D122-K124 PolarHBondContact OD1-N 3.23Å; D122-K124 WeakPolarHBondContact OD2-CD 3.3Å; D122-K124 WeakPolarHBondContact OD2-CG 3.27Å; D122-K124 IonicContact OD2-NZ 3.54Å; D122-K124 PolarHBondContact OD2-NZ 3.09Å; K124-Y126 HydrophobicContact CB-CD2 4.36Å; K124-Y126 HydrophobicContact CB-CE2 3.8Å; K124-R133 VanDerWaalsContact CA-O 3.3Å; K124-R133 WeakPolarHBondContact CA-O 3.46Å; K124-R133 VanDerWaalsContact CB-O 3.29Å; K124-R133 WeakPolarHBondContact CB-O 3.38Å
125	L	97.9	Very high	96.7	Very high	6 Å²	6	48.7 Å²	48.7	3%	0.031	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	126.8	170.2	-174.6	74.9	0	0	0	110	V116 G132 R133 F135 F163 T173	V116-L125 HydrophobicContact CG2-CD1 3.64Å; V116-L125 HydrophobicContact CG2-CG 4.25Å; L125-G132 CarbonylContact O-C 3.43Å; L125-G132 VanDerWaalsContact O-CA 3.31Å; L125-G132 WeakPolarHBondContact O-CA 3.45Å; L125-R133 PolarHBondContact N-O 2.96Å; L125-R133 PolarHBondContact O-N 2.86Å; L125-F135 HydrophobicContact CB-CB 3.73Å; L125-F135 HydrophobicContact CB-CD1 4.26Å; L125-F135 HydrophobicContact CB-CD2 4.01Å; L125-F135 HydrophobicContact CB-CG 3.76Å; L125-F135 HydrophobicContact CD1-CE1 4.5Å; L125-F135 HydrophobicContact CD2-CD2 4.03Å; L125-F135 HydrophobicContact CD2-CE2 4.08Å; L125-F135 HydrophobicContact CG-CD2 4.5Å; L125-F163 HydrophobicContact CD1-CD2 3.95Å; L125-F163 HydrophobicContact CD1-CE2 3.49Å; L125-F163 VanDerWaalsContact CD1-CE2 3.49Å; L125-F163 HydrophobicContact CD1-CZ 4.11Å; L125-T173 HydrophobicContact CD2-CG2 4.13Å
126	Y	98.4	Very high	96.5	Very high	24 Å²	24	49.4 Å²	49.4	9%	0.094	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	128.9	174.4	-70.4	-103.4	0	0	0	109.2	G110 W111 V116 A117 H119 D122 K124 R129	G110-Y126 WeakPolarHBondContact CA-O 3.49Å; G110-Y126 CarbonylContact O-C 3.44Å; W111-Y126 AromaticContact CD1-CD1 3.54Å; W111-Y126 AromaticContact NE1-CD1 3.65Å; W111-Y126 AromaticContact NE1-CE1 3.73Å; V116-Y126 CarbonylContact C-O 3.57Å; V116-Y126 VanDerWaalsContact CA-O 3.24Å; V116-Y126 WeakPolarHBondContact CA-O 3.13Å; A117-Y126 PolarHBondContact N-O 3.05Å; A117-Y126 PolarHBondContact O-N 3.21Å; H119-Y126 HydrophobicContact CB-CD2 4.05Å; H119-Y126 HydrophobicContact CB-CE2 3.85Å; H119-Y126 AromaticContact CD2-CD2 3.46Å; H119-Y126 VanDerWaalsContact CD2-CD2 3.46Å; H119-Y126 WeakPolarHBondContact CD2-CD2 3.5Å; H119-Y126 AromaticContact CE1-CD2 3.84Å; H119-Y126 AromaticContact CG-CD2 3.44Å; H119-Y126 VanDerWaalsContact CG-CD2 3.44Å; H119-Y126 AromaticContact CG-CE2 3.55Å; H119-Y126 AromaticContact ND1-CD2 3.67Å; H119-Y126 AromaticContact ND1-CE2 3.57Å; H119-Y126 AromaticContact NE2-CD2 3.71Å; H119-Y126 AromaticContact NE2-CG 3.92Å; D122-Y126 PolarHBondContact OD2-OH 2.87Å; K124-Y126 HydrophobicContact CB-CD2 4.36Å; K124-Y126 HydrophobicContact CB-CE2 3.8Å; Y126-R129 WeakPolarHBondContact CD1-O 3.41Å
127	N	96.1	Very high	96.3	Very high	73 Å²	73	52.9 Å²	52.9	39%	0.39	27%	0.268	S	S	.	.	S	Bend	trans	-141.9	59.9	-171.8	69.1	-24.1	0	0	0	113.4	G110 S115 V116	G110-N127 PolarHBondContact O-N 3.14Å; S115-N127 CarbonylContact O-C 3.51Å; S115-N127 WeakPolarHBondContact O-CA 3.21Å; V116-N127 HydrophobicContact CB-CB 4.49Å; V116-N127 HydrophobicContact CG2-CB 4.18Å
128	G	94.3	Very high	96.2	Very high	20 Å²	20	59.1 Å²	59.1	21%	0.206	30%	0.295	C	S	.	.	S	Bend	trans	111.3	3.4	176.1	0	0	0	0	0	115.7	G110 W111 L112 S115	G110-G128 PolarHBondContact O-N 2.85Å; W111-G128 CarbonylContact O-C 3.52Å; L112-G128 VanDerWaalsContact O-CA 3.32Å; L112-G128 WeakPolarHBondContact O-CA 3.34Å; S115-G128 PolarHBondContact O-N 3.05Å
129	R	94.3	Very high	96	Very high	156 Å²	156	59.2 Å²	59.2	59%	0.589	30%	0.295	S	S	*	.	S	Bend	trans	-159.2	152	-177.7	58	-174.4	178.7	-140	-2.6	111.4	G110 W111 Y126 K131	G110-R129 PolarHBondContact O-N 3.24Å; W111-R129 CarbonylContact O-C 3.45Å; W111-R129 WeakPolarHBondContact O-CA 3.5Å; W111-R129 PolarHBondContact O-N 2.86Å; W111-R129 VanDerWaalsContact O-N 3.14Å; Y126-R129 WeakPolarHBondContact CD1-O 3.41Å; R129-K131 PolarHBondContact O-N 2.87Å
130	A	93.9	Very high	95.7	Very high	72 Å²	72	63.4 Å²	63.4	60%	0.595	32%	0.318	S	S	*	.	S	Bend	trans	-73.6	30	177.6	0	0	0	0	0	114.7	W111	W111-A130 HydrophobicContact CD2-CB 4.27Å; W111-A130 HydrophobicContact CG-CB 4.17Å
131	K	95.3	Very high	95.6	Very high	161 Å²	161	66.2 Å²	66.2	70%	0.7	34%	0.338	S	S	*	.			trans	-128.2	102.1	173.7	-176.9	179.9	179.7	179.5	0	108.9	R129	R129-K131 PolarHBondContact O-N 2.87Å
132	G	95.2	Very high	95.3	Very high	19 Å²	19	66.6 Å²	66.6	20%	0.196	35%	0.353	C	S	.	.			trans	-72	157.3	-179.7	0	0	0	0	0	113.1	L125	L125-G132 CarbonylContact O-C 3.43Å; L125-G132 VanDerWaalsContact O-CA 3.31Å; L125-G132 WeakPolarHBondContact O-CA 3.45Å
133	R	94.9	Very high	95.2	Very high	182 Å²	182	67.1 Å²	67.1	69%	0.687	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.4	139	170.8	177.2	-172.6	159.8	-174.6	-3.5	108.9	K124 L125 F135	K124-R133 VanDerWaalsContact CA-O 3.3Å; K124-R133 WeakPolarHBondContact CA-O 3.46Å; K124-R133 VanDerWaalsContact CB-O 3.29Å; K124-R133 WeakPolarHBondContact CB-O 3.38Å; L125-R133 PolarHBondContact N-O 2.96Å; L125-R133 PolarHBondContact O-N 2.86Å; R133-F135 PolarHBondContact O-N 2.88Å
134	Q	95.5	Very high	95.2	Very high	127 Å²	127	69.3 Å²	69.3	59%	0.593	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-52.9	129.8	172.4	-172.4	56.9	48.1	0	0	110.2	G136	Q134-G136 PolarHBondContact NE2-O 3.49Å
135	F	95.3	Very high	95.2	Very high	40 Å²	40	66.2 Å²	66.2	18%	0.175	35%	0.351	C	S	.	.			trans	-146.1	-50.1	-171.2	-174	-104.3	0	0	0	112.8	Y118 L125 R133 F163 V170 G171	Y118-F135 AromaticContact CD2-CD1 3.65Å; Y118-F135 HydrophobicContact CD2-CD1 3.65Å; Y118-F135 HydrophobicContact CD2-CE1 4.21Å; Y118-F135 AromaticContact CE2-CD1 3.7Å; Y118-F135 HydrophobicContact CE2-CD1 3.7Å; Y118-F135 HydrophobicContact CE2-CE1 4.47Å; L125-F135 HydrophobicContact CB-CB 3.73Å; L125-F135 HydrophobicContact CB-CD1 4.26Å; L125-F135 HydrophobicContact CB-CD2 4.01Å; L125-F135 HydrophobicContact CB-CG 3.76Å; L125-F135 HydrophobicContact CD1-CE1 4.5Å; L125-F135 HydrophobicContact CD2-CD2 4.03Å; L125-F135 HydrophobicContact CD2-CE2 4.08Å; L125-F135 HydrophobicContact CG-CD2 4.5Å; R133-F135 PolarHBondContact O-N 2.88Å; F135-F163 HydrophobicContact CE1-CB 3.89Å; F135-F163 HydrophobicContact CE1-CD2 4.09Å; F135-F163 HydrophobicContact CE1-CG 4.27Å; F135-F163 HydrophobicContact CZ-CB 4.34Å; F135-F163 HydrophobicContact CZ-CD2 4.08Å; F135-V170 HydrophobicContact CD1-CB 4.45Å; F135-V170 HydrophobicContact CD1-CG1 3.61Å; F135-V170 HydrophobicContact CE1-CB 3.98Å; F135-V170 HydrophobicContact CE1-CG1 3.62Å; F135-V170 HydrophobicContact CG-CG1 4.44Å; F135-V170 HydrophobicContact CZ-CG1 4.45Å; F135-V170 WeakPolarHBondContact O-CG1 3.25Å; F135-G171 VanDerWaalsContact CZ-CA 3.46Å
136	G	94	Very high	95.2	Very high	16 Å²	16	65.9 Å²	65.9	17%	0.165	35%	0.349	C	S	.	.	S	Bend	trans	-144.6	-165.2	177.9	0	0	0	0	0	112.8	Y118 G123 Q134	Y118-G136 VanDerWaalsContact OH-C 3.31Å; Y118-G136 WeakPolarHBondContact OH-CA 3.38Å; G123-G136 CarbonylContact O-C 3.5Å; G123-G136 PolarHBondContact O-N 3.02Å; G123-G136 VanDerWaalsContact O-O 3.09Å; Q134-G136 PolarHBondContact NE2-O 3.49Å
137	S	94.1	Very high	95.2	Very high	73 Å²	73	64.8 Å²	64.8	51%	0.51	35%	0.345	S	S	.	.			trans	-96.8	148	176.3	57.2	0	0	0	0	111.9	Y118 K165	Y118-S137 PolarHBondContact OH-N 2.84Å; Y118-S137 VanDerWaalsContact OH-N 3.14Å; Y118-S137 PolarHBondContact OH-O 2.95Å; S137-K165 PolarHBondContact O-NZ 3.35Å; S137-K165 PolarHBondContact OG-NZ 3.19Å
138	K	96.6	Very high	95.3	Very high	131 Å²	131	61.3 Å²	61.3	57%	0.57	33%	0.326	S	S	*	.			trans	-49.8	150	176.6	-59.3	-176.9	177.1	-138.3	0	112.8	A120 D121 K165	A120-K138 CarbonylContact O-C 3.57Å; A120-K138 WeakPolarHBondContact O-CA 3.43Å; A120-K138 WeakPolarHBondContact O-CB 3.35Å; D121-K138 WeakPolarHBondContact O-CD 3.24Å; D121-K138 WeakPolarHBondContact O-CE 3.32Å; D121-K138 WeakPolarHBondContact O-CG 3.47Å; D121-K138 PolarHBondContact O-NZ 2.96Å; K138-K165 PolarHBondContact O-NZ 3.3Å
139	C	93.8	Very high	95.3	Very high	1 Å²	1	60.3 Å²	60.3	1%	0.007	32%	0.316	C	S	.	.			trans	-116.6	145.5	177.7	-66.9	0	0	0	0	110.9	I85 A120 D143 I145	I85-C139 HydrophobicContact CD1-CB 3.7Å; A120-C139 HydrophobicContact CB-CB 3.82Å; A120-C139 PolarHBondContact O-N 3.34Å; C139-D143 VanDerWaalsContact CA-OD2 3.24Å; C139-D143 WeakPolarHBondContact CA-OD2 3.43Å; C139-D143 HydrophobicContact CB-CB 4Å; C139-I145 HydrophobicContact CB-CD1 4.08Å; C139-I145 HydrophobicContact CB-CG1 4.33Å
140	N	93.6	Very high	95.2	Very high	95 Å²	95	54.9 Å²	54.9	51%	0.508	30%	0.297	S	S	.	.			trans	-132.2	-178.3	178.6	-79.7	-39.7	0	0	0	111.5	G142 D143	N140-G142 PolarHBondContact O-N 3.16Å; N140-D143 PolarHBondContact N-OD2 2.87Å; N140-D143 WeakPolarHBondContact O-CB 3.45Å; N140-D143 PolarHBondContact O-N 2.89Å
141	S	95.4	Very high	95.1	Very high	59 Å²	59	53.8 Å²	53.8	41%	0.413	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.2	128.5	171.5	-47	0	0	0	0	111.3	S88	S88-S141 PolarHBondContact N-OG 2.9Å; S88-S141 PolarHBondContact OG-OG 2.92Å
142	G	90.9	Very high	94.8	Very high	57 Å²	57	51.2 Å²	51.2	59%	0.588	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.5	-19.3	-175.2	0	0	0	0	0	115.2	I85 N140	I85-G142 PolarHBondContact O-N 3.01Å; N140-G142 PolarHBondContact O-N 3.16Å
143	D	94.7	Very high	94.5	Very high	33 Å²	33	50.5 Å²	50.5	18%	0.176	27%	0.274	C	S	.	.			trans	-75.8	152.7	173.5	-75.4	-45.5	0	0	0	111.8	I85 C139 N140 K165 N166	I85-D143 PolarHBondContact N-O 3.23Å; C139-D143 VanDerWaalsContact CA-OD2 3.24Å; C139-D143 WeakPolarHBondContact CA-OD2 3.43Å; C139-D143 HydrophobicContact CB-CB 4Å; N140-D143 PolarHBondContact N-OD2 2.87Å; N140-D143 WeakPolarHBondContact O-CB 3.45Å; N140-D143 PolarHBondContact O-N 2.89Å; D143-K165 IonicContact OD2-NZ 2.83Å; D143-N166 WeakPolarHBondContact CA-OD1 3.27Å; D143-N166 PolarHBondContact OD1-ND2 3.16Å
144	R	96.8	Very high	94.2	Very high	45 Å²	45	43 Å²	43	17%	0.17	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	132.1	171.5	129.1	-174.8	-72.2	-39.5	30.3	110.3	E82 V83 K165 N166 H198	E82-R144 VanDerWaalsContact CB-CZ 3.41Å; E82-R144 VanDerWaalsContact CD-NE 3.33Å; E82-R144 HydrophobicContact CG-CG 4Å; E82-R144 WeakPolarHBondContact OE1-CD 3.12Å; E82-R144 IonicContact OE1-CZ 2.83Å; E82-R144 IonicContact OE1-NE 3.75Å; E82-R144 IonicContact OE2-CZ 3.14Å; E82-R144 IonicContact OE2-NE 3.23Å; E82-R144 PolarHBondContact OE2-NE 2.63Å; E82-R144 IonicContact OE2-NH1 3.74Å; E82-R144 PolarHBondContact OE2-NH1 3.27Å; E82-R144 IonicContact OE2-NH2 3.27Å; E82-R144 PolarHBondContact OE2-NH2 3.11Å; V83-R144 CarbonylContact O-C 3.58Å; V83-R144 VanDerWaalsContact O-CA 3.26Å; V83-R144 WeakPolarHBondContact O-CA 3.49Å; R144-K165 CarbonylContact O-C 3.52Å; R144-K165 WeakPolarHBondContact O-CA 3.37Å; R144-N166 PolarHBondContact N-OD1 2.68Å; R144-N166 PolarHBondContact O-N 2.58Å; R144-H198 PolarHBondContact NH2-CD2 3.38Å; R144-H198 VanDerWaalsContact NH2-CD2 3.28Å
145	I	98.2	Very high	93.8	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	124.8	174.4	-59.8	170.7	0	0	0	108.5	E82 V83 I85 V96 Y118 A120 C139 T164	E82-I145 CarbonylContact C-O 3.58Å; E82-I145 WeakPolarHBondContact CA-O 3.18Å; V83-I145 PolarHBondContact N-O 2.97Å; V83-I145 PolarHBondContact O-N 2.65Å; I85-I145 HydrophobicContact CD1-CD1 4.23Å; V96-I145 HydrophobicContact CB-CB 4.28Å; V96-I145 HydrophobicContact CB-CG2 3.79Å; V96-I145 HydrophobicContact CG1-CB 4.5Å; V96-I145 HydrophobicContact CG1-CG2 4.03Å; V96-I145 HydrophobicContact CG2-CB 4.13Å; V96-I145 HydrophobicContact CG2-CD1 4.1Å; V96-I145 HydrophobicContact CG2-CG2 4.19Å; Y118-I145 HydrophobicContact CD1-CD1 4.08Å; Y118-I145 HydrophobicContact CD1-CG1 4.24Å; Y118-I145 HydrophobicContact CD1-CG2 3.77Å; Y118-I145 HydrophobicContact CE1-CD1 4.46Å; Y118-I145 HydrophobicContact CE1-CG1 4.48Å; A120-I145 HydrophobicContact CB-CD1 4.14Å; C139-I145 HydrophobicContact CB-CD1 4.08Å; C139-I145 HydrophobicContact CB-CG1 4.33Å; I145-T164 WeakPolarHBondContact CA-O 3.44Å
146	G	98.2	Very high	93.3	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	151.2	171.5	0	0	0	0	0	112.7	F81 F163 T164	F81-G146 WeakPolarHBondContact O-CA 3.39Å; G146-F163 CarbonylContact O-C 3.1Å; G146-F163 VanDerWaalsContact O-CA 3.25Å; G146-F163 WeakPolarHBondContact O-CA 3.35Å; G146-T164 WeakPolarHBondContact CA-OG1 3.3Å; G146-T164 PolarHBondContact N-O 2.82Å; G146-T164 PolarHBondContact N-OG1 2.85Å; G146-T164 PolarHBondContact O-N 3.35Å
147	C	98.4	Very high	92.8	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	131.2	174.9	178.7	0	0	0	0	109.1	Y80 F81 F162 F163	Y80-C147 WeakPolarHBondContact CD2-O 3.2Å; F81-C147 HydrophobicContact CD1-CB 4.23Å; F81-C147 VanDerWaalsContact CD1-O 3.28Å; F81-C147 WeakPolarHBondContact CD1-O 3.34Å; F81-C147 HydrophobicContact CE1-CB 3.54Å; F81-C147 HydrophobicContact CZ-CB 3.88Å; F81-C147 PolarHBondContact N-O 2.86Å; F81-C147 PolarHBondContact O-N 3.27Å; C147-F162 WeakPolarHBondContact CA-O 3.43Å; C147-F163 HydrophobicContact CB-CD1 3.83Å; C147-F163 HydrophobicContact CB-CE1 3.72Å; C147-F163 WeakPolarHBondContact SG-CE1 3.46Å
148	G	97	Very high	92.5	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	171.5	178.7	0	0	0	0	0	113.5	N79 I161 F162	N79-G148 CarbonylContact O-C 3.58Å; N79-G148 WeakPolarHBondContact O-CA 3.39Å; G148-I161 CarbonylContact O-C 3.57Å; G148-I161 VanDerWaalsContact O-CA 3.28Å; G148-I161 WeakPolarHBondContact O-CA 3.44Å; G148-I161 WeakPolarHBondContact O-CG2 3.46Å; G148-F162 VanDerWaalsContact C-CE1 3.5Å; G148-F162 PolarHBondContact N-O 2.93Å; G148-F162 WeakPolarHBondContact O-CD1 3.36Å; G148-F162 PolarHBondContact O-N 3.44Å
149	I	95.6	Very high	92.4	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	132.1	176.1	-58	178.6	0	0	0	107.4	L74 N79 L98 F154 Q160 I161 P179 L182	L74-I149 HydrophobicContact CB-CD1 4.2Å; L74-I149 HydrophobicContact CD1-CD1 4.16Å; L74-I149 HydrophobicContact CD1-CG1 4.02Å; N79-I149 PolarHBondContact ND2-O 2.79Å; N79-I149 PolarHBondContact O-N 2.9Å; L98-I149 HydrophobicContact CD1-CD1 3.91Å; L98-I149 HydrophobicContact CD1-CG1 3.73Å; I149-F154 HydrophobicContact CB-CE2 3.87Å; I149-F154 HydrophobicContact CB-CZ 4.08Å; I149-F154 HydrophobicContact CD1-CZ 4.07Å; I149-F154 HydrophobicContact CG2-CD2 4.32Å; I149-F154 HydrophobicContact CG2-CE2 3.72Å; I149-F154 HydrophobicContact CG2-CZ 4.1Å; I149-Q160 CarbonylContact C-O 3.52Å; I149-Q160 WeakPolarHBondContact CA-O 3.49Å; I149-I161 HydrophobicContact CG1-CG1 4.23Å; I149-P179 HydrophobicContact CD1-CB 3.75Å; I149-P179 HydrophobicContact CG2-CB 3.98Å; I149-L182 HydrophobicContact CD1-CB 4.23Å; I149-L182 HydrophobicContact CD1-CD1 3.99Å
150	E	92.6	Very high	92.4	Very high	41 Å²	41	48 Å²	48	19%	0.192	27%	0.272	C	S	.	.			trans	-59.1	128.6	175.2	-70.1	-65.8	175.9	0	0	110.1	V152 S153 Q160 F162 R169	E150-V152 PolarHBondContact O-N 2.88Å; E150-S153 WeakPolarHBondContact O-CA 3.4Å; E150-S153 WeakPolarHBondContact O-CB 3.35Å; E150-S153 PolarHBondContact O-N 3.09Å; E150-S153 PolarHBondContact O-OG 3.41Å; E150-S153 VanDerWaalsContact O-OG 3.05Å; E150-Q160 HydrophobicContact CB-CB 4.21Å; E150-Q160 HydrophobicContact CB-CG 4.44Å; E150-Q160 HydrophobicContact CG-CB 4.15Å; E150-Q160 HydrophobicContact CG-CG 3.84Å; E150-Q160 PolarHBondContact N-O 2.81Å; E150-F162 HydrophobicContact CG-CD1 4.14Å; E150-R169 IonicContact OE1-CZ 2.8Å; E150-R169 IonicContact OE1-NH1 3.88Å; E150-R169 PolarHBondContact OE1-NH1 2.78Å; E150-R169 IonicContact OE1-NH2 3.94Å; E150-R169 PolarHBondContact OE1-NH2 2.87Å
151	P	90.5	Very high	92.6	Very high	49 Å²	49	43.4 Å²	43.4	32%	0.318	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-54.3	-32.2	-173.8	-29.3	34.5	0	0	0	114.7	S153 F154	P151-S153 PolarHBondContact O-N 2.79Å; P151-F154 PolarHBondContact O-N 3.22Å
152	V	88.7	Confident	92.7	Very high	107 Å²	107	40.9 Å²	40.9	65%	0.648	23%	0.229	S	C	*	.	G	3₁₀ helix	trans	-63.3	-26.9	177.3	-179.7	0	0	0	0	111.9	E150 F154 D155	E150-V152 PolarHBondContact O-N 2.88Å; V152-F154 PolarHBondContact O-N 3.43Å; V152-D155 PolarHBondContact O-N 3.28Å; V152-D155 VanDerWaalsContact O-N 3.14Å
153	S	89.6	Confident	93	Very high	4 Å²	4	38.1 Å²	38.1	3%	0.028	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-62.9	-26.9	178.7	-56.2	0	0	0	0	113	E150 P151 D155 V156 T158 Q160 P179	E150-S153 WeakPolarHBondContact O-CA 3.4Å; E150-S153 WeakPolarHBondContact O-CB 3.35Å; E150-S153 PolarHBondContact O-N 3.09Å; E150-S153 PolarHBondContact O-OG 3.41Å; E150-S153 VanDerWaalsContact O-OG 3.05Å; P151-S153 PolarHBondContact O-N 2.79Å; S153-D155 PolarHBondContact O-N 2.85Å; S153-V156 CarbonylContact O-C 3.51Å; S153-V156 WeakPolarHBondContact O-CG2 3.39Å; S153-V156 PolarHBondContact O-N 2.87Å; S153-T158 WeakPolarHBondContact CB-O 3.43Å; S153-Q160 WeakPolarHBondContact OG-CB 3.43Å; S153-Q160 PolarHBondContact OG-N 2.87Å; S153-P179 WeakPolarHBondContact O-CG 3.18Å
154	F	89.3	Confident	93.1	Very high	26 Å²	26	36.6 Å²	36.6	11%	0.114	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-72.1	-14.2	178.7	-69	-87.2	0	0	0	113.3	L74 T75 K76 N79 I149 P151 V152 P179	L74-F154 HydrophobicContact CB-CZ 4.44Å; T75-F154 WeakPolarHBondContact O-CZ 3.35Å; K76-F154 HydrophobicContact CB-CB 4.2Å; K76-F154 HydrophobicContact CB-CD2 4.17Å; K76-F154 HydrophobicContact CB-CG 4.08Å; K76-F154 HydrophobicContact CD-CB 4.47Å; K76-F154 HydrophobicContact CG-CB 4.36Å; K76-F154 HydrophobicContact CG-CD2 4.39Å; N79-F154 HydrophobicContact CB-CE2 3.83Å; N79-F154 HydrophobicContact CB-CZ 4.31Å; I149-F154 HydrophobicContact CB-CE2 3.87Å; I149-F154 HydrophobicContact CB-CZ 4.08Å; I149-F154 HydrophobicContact CD1-CZ 4.07Å; I149-F154 HydrophobicContact CG2-CD2 4.32Å; I149-F154 HydrophobicContact CG2-CE2 3.72Å; I149-F154 HydrophobicContact CG2-CZ 4.1Å; P151-F154 PolarHBondContact O-N 3.22Å; V152-F154 PolarHBondContact O-N 3.43Å; F154-P179 HydrophobicContact CB-CG 4.38Å; F154-P179 HydrophobicContact CD1-CB 3.96Å; F154-P179 HydrophobicContact CD1-CG 3.6Å; F154-P179 HydrophobicContact CE1-CB 3.77Å; F154-P179 HydrophobicContact CE1-CG 3.96Å; F154-P179 HydrophobicContact CG-CB 4.49Å; F154-P179 HydrophobicContact CG-CG 3.96Å; F154-P179 HydrophobicContact CZ-CB 4.16Å
155	D	87.3	Confident	93.1	Very high	109 Å²	109	36 Å²	36	58%	0.583	19%	0.192	S	C	*	.	G	3₁₀ helix	trans	-96.1	-3.1	176.4	-55.4	-43.6	0	0	0	111.9	K76 V152 S153	K76-D155 IonicContact NZ-OD1 2.82Å; K76-D155 PolarHBondContact NZ-OD1 2.85Å; K76-D155 IonicContact NZ-OD2 2.72Å; K76-D155 PolarHBondContact NZ-OD2 3.33Å; V152-D155 PolarHBondContact O-N 3.28Å; V152-D155 VanDerWaalsContact O-N 3.14Å; S153-D155 PolarHBondContact O-N 2.85Å
156	V	83.8	Confident	92.9	Very high	72 Å²	72	39 Å²	39	44%	0.436	21%	0.208	S	C	.	.	S	Bend	trans	-130.5	162.8	-178.7	-63.7	0	0	0	0	111.4	S153 T158	S153-V156 CarbonylContact O-C 3.51Å; S153-V156 WeakPolarHBondContact O-CG2 3.39Å; S153-V156 PolarHBondContact O-N 2.87Å; V156-T158 WeakPolarHBondContact CG2-OG1 3.19Å; V156-T158 PolarHBondContact O-N 2.69Å; V156-T158 VanDerWaalsContact O-N 3.14Å
157	Q	83.3	Confident	92.5	Very high	173 Å²	173	40.9 Å²	40.9	81%	0.808	23%	0.227	S	C	*	.	S	Bend	trans	-85.3	27	-177.7	-64.4	-175.1	-9.8	0	0	113.6	M177	Q157-M177 CarbonylContact O-C 3.58Å
158	T	89.2	Confident	92.2	Very high	64 Å²	64	47.6 Å²	47.6	39%	0.393	26%	0.256	S	S	.	.	S	Bend	trans	-137.2	129.7	-179	53.7	0	0	0	0	110.2	S153 V156 M177	S153-T158 WeakPolarHBondContact CB-O 3.43Å; V156-T158 WeakPolarHBondContact CG2-OG1 3.19Å; V156-T158 PolarHBondContact O-N 2.69Å; V156-T158 VanDerWaalsContact O-N 3.14Å; T158-M177 CarbonylContact C-O 3.59Å; T158-M177 WeakPolarHBondContact CA-O 3.35Å
159	A	92.9	Very high	92	Very high	0 Å²	0	53 Å²	53	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	109.6	178.9	0	0	0	0	0	110.8	I161 I174 M175 M177 P179 L182	A159-I161 HydrophobicContact CB-CD1 4.35Å; A159-I161 HydrophobicContact CB-CG1 4.24Å; A159-I174 WeakPolarHBondContact O-CA 3.42Å; A159-M175 HydrophobicContact CB-CB 4.48Å; A159-M175 PolarHBondContact N-O 3.47Å; A159-M175 PolarHBondContact O-N 2.81Å; A159-M177 PolarHBondContact N-O 2.87Å; A159-P179 HydrophobicContact CB-CB 4.05Å; A159-L182 HydrophobicContact CB-CD1 3.87Å
160	Q	95.1	Very high	91.9	Very high	73 Å²	73	55.1 Å²	55.1	34%	0.341	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	108.4	167.3	-176.2	177.5	-1.9	0	0	109.1	I149 E150 S153 I174	I149-Q160 CarbonylContact C-O 3.52Å; I149-Q160 WeakPolarHBondContact CA-O 3.49Å; E150-Q160 HydrophobicContact CB-CB 4.21Å; E150-Q160 HydrophobicContact CB-CG 4.44Å; E150-Q160 HydrophobicContact CG-CB 4.15Å; E150-Q160 HydrophobicContact CG-CG 3.84Å; E150-Q160 PolarHBondContact N-O 2.81Å; S153-Q160 WeakPolarHBondContact OG-CB 3.43Å; S153-Q160 PolarHBondContact OG-N 2.87Å; Q160-I174 HydrophobicContact CB-CG1 4.4Å; Q160-I174 HydrophobicContact CG-CG1 4.28Å
161	I	97	Very high	91.9	Very high	0 Å²	0	54 Å²	54	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	132.4	-173.9	-59	166	0	0	0	108.3	L98 V116 G148 I149 A159 F163 S172 T173 M175 L182	L98-I161 HydrophobicContact CD1-CD1 4.1Å; L98-I161 HydrophobicContact CD1-CG1 4.14Å; L98-I161 HydrophobicContact CD1-CG2 3.97Å; V116-I161 HydrophobicContact CG1-CB 4.5Å; V116-I161 HydrophobicContact CG1-CD1 3.45Å; V116-I161 VanDerWaalsContact CG1-CD1 3.45Å; V116-I161 HydrophobicContact CG1-CG2 4.03Å; G148-I161 CarbonylContact O-C 3.57Å; G148-I161 VanDerWaalsContact O-CA 3.28Å; G148-I161 WeakPolarHBondContact O-CA 3.44Å; G148-I161 WeakPolarHBondContact O-CG2 3.46Å; I149-I161 HydrophobicContact CG1-CG1 4.23Å; A159-I161 HydrophobicContact CB-CD1 4.35Å; A159-I161 HydrophobicContact CB-CG1 4.24Å; I161-F163 HydrophobicContact CG2-CE2 3.89Å; I161-F163 HydrophobicContact CG2-CZ 4.18Å; I161-S172 CarbonylContact O-C 3.59Å; I161-S172 WeakPolarHBondContact O-CA 3.44Å; I161-S172 VanDerWaalsContact O-CB 3.27Å; I161-S172 WeakPolarHBondContact O-CB 3.41Å; I161-T173 HydrophobicContact CB-CG2 4.37Å; I161-T173 PolarHBondContact N-O 3.31Å; I161-T173 PolarHBondContact O-N 2.97Å; I161-M175 HydrophobicContact CD1-CB 4.33Å; I161-M175 HydrophobicContact CD1-CG 3.93Å; I161-M175 HydrophobicContact CD1-SD 3.48Å; I161-M175 WeakPolarHBondContact CD1-SD 3.07Å; I161-L182 HydrophobicContact CD1-CD1 3.83Å
162	F	96.9	Very high	92.1	Very high	5 Å²	5	54.5 Å²	54.5	2%	0.022	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	154.1	177	67.8	-91.5	0	0	0	110.9	Y80 C147 G148 E150 T164 G171 L203	Y80-F162 AromaticContact CD2-CE2 3.66Å; Y80-F162 HydrophobicContact CD2-CE2 3.66Å; Y80-F162 AromaticContact CD2-CZ 3.78Å; Y80-F162 HydrophobicContact CD2-CZ 3.78Å; Y80-F162 AromaticContact CE2-CE2 3.75Å; Y80-F162 HydrophobicContact CE2-CE2 3.75Å; Y80-F162 HydrophobicContact CE2-CZ 4.34Å; C147-F162 WeakPolarHBondContact CA-O 3.43Å; G148-F162 VanDerWaalsContact C-CE1 3.5Å; G148-F162 PolarHBondContact N-O 2.93Å; G148-F162 WeakPolarHBondContact O-CD1 3.36Å; G148-F162 PolarHBondContact O-N 3.44Å; E150-F162 HydrophobicContact CG-CD1 4.14Å; F162-T164 HydrophobicContact CD2-CG2 4.14Å; F162-T164 HydrophobicContact CE2-CG2 4.19Å; F162-G171 WeakPolarHBondContact CA-O 2.96Å; F162-L203 HydrophobicContact CE2-CD2 4.16Å
163	F	98.3	Very high	92.4	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	149.8	177.4	-68.5	-90.2	0	0	0	110.6	V96 V116 L125 F135 G146 C147 I161 V170 G171	V96-F163 WeakPolarHBondContact O-CE1 3.14Å; V116-F163 HydrophobicContact CG1-CZ 4.31Å; V116-F163 HydrophobicContact CG2-CE2 3.94Å; V116-F163 HydrophobicContact CG2-CZ 4.01Å; L125-F163 HydrophobicContact CD1-CD2 3.95Å; L125-F163 HydrophobicContact CD1-CE2 3.49Å; L125-F163 VanDerWaalsContact CD1-CE2 3.49Å; L125-F163 HydrophobicContact CD1-CZ 4.11Å; F135-F163 HydrophobicContact CE1-CB 3.89Å; F135-F163 HydrophobicContact CE1-CD2 4.09Å; F135-F163 HydrophobicContact CE1-CG 4.27Å; F135-F163 HydrophobicContact CZ-CB 4.34Å; F135-F163 HydrophobicContact CZ-CD2 4.08Å; G146-F163 CarbonylContact O-C 3.1Å; G146-F163 VanDerWaalsContact O-CA 3.25Å; G146-F163 WeakPolarHBondContact O-CA 3.35Å; C147-F163 HydrophobicContact CB-CD1 3.83Å; C147-F163 HydrophobicContact CB-CE1 3.72Å; C147-F163 WeakPolarHBondContact SG-CE1 3.46Å; I161-F163 HydrophobicContact CG2-CE2 3.89Å; I161-F163 HydrophobicContact CG2-CZ 4.18Å; F163-V170 PolarHBondContact O-N 2.85Å; F163-G171 PolarHBondContact N-O 3.15Å
164	T	97.2	Very high	92.6	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	154	176.1	69.5	0	0	0	0	110.1	Y80 I145 G146 F162 K168 L203	Y80-T164 HydrophobicContact CE2-CG2 4.08Å; Y80-T164 PolarHBondContact OH-OG1 3.45Å; I145-T164 WeakPolarHBondContact CA-O 3.44Å; G146-T164 WeakPolarHBondContact CA-OG1 3.3Å; G146-T164 PolarHBondContact N-O 2.82Å; G146-T164 PolarHBondContact N-OG1 2.85Å; G146-T164 PolarHBondContact O-N 3.35Å; F162-T164 HydrophobicContact CD2-CG2 4.14Å; F162-T164 HydrophobicContact CE2-CG2 4.19Å; T164-K168 CarbonylContact C-O 3.59Å; T164-K168 WeakPolarHBondContact CA-O 3.21Å; T164-K168 WeakPolarHBondContact CB-O 3.25Å; T164-L203 HydrophobicContact CG2-CD1 3.8Å
165	K	96	Very high	92.7	Very high	33 Å²	33	55.3 Å²	55.3	14%	0.143	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	120.4	168.6	178	179.3	175	174.8	0	107.1	S137 K138 D143 R144 G167 K168 V170	S137-K165 PolarHBondContact O-NZ 3.35Å; S137-K165 PolarHBondContact OG-NZ 3.19Å; K138-K165 PolarHBondContact O-NZ 3.3Å; D143-K165 IonicContact OD2-NZ 2.83Å; R144-K165 CarbonylContact O-C 3.52Å; R144-K165 WeakPolarHBondContact O-CA 3.37Å; K165-G167 VanDerWaalsContact C-N 3.29Å; K165-G167 PolarHBondContact O-N 2.86Å; K165-K168 PolarHBondContact N-O 3.32Å; K165-K168 PolarHBondContact O-N 2.83Å; K165-K168 VanDerWaalsContact O-N 3.1Å; K165-V170 HydrophobicContact CB-CG2 3.71Å
166	N	93.8	Very high	92.8	Very high	63 Å²	63	56 Å²	56	34%	0.337	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.7	47	-177.5	-57.9	-35.4	0	0	0	112.3	D143 R144 K168	D143-N166 WeakPolarHBondContact CA-OD1 3.27Å; D143-N166 PolarHBondContact OD1-ND2 3.16Å; R144-N166 PolarHBondContact N-OD1 2.68Å; R144-N166 PolarHBondContact O-N 2.58Å; N166-K168 PolarHBondContact O-N 2.69Å; N166-K168 VanDerWaalsContact O-N 3.09Å
167	G	90.4	Very high	93	Very high	39 Å²	39	54.8 Å²	54.8	40%	0.402	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.5	-20.5	-179.2	0	0	0	0	0	115.3	K165	K165-G167 VanDerWaalsContact C-N 3.29Å; K165-G167 PolarHBondContact O-N 2.86Å
168	K	90.8	Very high	93.3	Very high	142 Å²	142	49.1 Å²	49.1	62%	0.617	28%	0.275	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.4	132	177.9	-170.7	178.6	178.7	-176.6	0	111.1	T164 K165 N166 V170	T164-K168 CarbonylContact C-O 3.59Å; T164-K168 WeakPolarHBondContact CA-O 3.21Å; T164-K168 WeakPolarHBondContact CB-O 3.25Å; K165-K168 PolarHBondContact N-O 3.32Å; K165-K168 PolarHBondContact O-N 2.83Å; K165-K168 VanDerWaalsContact O-N 3.1Å; N166-K168 PolarHBondContact O-N 2.69Å; N166-K168 VanDerWaalsContact O-N 3.09Å; K168-V170 PolarHBondContact O-N 2.96Å
169	R	93.3	Very high	93.2	Very high	112 Å²	112	46.1 Å²	46.1	42%	0.423	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	129.8	176.1	-173.5	170.2	-74.8	-155.9	-9.2	111.1	E150	E150-R169 IonicContact OE1-CZ 2.8Å; E150-R169 IonicContact OE1-NH1 3.88Å; E150-R169 PolarHBondContact OE1-NH1 2.78Å; E150-R169 IonicContact OE1-NH2 3.94Å; E150-R169 PolarHBondContact OE1-NH2 2.87Å
170	V	94.4	Very high	92.7	Very high	46 Å²	46	51.1 Å²	51.1	28%	0.279	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	-43.8	176.2	179.6	0	0	0	0	110.2	F135 F163 K165 K168	F135-V170 HydrophobicContact CD1-CB 4.45Å; F135-V170 HydrophobicContact CD1-CG1 3.61Å; F135-V170 HydrophobicContact CE1-CB 3.98Å; F135-V170 HydrophobicContact CE1-CG1 3.62Å; F135-V170 HydrophobicContact CG-CG1 4.44Å; F135-V170 HydrophobicContact CZ-CG1 4.45Å; F135-V170 WeakPolarHBondContact O-CG1 3.25Å; F163-V170 PolarHBondContact O-N 2.85Å; K165-V170 HydrophobicContact CB-CG2 3.71Å; K168-V170 PolarHBondContact O-N 2.96Å
171	G	92.9	Very high	92.5	Very high	18 Å²	18	49.1 Å²	49.1	19%	0.186	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	174.4	-172.3	-179.6	0	0	0	0	0	112.3	F135 F162 F163	F135-G171 VanDerWaalsContact CZ-CA 3.46Å; F162-G171 WeakPolarHBondContact CA-O 2.96Å; F163-G171 PolarHBondContact N-O 3.15Å
172	S	94.9	Very high	92.4	Very high	59 Å²	59	49.1 Å²	49.1	41%	0.413	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	163.2	177.1	64.3	0	0	0	0	112.5	I161	I161-S172 CarbonylContact O-C 3.59Å; I161-S172 WeakPolarHBondContact O-CA 3.44Å; I161-S172 VanDerWaalsContact O-CB 3.27Å; I161-S172 WeakPolarHBondContact O-CB 3.41Å
173	T	94.9	Very high	92.4	Very high	25 Å²	25	49.3 Å²	49.3	15%	0.153	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	154.4	172.7	-173.6	0	0	0	0	109.9	V116 L125 I161	V116-T173 HydrophobicContact CG2-CG2 3.88Å; L125-T173 HydrophobicContact CD2-CG2 4.13Å; I161-T173 HydrophobicContact CB-CG2 4.37Å; I161-T173 PolarHBondContact N-O 3.31Å; I161-T173 PolarHBondContact O-N 2.97Å
174	I	93.2	Very high	92.4	Very high	112 Å²	112	49.4 Å²	49.4	57%	0.574	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.1	130.3	176.9	-59.9	170.8	0	0	0	108.5	A159 Q160	A159-I174 WeakPolarHBondContact O-CA 3.42Å; Q160-I174 HydrophobicContact CB-CG1 4.4Å; Q160-I174 HydrophobicContact CG-CG1 4.28Å
175	M	91.5	Very high	92.5	Very high	16 Å²	16	49.4 Å²	49.4	8%	0.079	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	132.1	170.4	-73.6	-174.6	50.6	0	0	110.4	D114 V116 A159 I161 M177	D114-M175 WeakPolarHBondContact O-CE 3.34Å; V116-M175 HydrophobicContact CB-SD 3.77Å; V116-M175 HydrophobicContact CG1-SD 3.61Å; A159-M175 HydrophobicContact CB-CB 4.48Å; A159-M175 PolarHBondContact N-O 3.47Å; A159-M175 PolarHBondContact O-N 2.81Å; I161-M175 HydrophobicContact CD1-CB 4.33Å; I161-M175 HydrophobicContact CD1-CG 3.93Å; I161-M175 HydrophobicContact CD1-SD 3.48Å; I161-M175 WeakPolarHBondContact CD1-SD 3.07Å; M175-M177 HydrophobicContact CB-CG 4.13Å; M175-M177 HydrophobicContact CE-CG 4.08Å; M175-M177 HydrophobicContact CE-SD 3.27Å; M175-M177 WeakPolarHBondContact CE-SD 3.42Å; M175-M177 PolarHBondContact O-N 3.01Å
176	P	89.2	Confident	92.6	Very high	125 Å²	125	47.9 Å²	47.9	81%	0.812	28%	0.277	S	S	*	.	S	Bend	trans	-79.5	53.9	-177.2	35.2	-37.1	0	0	0	111.8
177	M	88.4	Confident	92.9	Very high	46 Å²	46	44.9 Å²	44.9	23%	0.227	26%	0.261	C	S	.	.	S	Bend	trans	-150.7	163	178.9	62.7	-169.4	-82.7	0	0	111.4	D114 Q157 T158 A159 M175 L182	D114-M177 HydrophobicContact CB-CE 4.22Å; D114-M177 HydrophobicContact CB-SD 3.93Å; Q157-M177 CarbonylContact O-C 3.58Å; T158-M177 CarbonylContact C-O 3.59Å; T158-M177 WeakPolarHBondContact CA-O 3.35Å; A159-M177 PolarHBondContact N-O 2.87Å; M175-M177 HydrophobicContact CB-CG 4.13Å; M175-M177 HydrophobicContact CE-CG 4.08Å; M175-M177 HydrophobicContact CE-SD 3.27Å; M175-M177 WeakPolarHBondContact CE-SD 3.42Å; M175-M177 PolarHBondContact O-N 3.01Å; M177-L182 HydrophobicContact CE-CD2 3.75Å; M177-L182 HydrophobicContact CE-CG 4.36Å; M177-L182 HydrophobicContact SD-CD2 4.4Å
178	S	88.7	Confident	93.2	Very high	54 Å²	54	43 Å²	43	38%	0.378	24%	0.242	S	C	.	.			trans	-66.7	140.3	175.8	167.8	0	0	0	0	111.5	D180	S178-D180 VanDerWaalsContact C-N 3.35Å; S178-D180 PolarHBondContact OG-N 2.66Å
179	P	87.5	Confident	93.5	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.006	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-73	-20.6	178.8	29.9	-36	0	0	0	114.4	I149 S153 F154 A159 G181 L182	I149-P179 HydrophobicContact CD1-CB 3.75Å; I149-P179 HydrophobicContact CG2-CB 3.98Å; S153-P179 WeakPolarHBondContact O-CG 3.18Å; F154-P179 HydrophobicContact CB-CG 4.38Å; F154-P179 HydrophobicContact CD1-CB 3.96Å; F154-P179 HydrophobicContact CD1-CG 3.6Å; F154-P179 HydrophobicContact CE1-CB 3.77Å; F154-P179 HydrophobicContact CE1-CG 3.96Å; F154-P179 HydrophobicContact CG-CB 4.49Å; F154-P179 HydrophobicContact CG-CG 3.96Å; F154-P179 HydrophobicContact CZ-CB 4.16Å; A159-P179 HydrophobicContact CB-CB 4.05Å; P179-G181 PolarHBondContact O-N 3.13Å; P179-L182 PolarHBondContact O-N 2.69Å; P179-L182 VanDerWaalsContact O-N 3.12Å
180	D	83.1	Confident	93.6	Very high	104 Å²	104	32.7 Å²	32.7	56%	0.556	20%	0.202	S	C	*	.	G	3₁₀ helix	trans	-64.2	-7.6	-171.7	-67.3	-37.4	0	0	0	114.9	S178	S178-D180 VanDerWaalsContact C-N 3.35Å; S178-D180 PolarHBondContact OG-N 2.66Å
181	G	89.6	Confident	93.5	Very high	32 Å²	32	36 Å²	36	33%	0.33	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-115.8	11.2	-179.3	0	0	0	0	0	114.8	P179 F183	P179-G181 PolarHBondContact O-N 3.13Å; G181-F183 VanDerWaalsContact O-CD2 3.26Å; G181-F183 WeakPolarHBondContact O-CD2 3.37Å; G181-F183 WeakPolarHBondContact O-CE2 3.36Å
182	L	95.6	Very high	93.4	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	118	-177.5	-70.8	178.4	0	0	0	111.3	P73 L74 L98 I149 A159 I161 M177 P179	P73-L182 CarbonylContact C-O 3.55Å; P73-L182 WeakPolarHBondContact CA-O 3.49Å; P73-L182 WeakPolarHBondContact CB-O 3.4Å; L74-L182 PolarHBondContact N-O 3.23Å; L98-L182 HydrophobicContact CB-CB 4.17Å; L98-L182 HydrophobicContact CB-CD2 4.38Å; L98-L182 HydrophobicContact CD1-CB 4.32Å; L98-L182 HydrophobicContact CD1-CD1 4.3Å; L98-L182 HydrophobicContact CD2-CB 4.43Å; I149-L182 HydrophobicContact CD1-CB 4.23Å; I149-L182 HydrophobicContact CD1-CD1 3.99Å; A159-L182 HydrophobicContact CB-CD1 3.87Å; I161-L182 HydrophobicContact CD1-CD1 3.83Å; M177-L182 HydrophobicContact CE-CD2 3.75Å; M177-L182 HydrophobicContact CE-CG 4.36Å; M177-L182 HydrophobicContact SD-CD2 4.4Å; P179-L182 PolarHBondContact O-N 2.69Å; P179-L182 VanDerWaalsContact O-N 3.12Å
183	F	97.3	Very high	93.5	Very high	8 Å²	8	34.4 Å²	34.4	4%	0.035	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	135.5	-175.2	-67.7	-105.8	0	0	0	110.7	Y42 V69 A70 P73 L98 V99 Q101 G181 A185	Y42-F183 HydrophobicContact CD1-CE1 4.22Å; Y42-F183 HydrophobicContact CD1-CZ 4.43Å; Y42-F183 HydrophobicContact CE1-CE1 4.42Å; Y42-F183 HydrophobicContact CE1-CZ 4.23Å; V69-F183 HydrophobicContact CG1-CB 3.73Å; V69-F183 HydrophobicContact CG1-CG 4.37Å; A70-F183 WeakPolarHBondContact O-CD1 3.1Å; P73-F183 HydrophobicContact CB-CD1 4.36Å; P73-F183 HydrophobicContact CB-CD2 4.18Å; P73-F183 HydrophobicContact CB-CE1 4.25Å; P73-F183 HydrophobicContact CB-CE2 4.01Å; P73-F183 HydrophobicContact CB-CG 4.34Å; P73-F183 HydrophobicContact CB-CZ 4.06Å; P73-F183 VanDerWaalsContact CD-CE1 3.47Å; P73-F183 HydrophobicContact CG-CE1 4.34Å; P73-F183 HydrophobicContact CG-CZ 4.13Å; L98-F183 WeakPolarHBondContact CA-O 3.38Å; V99-F183 HydrophobicContact CG2-CB 4.37Å; V99-F183 PolarHBondContact N-O 2.99Å; V99-F183 PolarHBondContact O-N 3.31Å; Q101-F183 HydrophobicContact CB-CD2 4.25Å; Q101-F183 HydrophobicContact CB-CE2 3.61Å; Q101-F183 HydrophobicContact CB-CZ 4.05Å; Q101-F183 HydrophobicContact CG-CE2 4.1Å; Q101-F183 HydrophobicContact CG-CZ 4.02Å; G181-F183 VanDerWaalsContact O-CD2 3.26Å; G181-F183 WeakPolarHBondContact O-CD2 3.37Å; G181-F183 WeakPolarHBondContact O-CE2 3.36Å; F183-A185 PolarHBondContact O-N 2.98Å
184	P	98.3	Very high	93.7	Very high	3 Å²	3	36.2 Å²	36.2	2%	0.019	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-52.2	132.8	167.3	-27.7	36.6	0	0	0	111.4	A70 R72 L74 F81 L98 L199	A70-P184 HydrophobicContact CB-CB 3.89Å; A70-P184 HydrophobicContact CB-CG 4.25Å; A70-P184 WeakPolarHBondContact CB-O 3.43Å; A70-P184 PolarHBondContact N-O 2.91Å; R72-P184 WeakPolarHBondContact O-CD 3.47Å; L74-P184 HydrophobicContact CD2-CG 3.72Å; L74-P184 HydrophobicContact CG-CG 4.08Å; F81-P184 HydrophobicContact CD1-CB 3.82Å; F81-P184 HydrophobicContact CD1-CG 3.82Å; F81-P184 HydrophobicContact CD2-CB 3.98Å; F81-P184 HydrophobicContact CE1-CB 3.72Å; F81-P184 HydrophobicContact CE1-CG 4.07Å; F81-P184 HydrophobicContact CE2-CB 3.9Å; F81-P184 HydrophobicContact CG-CB 3.93Å; F81-P184 HydrophobicContact CG-CG 4.11Å; F81-P184 HydrophobicContact CZ-CB 3.77Å; L98-P184 HydrophobicContact CD2-CG 4.49Å; P184-L199 HydrophobicContact CB-CD2 3.91Å; P184-L199 HydrophobicContact CG-CD2 3.91Å
185	A	98.7	Very high	93.9	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	146.9	178	0	0	0	0	0	112.1	Y68 V69 G97 V99 P109 F183	Y68-A185 CarbonylContact O-C 3.46Å; Y68-A185 WeakPolarHBondContact O-CA 3.41Å; Y68-A185 WeakPolarHBondContact O-CB 3.44Å; V69-A185 HydrophobicContact CG2-CB 4.31Å; G97-A185 PolarHBondContact N-O 3.01Å; G97-A185 PolarHBondContact O-N 2.97Å; V99-A185 HydrophobicContact CB-CB 4.3Å; V99-A185 HydrophobicContact CG1-CB 3.68Å; V99-A185 HydrophobicContact CG2-CB 3.66Å; P109-A185 HydrophobicContact CB-CB 4.31Å; P109-A185 HydrophobicContact CG-CB 3.76Å; F183-A185 PolarHBondContact O-N 2.98Å
186	V	98.8	Very high	94.2	Very high	0 Å²	0	36 Å²	36	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	136.4	175.6	-179.3	0	0	0	0	108	L56 C67 Y68 V83 A95 V195 L197	L56-V186 HydrophobicContact CD1-CB 4.07Å; L56-V186 HydrophobicContact CD1-CG1 4.35Å; L56-V186 HydrophobicContact CD1-CG2 4.01Å; C67-V186 CarbonylContact C-O 3.49Å; C67-V186 WeakPolarHBondContact CA-O 3.47Å; Y68-V186 PolarHBondContact N-O 2.88Å; Y68-V186 PolarHBondContact O-N 2.85Å; V83-V186 HydrophobicContact CG2-CG2 3.85Å; A95-V186 CarbonylContact O-C 3.59Å; A95-V186 VanDerWaalsContact O-CA 3.26Å; A95-V186 WeakPolarHBondContact O-CA 3.49Å; V186-V195 HydrophobicContact CG1-CG2 4Å; V186-L197 HydrophobicContact CG2-CD1 4.4Å
187	G	98.7	Very high	94.6	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	152.6	169.9	0	0	0	0	0	112.1	G66 I94 A95 Q108	G66-G187 CarbonylContact O-C 3.41Å; G66-G187 WeakPolarHBondContact O-CA 3.14Å; I94-G187 CarbonylContact C-O 3.59Å; I94-G187 VanDerWaalsContact CA-O 3.28Å; I94-G187 WeakPolarHBondContact CA-O 3.26Å; A95-G187 PolarHBondContact N-O 3.27Å; A95-G187 PolarHBondContact O-N 3.14Å; Q108-G187 PolarHBondContact OE1-O 3.23Å
188	M	98.3	Very high	95	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	147.4	-173.5	-73.9	-171.3	-79.9	0	0	109.5	I49 L56 Y58 G66 I94 Q108 E193	I49-M188 HydrophobicContact CB-CE 4.34Å; I49-M188 HydrophobicContact CD1-CE 3.54Å; I49-M188 HydrophobicContact CG1-CE 3.73Å; I49-M188 HydrophobicContact CG2-CE 3.75Å; L56-M188 HydrophobicContact CB-CE 3.88Å; Y58-M188 HydrophobicContact CD2-CB 3.82Å; Y58-M188 HydrophobicContact CG-CB 4.38Å; G66-M188 WeakPolarHBondContact CA-O 3.3Å; G66-M188 PolarHBondContact N-O 2.82Å; G66-M188 PolarHBondContact O-N 2.85Å; I94-M188 HydrophobicContact CG1-CG 4.23Å; Q108-M188 PolarHBondContact NE2-O 3.45Å; M188-E193 VanDerWaalsContact C-OE2 3.3Å; M188-E193 WeakPolarHBondContact CA-OE2 3.43Å; M188-E193 HydrophobicContact CB-CB 4.34Å; M188-E193 WeakPolarHBondContact CB-OE2 3.33Å; M188-E193 HydrophobicContact CG-CB 4.13Å; M188-E193 HydrophobicContact SD-CB 3.76Å
189	H	97.3	Very high	95.3	Very high	32 Å²	32	30.9 Å²	30.9	15%	0.148	17%	0.168	C	C	.	.			trans	-149	19.1	-173.8	-163.2	-168.5	0	0	0	114.7	G63 E64 R91 T93 E193	G63-H189 VanDerWaalsContact C-NE2 3.33Å; G63-H189 PolarHBondContact O-NE2 2.7Å; E64-H189 PolarHBondContact O-CD2 2.83Å; R91-H189 PolarHBondContact NH1-ND1 2.84Å; R91-H189 PolarHBondContact NH1-O 3.06Å; T93-H189 PolarHBondContact O-N 3.33Å; T93-H189 WeakPolarHBondContact OG1-CB 3.46Å; H189-E193 PolarHBondContact N-OE2 2.95Å
190	S	93.9	Very high	95.4	Very high	6 Å²	6	37.9 Å²	37.9	4%	0.042	21%	0.206	C	C	.	.	S	Bend	trans	-150	154.3	171	80.9	0	0	0	0	114.5	Y58 V90 R91 E193	Y58-S190 WeakPolarHBondContact CB-O 3.15Å; Y58-S190 VanDerWaalsContact CD1-C 3.42Å; Y58-S190 WeakPolarHBondContact CD1-O 3.1Å; Y58-S190 VanDerWaalsContact CG-O 3.29Å; V90-S190 PolarHBondContact N-OG 3.43Å; R91-S190 PolarHBondContact N-OG 3.39Å; S190-E193 VanDerWaalsContact CB-OE1 3.32Å; S190-E193 WeakPolarHBondContact CB-OE1 3.16Å; S190-E193 VanDerWaalsContact N-CD 3.3Å; S190-E193 PolarHBondContact N-OE1 3.34Å; S190-E193 PolarHBondContact N-OE2 3.43Å; S190-E193 VanDerWaalsContact N-OE2 3.13Å; S190-E193 WeakPolarHBondContact O-CB 3.45Å; S190-E193 WeakPolarHBondContact O-CG 3.42Å; S190-E193 PolarHBondContact O-N 2.89Å; S190-E193 WeakPolarHBondContact OG-CG 3.43Å; S190-E193 PolarHBondContact OG-OE1 2.87Å
191	L	92.9	Very high	95.8	Very high	114 Å²	114	33.8 Å²	33.8	60%	0.597	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.1	138.9	178.8	-65.9	172.7	0	0	0	110.9	Y58 G89 V90 E193	Y58-L191 HydrophobicContact CD1-CD2 4.25Å; Y58-L191 HydrophobicContact CE1-CD2 4.04Å; G89-L191 CarbonylContact C-O 3.51Å; G89-L191 WeakPolarHBondContact CA-O 3.28Å; V90-L191 HydrophobicContact CG2-CB 4.29Å; V90-L191 PolarHBondContact N-O 2.76Å; L191-E193 VanDerWaalsContact C-N 3.29Å
192	G	91.5	Very high	95.5	Very high	43 Å²	43	40.7 Å²	40.7	44%	0.443	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	84.9	-7.9	-179.9	0	0	0	0	0	114.6	D87 G89 E194	D87-G192 VanDerWaalsContact CB-O 3.3Å; D87-G192 WeakPolarHBondContact CB-O 3.18Å; G89-G192 VanDerWaalsContact CA-C 3.5Å; G192-E194 PolarHBondContact O-N 3.35Å
193	E	97.4	Very high	94.4	Very high	1 Å²	1	43.9 Å²	43.9	1%	0.005	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	124.9	175.2	-74.2	170.5	-171.9	0	0	110.7	Y58 D87 S88 T93 I94 M188 H189 S190 L191	Y58-E193 PolarHBondContact N-O 2.93Å; D87-E193 WeakPolarHBondContact O-CA 3.4Å; S88-E193 WeakPolarHBondContact O-CG 3.34Å; T93-E193 WeakPolarHBondContact CA-OE1 3.42Å; T93-E193 PolarHBondContact N-OE1 2.75Å; T93-E193 PolarHBondContact OG1-OE1 2.84Å; I94-E193 HydrophobicContact CD1-CB 4.35Å; I94-E193 HydrophobicContact CD1-CG 4.18Å; I94-E193 HydrophobicContact CG1-CB 4.25Å; I94-E193 HydrophobicContact CG1-CG 3.96Å; M188-E193 VanDerWaalsContact C-OE2 3.3Å; M188-E193 WeakPolarHBondContact CA-OE2 3.43Å; M188-E193 HydrophobicContact CB-CB 4.34Å; M188-E193 WeakPolarHBondContact CB-OE2 3.33Å; M188-E193 HydrophobicContact CG-CB 4.13Å; M188-E193 HydrophobicContact SD-CB 3.76Å; H189-E193 PolarHBondContact N-OE2 2.95Å; S190-E193 VanDerWaalsContact CB-OE1 3.32Å; S190-E193 WeakPolarHBondContact CB-OE1 3.16Å; S190-E193 VanDerWaalsContact N-CD 3.3Å; S190-E193 PolarHBondContact N-OE1 3.34Å; S190-E193 PolarHBondContact N-OE2 3.43Å; S190-E193 VanDerWaalsContact N-OE2 3.13Å; S190-E193 WeakPolarHBondContact O-CB 3.45Å; S190-E193 WeakPolarHBondContact O-CG 3.42Å; S190-E193 PolarHBondContact O-N 2.89Å; S190-E193 WeakPolarHBondContact OG-CG 3.43Å; S190-E193 PolarHBondContact OG-OE1 2.87Å; L191-E193 VanDerWaalsContact C-N 3.29Å
194	E	97.8	Very high	92.6	Very high	64 Å²	64	46.3 Å²	46.3	30%	0.299	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	136.3	178.6	-176.4	168.7	108.1	0	0	110.7	T55 L56 S57 V86 D87 G192	T55-E194 HydrophobicContact CG2-CG 3.68Å; L56-E194 WeakPolarHBondContact O-CA 3.36Å; S57-E194 PolarHBondContact OG-OE2 2.97Å; V86-E194 WeakPolarHBondContact CA-O 3.45Å; V86-E194 HydrophobicContact CB-CB 4.26Å; V86-E194 HydrophobicContact CB-CG 4.08Å; V86-E194 WeakPolarHBondContact CB-O 3.49Å; V86-E194 HydrophobicContact CG1-CG 4.44Å; V86-E194 HydrophobicContact CG2-CG 4.46Å; V86-E194 PolarHBondContact N-O 2.91Å; D87-E194 HydrophobicContact CB-CB 4.34Å; D87-E194 PolarHBondContact N-O 2.91Å; D87-E194 PolarHBondContact O-N 2.83Å; G192-E194 PolarHBondContact O-N 3.35Å
195	V	98.5	Very high	90.4	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	160.2	178.8	-53.6	0	0	0	0	111.9	T55 L56 V83 S84 I85 I94 V186	T55-V195 CarbonylContact C-O 3.57Å; T55-V195 WeakPolarHBondContact CA-O 3.09Å; L56-V195 HydrophobicContact CB-CG2 3.8Å; L56-V195 HydrophobicContact CD1-CG2 4.04Å; L56-V195 HydrophobicContact CG-CG2 4.39Å; L56-V195 PolarHBondContact N-O 2.68Å; L56-V195 PolarHBondContact O-N 3.44Å; V83-V195 HydrophobicContact CG1-CB 3.58Å; V83-V195 HydrophobicContact CG1-CG1 3.98Å; V83-V195 HydrophobicContact CG1-CG2 3.7Å; S84-V195 CarbonylContact O-C 3.46Å; S84-V195 WeakPolarHBondContact O-CA 3.4Å; S84-V195 WeakPolarHBondContact O-CB 3.42Å; I85-V195 HydrophobicContact CG1-CG1 4.47Å; I94-V195 HydrophobicContact CD1-CG1 3.87Å; I94-V195 HydrophobicContact CG2-CG1 3.97Å; V186-V195 HydrophobicContact CG1-CG2 4Å
196	R	97.7	Very high	88.1	Confident	123 Å²	123	64.3 Å²	64.3	46%	0.464	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	126.8	167.4	-69.9	176.7	68.7	-169.8	0.8	110.4	D54 V83 S84 V86 H198	D54-R196 CarbonylContact O-C 3.35Å; D54-R196 WeakPolarHBondContact O-CA 3.41Å; V83-R196 CarbonylContact C-O 3.52Å; V83-R196 WeakPolarHBondContact CA-O 3.14Å; S84-R196 PolarHBondContact N-O 3.37Å; S84-R196 PolarHBondContact O-N 2.8Å; V86-R196 HydrophobicContact CG2-CB 4.49Å; V86-R196 HydrophobicContact CG2-CG 3.75Å; R196-H198 PolarHBondContact O-CD2 3.27Å
197	L	97.8	Very high	85.4	Confident	8 Å²	8	71.7 Å²	71.7	4%	0.042	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	123.7	-178.6	178	64.3	0	0	0	111.1	D54 L56 Y68 F81 V83 V186 L199	D54-L197 PolarHBondContact O-N 3.09Å; L56-L197 HydrophobicContact CD1-CB 4.16Å; L56-L197 HydrophobicContact CD1-CD2 4.43Å; Y68-L197 HydrophobicContact CD1-CD2 4.33Å; Y68-L197 HydrophobicContact CE1-CD2 3.6Å; F81-L197 HydrophobicContact CD2-CD1 3.75Å; F81-L197 HydrophobicContact CE2-CD1 4.11Å; V83-L197 HydrophobicContact CG2-CD1 3.8Å; V186-L197 HydrophobicContact CG2-CD1 4.4Å; L197-L199 HydrophobicContact CD1-CD2 4.13Å; L197-L199 HydrophobicContact CD1-CG 4.46Å; L197-L199 HydrophobicContact CD2-CD1 4.3Å; L197-L199 HydrophobicContact CD2-CD2 4.11Å; L197-L199 HydrophobicContact CD2-CG 4.02Å; L197-L199 HydrophobicContact CG-CD2 4.19Å; L197-L199 HydrophobicContact CG-CG 4.03Å
198	H	96.5	Very high	82.8	Confident	51 Å²	51	77.4 Å²	77.4	24%	0.236	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	87.9	179.1	-51.6	-82.9	0	0	0	110	E82 S84 R144 R196 N200 A201	E82-H198 HydrophobicContact CB-CB 4.43Å; E82-H198 PolarHBondContact N-O 2.94Å; E82-H198 WeakPolarHBondContact O-CA 3.35Å; E82-H198 VanDerWaalsContact O-CB 3.3Å; E82-H198 WeakPolarHBondContact O-CB 3.31Å; E82-H198 PolarHBondContact O-CD2 3.16Å; E82-H198 PolarHBondContact O-N 2.87Å; S84-H198 PolarHBondContact OG-NE2 2.73Å; R144-H198 PolarHBondContact NH2-CD2 3.38Å; R144-H198 VanDerWaalsContact NH2-CD2 3.28Å; R196-H198 PolarHBondContact O-CD2 3.27Å; H198-N200 VanDerWaalsContact C-N 3.28Å; H198-N200 PolarHBondContact O-N 2.8Å; H198-A201 HydrophobicContact CB-CB 4.24Å
199	L	94.4	Very high	80.2	Confident	58 Å²	58	82.4 Å²	82.4	30%	0.304	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-20.8	-180	-69.7	176	0	0	0	114	A70 F81 P184 L197	A70-L199 HydrophobicContact CB-CD2 4.3Å; F81-L199 HydrophobicContact CB-CD2 4.19Å; P184-L199 HydrophobicContact CB-CD2 3.91Å; P184-L199 HydrophobicContact CG-CD2 3.91Å; L197-L199 HydrophobicContact CD1-CD2 4.13Å; L197-L199 HydrophobicContact CD1-CG 4.46Å; L197-L199 HydrophobicContact CD2-CD1 4.3Å; L197-L199 HydrophobicContact CD2-CD2 4.11Å; L197-L199 HydrophobicContact CD2-CG 4.02Å; L197-L199 HydrophobicContact CG-CD2 4.19Å; L197-L199 HydrophobicContact CG-CG 4.03Å
200	N	90.2	Very high	77.7	Confident	149 Å²	149	86.7 Å²	86.7	80%	0.797	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.9	26	179.8	-58.3	-35.5	0	0	0	111.8	H198	H198-N200 VanDerWaalsContact C-N 3.28Å; H198-N200 PolarHBondContact O-N 2.8Å
201	A	90.4	Very high	74.9	Confident	18 Å²	18	94.9 Å²	94.9	15%	0.149	50%	0.502	C	S	.	.			trans	-66.9	141.7	176.7	0	0	0	0	0	110.6	Y80 E82 H198	Y80-A201 HydrophobicContact CD1-CB 3.99Å; Y80-A201 HydrophobicContact CE1-CB 4.02Å; E82-A201 HydrophobicContact CB-CB 3.4Å; E82-A201 HydrophobicContact CG-CB 4.23Å; E82-A201 WeakPolarHBondContact OE2-CB 3.42Å; H198-A201 HydrophobicContact CB-CB 4.24Å
202	E	83.2	Confident	72.7	Confident	176 Å²	176	97.8 Å²	97.8	82%	0.822	52%	0.515	S	S	*	.			trans	-113.5	129.8	173.4	-65.7	-175.9	178.2	0	0	108.4	G204	E202-G204 PolarHBondContact O-N 3.22Å; E202-G204 VanDerWaalsContact O-N 3.08Å
203	L	74	Confident	70.4	Confident	67 Å²	67	102.9 Å²	102.9	35%	0.351	54%	0.537	S	S	.	.			trans	-74.5	101.9	170.6	-165.8	76.3	0	0	0	106.9	Y80 F162 T164 R205	Y80-L203 HydrophobicContact CD1-CB 4.19Å; Y80-L203 HydrophobicContact CE1-CB 4.09Å; Y80-L203 HydrophobicContact CE1-CD1 4.08Å; Y80-L203 HydrophobicContact CE2-CD1 4.17Å; Y80-L203 WeakPolarHBondContact OH-CD1 3.28Å; F162-L203 HydrophobicContact CE2-CD2 4.16Å; T164-L203 HydrophobicContact CG2-CD1 3.8Å; L203-R205 PolarHBondContact O-N 2.84Å
204	G	58.3	Low	67.8	Low	60 Å²	60	108.3 Å²	108.3	62%	0.619	57%	0.567	S	S	*	*			trans	-49.6	126.9	176.3	0	0	0	0	0	109.8	E202 E206	E202-G204 PolarHBondContact O-N 3.22Å; E202-G204 VanDerWaalsContact O-N 3.08Å; G204-E206 PolarHBondContact O-N 3.44Å
205	R	52	Low	65.5	Low	194 Å²	194	108.1 Å²	108.1	73%	0.732	57%	0.572	S	S	*	*			trans	-59.6	134.8	167.1	-75	-176.6	151.8	121.4	0.5	106.5	L203 D207 D208	L203-R205 PolarHBondContact O-N 2.84Å; R205-D207 PolarHBondContact O-N 2.65Å; R205-D208 PolarHBondContact O-N 2.92Å
206	E	49.7	Very low	63.3	Low	186 Å²	186	112.9 Å²	112.9	87%	0.869	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.6	-10.6	-178.1	-67.9	179.4	154.8	0	0	113.6	G204	G204-E206 PolarHBondContact O-N 3.44Å
207	D	43.8	Very low	61.2	Low	155 Å²	155	113.1 Å²	113.1	83%	0.829	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.3	-10.6	175	-85.9	-28.6	0	0	0	116.6	R205 S209	R205-D207 PolarHBondContact O-N 2.65Å; D207-S209 PolarHBondContact O-N 3Å
208	D	42.7	Very low	59.7	Low	120 Å²	120	117.8 Å²	117.8	64%	0.642	62%	0.622	S	S	*	*			trans	-96.4	18.5	-175	-73.2	-31.1	0	0	0	113.8	R205 V210	R205-D208 PolarHBondContact O-N 2.92Å; D208-V210 PolarHBondContact O-N 3.08Å
209	S	44.6	Very low	59	Low	105 Å²	105	117.5 Å²	117.5	73%	0.734	62%	0.621	S	S	*	*			trans	-69.7	18.6	-175.2	-48.5	0	0	0	0	115.4	D207	D207-S209 PolarHBondContact O-N 3Å
210	V	44.9	Very low	58.8	Low	123 Å²	123	115.9 Å²	115.9	75%	0.745	61%	0.611	S	S	*	*	S	Bend	trans	-127	69	-175.6	-169	0	0	0	0	108.7	D208	D208-V210 PolarHBondContact O-N 3.08Å
211	M	34.6	Very low	58.6	Low	177 Å²	177	110.9 Å²	110.9	87%	0.872	59%	0.594	S	S	*	*			trans	166.7	72.7	155.6	-79.9	-23.1	-137.3	0	0	109.7
212	M	46	Very low	58.7	Low	176 Å²	176	113.8 Å²	113.8	87%	0.867	60%	0.601	S	S	*	*			trans	-119.2	138.4	159.8	-69.2	-137.6	-60.9	0	0	108.8	D214	M212-D214 PolarHBondContact O-N 3.37Å
213	V	44.8	Very low	59.2	Low	150 Å²	150	109.4 Å²	109.4	91%	0.909	58%	0.583	S	S	*	*			trans	-74.8	111.7	-178.9	178.5	0	0	0	0	107.3	S215	V213-S215 PolarHBondContact O-N 2.82Å
214	D	41.2	Very low	60.2	Low	115 Å²	115	108.3 Å²	108.3	62%	0.615	58%	0.576	S	S	*	*			trans	-57.7	106.2	-175	-64.7	-37	0	0	0	112.1	M212	M212-D214 PolarHBondContact O-N 3.37Å
215	S	49.3	Very low	62	Low	60 Å²	60	108.6 Å²	108.6	42%	0.42	56%	0.563	S	S	.	*			trans	-83.1	103.1	151.2	-173.4	0	0	0	0	106.6	V213 E217 D218	V213-S215 PolarHBondContact O-N 2.82Å; S215-E217 PolarHBondContact O-N 3.21Å; S215-D218 PolarHBondContact O-N 3.45Å
216	Y	52.9	Low	64	Low	100 Å²	100	100 Å²	100	39%	0.392	53%	0.532	S	S	.	.	G	3₁₀ helix	trans	-54.8	-15	-179.9	-64.8	-86.8	0	0	0	114.1	D218 G230 T231	Y216-D218 VanDerWaalsContact C-N 3.25Å; Y216-D218 PolarHBondContact O-N 2.84Å; Y216-G230 WeakPolarHBondContact CB-O 3.31Å; Y216-T231 HydrophobicContact CD1-CG2 3.53Å; Y216-T231 HydrophobicContact CE1-CG2 3.36Å; Y216-T231 HydrophobicContact CG-CG2 4.18Å
217	E	53.7	Low	66.1	Low	127 Å²	127	97 Å²	97	59%	0.593	51%	0.513	S	S	*	.	G	3₁₀ helix	trans	-65.8	-26.8	173.4	-64.5	-169.6	167.5	0	0	112.8	S215 E219 V228	S215-E217 PolarHBondContact O-N 3.21Å; E217-E219 VanDerWaalsContact C-N 3.26Å; E217-E219 PolarHBondContact O-N 2.76Å; E217-V228 HydrophobicContact CG-CG1 4.49Å
218	D	66.7	Low	68.3	Low	106 Å²	106	90.3 Å²	90.3	57%	0.567	48%	0.478	S	S	*	.	G	3₁₀ helix	trans	-75.8	-11.3	-177.3	-74.4	-42.1	0	0	0	114	S215 Y216 R251	S215-D218 PolarHBondContact O-N 3.45Å; Y216-D218 VanDerWaalsContact C-N 3.25Å; Y216-D218 PolarHBondContact O-N 2.84Å; D218-R251 WeakPolarHBondContact O-CD 3.19Å
219	E	81.8	Confident	70.4	Confident	45 Å²	45	87.7 Å²	87.7	21%	0.21	47%	0.468	C	S	.	.	G	3₁₀ helix	trans	-80.1	-20.1	-178.5	-61.5	-171.7	140.4	0	0	113.4	E217 R251 L437 H438	E217-E219 VanDerWaalsContact C-N 3.26Å; E217-E219 PolarHBondContact O-N 2.76Å; E219-R251 WeakPolarHBondContact O-CB 3.45Å; E219-R251 PolarHBondContact O-N 3.18Å; E219-L437 HydrophobicContact CB-CD1 3.77Å; E219-L437 HydrophobicContact CG-CD1 4.46Å; E219-H438 IonicContact OE1-CD2 3.1Å
220	W	89.7	Confident	72.5	Confident	25 Å²	25	84.3 Å²	84.3	10%	0.095	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	127.5	-177.2	-62.5	97.6	0	0	0	111.3	L223 V228 L233 A248 I424 V435	W220-L223 HydrophobicContact CB-CD1 4.31Å; W220-L223 HydrophobicContact CB-CD2 3.98Å; W220-L223 HydrophobicContact CB-CG 4.12Å; W220-L223 HydrophobicContact CD2-CD2 4.26Å; W220-L223 HydrophobicContact CE3-CD2 4.42Å; W220-L223 HydrophobicContact CG-CD2 4.05Å; W220-V228 HydrophobicContact CG-CG2 4.27Å; W220-L233 HydrophobicContact CH2-CD1 3.68Å; W220-L233 HydrophobicContact CZ2-CD1 3.68Å; W220-L233 HydrophobicContact CZ2-CD2 3.91Å; W220-L233 HydrophobicContact CZ2-CG 4.07Å; W220-L233 HydrophobicContact CZ3-CD1 4.41Å; W220-A248 HydrophobicContact CD2-CB 4.34Å; W220-A248 HydrophobicContact CE3-CB 3.65Å; W220-A248 HydrophobicContact CH2-CB 4.09Å; W220-A248 HydrophobicContact CZ3-CB 3.51Å; W220-I424 HydrophobicContact CH2-CD1 3.57Å; W220-I424 HydrophobicContact CH2-CG1 4.46Å; W220-I424 HydrophobicContact CZ3-CD1 3.84Å; W220-V435 HydrophobicContact CH2-CB 4.47Å; W220-V435 HydrophobicContact CH2-CG1 4.05Å; W220-V435 HydrophobicContact CH2-CG2 4.21Å; W220-V435 HydrophobicContact CZ2-CB 4.11Å; W220-V435 HydrophobicContact CZ2-CG1 4.05Å; W220-V435 HydrophobicContact CZ2-CG2 4.05Å
221	G	85.7	Confident	74.7	Confident	43 Å²	43	80.5 Å²	80.5	44%	0.443	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	-32.3	178	0	0	0	0	0	112.9	Q249	G221-Q249 PolarHBondContact N-O 3.3Å
222	R	92.6	Very high	77.5	Confident	80 Å²	80	74 Å²	74	30%	0.302	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	127.8	-176.6	-58.8	173.7	63.4	-139.4	1	110	Q249 K281 Y283	R222-Q249 HydrophobicContact CB-CB 4.28Å; R222-Q249 PolarHBondContact N-O 2.61Å; R222-Q249 VanDerWaalsContact N-O 3.16Å; R222-Q249 VanDerWaalsContact NH1-OE1 3.09Å; R222-Q249 PolarHBondContact O-N 3.35Å; R222-K281 PolarHBondContact NH1-O 2.98Å; R222-Y283 PolarHBondContact NH1-O 2.63Å; R222-Y283 PolarHBondContact NH2-O 3.34Å
223	L	94	Very high	79.9	Confident	84 Å²	84	65.7 Å²	65.7	44%	0.44	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	139.5	177.5	-63.2	171.2	0	0	0	109.2	W220 V228 L247 A248	W220-L223 HydrophobicContact CB-CD1 4.31Å; W220-L223 HydrophobicContact CB-CD2 3.98Å; W220-L223 HydrophobicContact CB-CG 4.12Å; W220-L223 HydrophobicContact CD2-CD2 4.26Å; W220-L223 HydrophobicContact CE3-CD2 4.42Å; W220-L223 HydrophobicContact CG-CD2 4.05Å; L223-V228 HydrophobicContact CD1-CG2 3.58Å; L223-V228 HydrophobicContact CD2-CG2 3.86Å; L223-V228 HydrophobicContact CG-CG2 4.39Å; L223-L247 CarbonylContact C-O 3.56Å; L223-L247 WeakPolarHBondContact CA-O 3.4Å; L223-A248 HydrophobicContact CD2-CB 3.72Å
224	H	95.4	Very high	82.4	Confident	43 Å²	43	59.6 Å²	59.6	20%	0.199	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	123.8	174.6	-178.3	-97.2	0	0	0	108.3	V226 V245 G246 L247 K285	H224-V226 WeakPolarHBondContact O-CG2 3.38Å; H224-V226 PolarHBondContact O-N 3.49Å; H224-V245 PolarHBondContact ND1-O 2.76Å; H224-G246 CarbonylContact O-C 3.1Å; H224-G246 WeakPolarHBondContact O-CA 3.19Å; H224-L247 HydrophobicContact CB-CB 4.32Å; H224-L247 PolarHBondContact N-O 3.21Å; H224-L247 PolarHBondContact O-N 2.92Å; H224-K285 HydrophobicContact CB-CB 4Å; H224-K285 PolarHBondContact ND1-O 3.33Å
225	D	95.9	Very high	85.1	Confident	66 Å²	66	55 Å²	55	35%	0.353	29%	0.29	S	S	.	.	S	Bend	trans	49.2	33.1	-179.8	-69.4	-14.6	0	0	0	114.6	L236 G237	D225-L236 PolarHBondContact O-N 3.47Å; D225-G237 PolarHBondContact O-N 2.88Å
226	V	94.5	Very high	87.2	Confident	14 Å²	14	56.6 Å²	56.6	9%	0.085	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	138.8	176.3	176.2	0	0	0	0	108.8	H224 L233 E234 A248 M426	H224-V226 WeakPolarHBondContact O-CG2 3.38Å; H224-V226 PolarHBondContact O-N 3.49Å; V226-L233 HydrophobicContact CG1-CB 3.97Å; V226-L233 HydrophobicContact CG1-CD2 4.05Å; V226-L233 HydrophobicContact CG1-CG 4.42Å; V226-E234 CarbonylContact C-O 3.39Å; V226-E234 WeakPolarHBondContact CA-O 3.32Å; V226-A248 HydrophobicContact CG1-CB 4.39Å; V226-M426 HydrophobicContact CB-CE 4.3Å; V226-M426 HydrophobicContact CG1-CE 3.7Å; V226-M426 HydrophobicContact CG2-CE 3.59Å
227	R	92.6	Very high	89	Confident	122 Å²	122	52.3 Å²	52.3	46%	0.46	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	138.3	170.8	174.7	169.3	63.4	-156.7	1.4	110.5	L233 E234 L236	R227-L233 WeakPolarHBondContact O-CA 3.19Å; R227-E234 IonicContact CZ-OE2 3.08Å; R227-E234 VanDerWaalsContact CZ-OE2 3.28Å; R227-E234 PolarHBondContact N-O 3.4Å; R227-E234 IonicContact NE-OE2 3.53Å; R227-E234 PolarHBondContact NE-OE2 2.88Å; R227-E234 VanDerWaalsContact NE-OE2 3.1Å; R227-E234 IonicContact NH2-OE2 2.71Å; R227-E234 PolarHBondContact NH2-OE2 2.82Å; R227-E234 PolarHBondContact O-N 2.87Å; R227-L236 HydrophobicContact CB-CD1 3.7Å; R227-L236 HydrophobicContact CB-CD2 4.35Å; R227-L236 HydrophobicContact CB-CG 4.01Å
228	V	91.5	Very high	90.8	Very high	15 Å²	15	53.2 Å²	53.2	9%	0.091	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	131.9	173	-172.8	0	0	0	0	109	E217 W220 L223 G230 L233	E217-V228 HydrophobicContact CG-CG1 4.49Å; W220-V228 HydrophobicContact CG-CG2 4.27Å; L223-V228 HydrophobicContact CD1-CG2 3.58Å; L223-V228 HydrophobicContact CD2-CG2 3.86Å; L223-V228 HydrophobicContact CG-CG2 4.39Å; V228-G230 WeakPolarHBondContact CG1-O 3.19Å; V228-L233 HydrophobicContact CB-CD2 4.25Å; V228-L233 HydrophobicContact CG1-CD2 4.29Å; V228-L233 HydrophobicContact CG2-CD2 3.65Å
229	C	86.9	Confident	91.9	Very high	65 Å²	65	49.1 Å²	49.1	44%	0.439	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	83	174.9	-72.3	0	0	0	0	108.8	T231 L232	C229-T231 PolarHBondContact O-N 2.65Å; C229-L232 HydrophobicContact CB-CB 4.39Å; C229-L232 PolarHBondContact N-O 3.09Å; C229-L232 WeakPolarHBondContact O-CB 3.35Å; C229-L232 PolarHBondContact O-N 3.3Å
230	G	87.5	Confident	92.2	Very high	34 Å²	34	55.6 Å²	55.6	35%	0.351	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.5	-124.2	-168.7	0	0	0	0	0	110.6	Y216 V228 L232	Y216-G230 WeakPolarHBondContact CB-O 3.31Å; V228-G230 WeakPolarHBondContact CG1-O 3.19Å; G230-L232 VanDerWaalsContact C-N 3.31Å
231	T	90.8	Very high	92.2	Very high	43 Å²	43	56.9 Å²	56.9	26%	0.264	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-3.9	175	48.7	0	0	0	0	113.7	Y216 C229 K434 V435	Y216-T231 HydrophobicContact CD1-CG2 3.53Å; Y216-T231 HydrophobicContact CE1-CG2 3.36Å; Y216-T231 HydrophobicContact CG-CG2 4.18Å; C229-T231 PolarHBondContact O-N 2.65Å; T231-K434 CarbonylContact O-C 3.52Å; T231-K434 WeakPolarHBondContact O-CA 3.27Å; T231-K434 WeakPolarHBondContact OG1-CE 3.45Å; T231-V435 PolarHBondContact O-N 3.41Å
232	L	94.1	Very high	92.3	Very high	42 Å²	42	59.6 Å²	59.6	22%	0.22	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	129	-178.8	-171	76.2	0	0	0	110.6	C229 G230 E234 V266 K432 V433	C229-L232 HydrophobicContact CB-CB 4.39Å; C229-L232 PolarHBondContact N-O 3.09Å; C229-L232 WeakPolarHBondContact O-CB 3.35Å; C229-L232 PolarHBondContact O-N 3.3Å; G230-L232 VanDerWaalsContact C-N 3.31Å; L232-E234 HydrophobicContact CD2-CG 3.83Å; L232-E234 WeakPolarHBondContact CD2-OE1 3.24Å; L232-E234 HydrophobicContact CG-CG 4.09Å; L232-V266 HydrophobicContact CD1-CB 4.46Å; L232-V266 HydrophobicContact CD1-CG2 4.17Å; L232-K432 HydrophobicContact CD1-CB 4.3Å; L232-V433 WeakPolarHBondContact CA-O 3.41Å
233	L	96.3	Very high	92.1	Very high	1 Å²	1	59.6 Å²	59.6	1%	0.005	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	135.8	165.3	-60.8	-175.5	0	0	0	110	W220 V226 R227 V228 A248 I424 M426 K432 V433 V435	W220-L233 HydrophobicContact CH2-CD1 3.68Å; W220-L233 HydrophobicContact CZ2-CD1 3.68Å; W220-L233 HydrophobicContact CZ2-CD2 3.91Å; W220-L233 HydrophobicContact CZ2-CG 4.07Å; W220-L233 HydrophobicContact CZ3-CD1 4.41Å; V226-L233 HydrophobicContact CG1-CB 3.97Å; V226-L233 HydrophobicContact CG1-CD2 4.05Å; V226-L233 HydrophobicContact CG1-CG 4.42Å; R227-L233 WeakPolarHBondContact O-CA 3.19Å; V228-L233 HydrophobicContact CB-CD2 4.25Å; V228-L233 HydrophobicContact CG1-CD2 4.29Å; V228-L233 HydrophobicContact CG2-CD2 3.65Å; L233-A248 HydrophobicContact CD1-CB 3.65Å; L233-I424 HydrophobicContact CD1-CB 4.43Å; L233-I424 HydrophobicContact CD1-CG2 4.43Å; L233-M426 HydrophobicContact CB-CE 3.96Å; L233-K432 VanDerWaalsContact O-CA 3.3Å; L233-K432 WeakPolarHBondContact O-CA 3.4Å; L233-V433 HydrophobicContact CB-CG2 3.88Å; L233-V433 HydrophobicContact CD1-CG2 4.26Å; L233-V433 HydrophobicContact CG-CG2 4.43Å; L233-V433 PolarHBondContact N-O 3.1Å; L233-V433 PolarHBondContact O-N 2.88Å; L233-V435 HydrophobicContact CD1-CG2 3.65Å; L233-V435 HydrophobicContact CG-CG2 3.88Å
234	E	97	Very high	92.1	Very high	22 Å²	22	56.8 Å²	56.8	10%	0.103	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	128.5	177.1	-56.8	-171.7	140.7	0	0	110.3	V226 R227 L232 K432	V226-E234 CarbonylContact C-O 3.39Å; V226-E234 WeakPolarHBondContact CA-O 3.32Å; R227-E234 IonicContact CZ-OE2 3.08Å; R227-E234 VanDerWaalsContact CZ-OE2 3.28Å; R227-E234 PolarHBondContact N-O 3.4Å; R227-E234 IonicContact NE-OE2 3.53Å; R227-E234 PolarHBondContact NE-OE2 2.88Å; R227-E234 VanDerWaalsContact NE-OE2 3.1Å; R227-E234 IonicContact NH2-OE2 2.71Å; R227-E234 PolarHBondContact NH2-OE2 2.82Å; R227-E234 PolarHBondContact O-N 2.87Å; L232-E234 HydrophobicContact CD2-CG 3.83Å; L232-E234 WeakPolarHBondContact CD2-OE1 3.24Å; L232-E234 HydrophobicContact CG-CG 4.09Å; E234-K432 HydrophobicContact CB-CG 4.48Å; E234-K432 HydrophobicContact CG-CD 4.09Å; E234-K432 HydrophobicContact CG-CG 4.07Å; E234-K432 VanDerWaalsContact OE1-CE 3.31Å; E234-K432 WeakPolarHBondContact OE1-CE 3.28Å; E234-K432 IonicContact OE1-NZ 3.17Å; E234-K432 PolarHBondContact OE1-NZ 3.49Å
235	Y	97.5	Very high	92	Very high	17 Å²	17	54.7 Å²	54.7	7%	0.067	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	132.6	174.9	179	-113.2	0	0	0	111.5	G237 K238 G239 D244 M426 S428 E431	Y235-G237 VanDerWaalsContact CE1-O 3.25Å; Y235-G237 WeakPolarHBondContact CE1-O 3.49Å; Y235-G237 VanDerWaalsContact CZ-C 3.41Å; Y235-G237 VanDerWaalsContact OH-CA 3.31Å; Y235-G237 WeakPolarHBondContact OH-CA 3.18Å; Y235-K238 PolarHBondContact OH-N 2.84Å; Y235-G239 VanDerWaalsContact OH-CA 3.26Å; Y235-G239 WeakPolarHBondContact OH-CA 3.44Å; Y235-G239 PolarHBondContact OH-N 2.83Å; Y235-D244 WeakPolarHBondContact CE2-O 3.17Å; Y235-D244 PolarHBondContact OH-O 3.04Å; Y235-M426 HydrophobicContact CD2-CB 3.84Å; Y235-M426 WeakPolarHBondContact CE2-O 3.28Å; Y235-M426 HydrophobicContact CG-CB 4.1Å; Y235-S428 VanDerWaalsContact CD1-C 3.5Å; Y235-S428 WeakPolarHBondContact CD1-O 3.5Å; Y235-E431 PolarHBondContact N-O 2.92Å
236	L	94.9	Very high	92	Very high	94 Å²	94	51.6 Å²	51.6	49%	0.492	28%	0.276	S	S	.	.			trans	-118.7	-4.1	179.3	-63.9	-172.7	0	0	0	113.8	D225 R227	D225-L236 PolarHBondContact O-N 3.47Å; R227-L236 HydrophobicContact CB-CD1 3.7Å; R227-L236 HydrophobicContact CB-CD2 4.35Å; R227-L236 HydrophobicContact CB-CG 4.01Å
237	G	90.5	Very high	92.2	Very high	11 Å²	11	51 Å²	51	11%	0.113	27%	0.273	C	S	.	.	S	Bend	trans	-72.3	177.5	-178.6	0	0	0	0	0	113	D225 Y235	D225-G237 PolarHBondContact O-N 2.88Å; Y235-G237 VanDerWaalsContact CE1-O 3.25Å; Y235-G237 WeakPolarHBondContact CE1-O 3.49Å; Y235-G237 VanDerWaalsContact CZ-C 3.41Å; Y235-G237 VanDerWaalsContact OH-CA 3.31Å; Y235-G237 WeakPolarHBondContact OH-CA 3.18Å
238	K	91.3	Very high	92.4	Very high	145 Å²	145	45.2 Å²	45.2	63%	0.63	25%	0.251	S	S	*	.			trans	-80.3	-26.8	-176.7	-64.5	175.2	-176.3	166.7	0	113.6	Y235 K240	Y235-K238 PolarHBondContact OH-N 2.84Å; K238-K240 HydrophobicContact CB-CG 4.17Å; K238-K240 PolarHBondContact O-N 3.02Å
239	G	89.3	Confident	92.6	Very high	20 Å²	20	44.7 Å²	44.7	21%	0.206	25%	0.248	C	C	.	.			trans	59.3	28.4	-178.9	0	0	0	0	0	114.8	Y235 L427	Y235-G239 VanDerWaalsContact OH-CA 3.26Å; Y235-G239 WeakPolarHBondContact OH-CA 3.44Å; Y235-G239 PolarHBondContact OH-N 2.83Å; G239-L427 WeakPolarHBondContact CA-O 3.49Å
240	K	87.9	Confident	93	Very high	182 Å²	182	41.9 Å²	41.9	79%	0.791	23%	0.229	S	C	*	.	S	Bend	trans	-95.3	-33.3	-175.1	-67.2	-172.8	178.6	-170.4	0	112.9	K238 D244	K238-K240 HydrophobicContact CB-CG 4.17Å; K238-K240 PolarHBondContact O-N 3.02Å; K240-D244 WeakPolarHBondContact CB-OD2 3.39Å; K240-D244 PolarHBondContact N-OD2 3.21Å
241	S	90.2	Very high	93.2	Very high	51 Å²	51	44.4 Å²	44.4	36%	0.357	23%	0.228	S	C	.	.	S	Bend	trans	-133.2	163.3	-175.9	66.6	0	0	0	0	110.8	V243 D244 L427	S241-V243 PolarHBondContact O-N 2.95Å; S241-V243 WeakPolarHBondContact OG-CG2 3.47Å; S241-D244 PolarHBondContact N-OD2 3.38Å; S241-D244 PolarHBondContact O-N 2.82Å; S241-D244 VanDerWaalsContact O-N 3.07Å; S241-D244 VanDerWaalsContact OG-CG 3.31Å; S241-D244 PolarHBondContact OG-OD2 2.88Å; S241-L427 WeakPolarHBondContact O-CD1 3.48Å
242	I	87.9	Confident	93.2	Very high	100 Å²	100	48.5 Å²	48.5	51%	0.513	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-12.4	177.9	61.2	170	0	0	0	114	V245 W291	I242-V245 WeakPolarHBondContact O-CG2 3.4Å; I242-W291 HydrophobicContact CB-CH2 4.45Å; I242-W291 HydrophobicContact CB-CZ3 4.19Å
243	V	88.9	Confident	93.2	Very high	80 Å²	80	48.2 Å²	48.2	49%	0.485	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-9	177.2	-60.4	0	0	0	0	113.5	S241 V245	S241-V243 PolarHBondContact O-N 2.95Å; S241-V243 WeakPolarHBondContact OG-CG2 3.47Å; V243-V245 PolarHBondContact O-N 2.98Å
244	D	92.3	Very high	93	Very high	25 Å²	25	48.4 Å²	48.4	13%	0.134	25%	0.246	C	C	.	.			trans	-78.3	28.1	178	-66.2	-55.5	0	0	0	112.4	Y235 K240 S241 G246 L427	Y235-D244 WeakPolarHBondContact CE2-O 3.17Å; Y235-D244 PolarHBondContact OH-O 3.04Å; K240-D244 WeakPolarHBondContact CB-OD2 3.39Å; K240-D244 PolarHBondContact N-OD2 3.21Å; S241-D244 PolarHBondContact N-OD2 3.38Å; S241-D244 PolarHBondContact O-N 2.82Å; S241-D244 VanDerWaalsContact O-N 3.07Å; S241-D244 VanDerWaalsContact OG-CG 3.31Å; S241-D244 PolarHBondContact OG-OD2 2.88Å; D244-G246 PolarHBondContact O-N 3.31Å; D244-L427 HydrophobicContact CB-CD1 4.31Å
245	V	94.1	Very high	92.6	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.255	C	S	.	.			trans	-66.9	129.3	-175.9	177.9	0	0	0	0	110.7	H224 I242 V243 H288 L427	H224-V245 PolarHBondContact ND1-O 2.76Å; I242-V245 WeakPolarHBondContact O-CG2 3.4Å; V243-V245 PolarHBondContact O-N 2.98Å; V245-H288 HydrophobicContact CG2-CB 4.38Å; V245-L427 HydrophobicContact CB-CD1 4.4Å; V245-L427 HydrophobicContact CG2-CD1 3.79Å; V245-L427 HydrophobicContact CG2-CD2 4.45Å
246	G	96.5	Very high	92	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	126.4	163.2	0	0	0	0	0	109.2	H224 D244 G425 M426	H224-G246 CarbonylContact O-C 3.1Å; H224-G246 WeakPolarHBondContact O-CA 3.19Å; D244-G246 PolarHBondContact O-N 3.31Å; G246-G425 WeakPolarHBondContact O-CA 3.36Å; G246-M426 WeakPolarHBondContact CA-O 3.39Å; G246-M426 PolarHBondContact N-O 2.98Å; G246-M426 PolarHBondContact O-N 2.62Å
247	L	97.4	Very high	91.5	Very high	2 Å²	2	59.4 Å²	59.4	1%	0.01	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	132.7	-177.8	-167.7	83.4	0	0	0	110.1	L223 H224 Y283 P289 T423	L223-L247 CarbonylContact C-O 3.56Å; L223-L247 WeakPolarHBondContact CA-O 3.4Å; H224-L247 HydrophobicContact CB-CB 4.32Å; H224-L247 PolarHBondContact N-O 3.21Å; H224-L247 PolarHBondContact O-N 2.92Å; L247-Y283 HydrophobicContact CD1-CD1 4.35Å; L247-Y283 HydrophobicContact CD2-CD1 4.45Å; L247-P289 HydrophobicContact CD1-CG 4.06Å; L247-T423 HydrophobicContact CD1-CG2 3.54Å; L247-T423 HydrophobicContact CG-CG2 4.14Å
248	A	97	Very high	91.2	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	120.1	165.1	0	0	0	0	0	109.3	W220 L223 V226 L233 T423 I424	W220-A248 HydrophobicContact CD2-CB 4.34Å; W220-A248 HydrophobicContact CE3-CB 3.65Å; W220-A248 HydrophobicContact CH2-CB 4.09Å; W220-A248 HydrophobicContact CZ3-CB 3.51Å; L223-A248 HydrophobicContact CD2-CB 3.72Å; V226-A248 HydrophobicContact CG1-CB 4.39Å; L233-A248 HydrophobicContact CD1-CB 3.65Å; A248-T423 WeakPolarHBondContact O-CA 3.49Å; A248-I424 PolarHBondContact N-O 2.82Å; A248-I424 PolarHBondContact O-N 2.72Å
249	Q	97	Very high	91.2	Very high	4 Å²	4	56.9 Å²	56.9	2%	0.019	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	129.6	178.3	-177	172.6	68.4	0	0	110	G221 R222 R280 K281 F421 P422 T423	G221-Q249 PolarHBondContact N-O 3.3Å; R222-Q249 HydrophobicContact CB-CB 4.28Å; R222-Q249 PolarHBondContact N-O 2.61Å; R222-Q249 VanDerWaalsContact N-O 3.16Å; R222-Q249 VanDerWaalsContact NH1-OE1 3.09Å; R222-Q249 PolarHBondContact O-N 3.35Å; Q249-R280 PolarHBondContact NE2-O 2.84Å; Q249-K281 PolarHBondContact OE1-O 2.78Å; Q249-K281 VanDerWaalsContact OE1-O 3.09Å; Q249-F421 HydrophobicContact CG-CB 3.84Å; Q249-P422 WeakPolarHBondContact CA-O 3.34Å; Q249-T423 HydrophobicContact CB-CG2 4.25Å; Q249-T423 PolarHBondContact NE2-OG1 3.12Å; Q249-T423 VanDerWaalsContact NE2-OG1 3.14Å
250	A	95.3	Very high	91.5	Very high	6 Å²	6	56.4 Å²	56.4	5%	0.05	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	154.7	-179.9	0	0	0	0	0	111.5	H252 F421 P422 L437	A250-H252 VanDerWaalsContact C-N 3.32Å; A250-H252 PolarHBondContact O-N 3.01Å; A250-F421 WeakPolarHBondContact O-CD1 3.49Å; A250-P422 HydrophobicContact CB-CB 3.84Å; A250-P422 HydrophobicContact CB-CG 4.04Å; A250-P422 PolarHBondContact N-O 3.29Å; A250-L437 HydrophobicContact CB-CD1 4.14Å; A250-L437 HydrophobicContact CB-CD2 4.25Å
251	R	91	Very high	91.9	Very high	87 Å²	87	47.7 Å²	47.7	33%	0.328	24%	0.241	S	C	.	.	S	Bend	trans	-70	-28	-178.1	-174.5	177.9	-174.9	151.1	6	113.5	D218 E219 F421	D218-R251 WeakPolarHBondContact O-CD 3.19Å; E219-R251 WeakPolarHBondContact O-CB 3.45Å; E219-R251 PolarHBondContact O-N 3.18Å; R251-F421 WeakPolarHBondContact O-CE1 3.4Å
252	H	90.7	Very high	92.3	Very high	130 Å²	130	46.7 Å²	46.7	60%	0.602	23%	0.23	S	C	*	.	S	Bend	trans	-121.9	145	-173.7	-62.4	-61.5	0	0	0	111.5	A250 F421 P422	A250-H252 VanDerWaalsContact C-N 3.32Å; A250-H252 PolarHBondContact O-N 3.01Å; H252-F421 VanDerWaalsContact C-CD1 3.4Å; H252-P422 WeakPolarHBondContact O-CD 3.3Å
253	P	93.4	Very high	92.7	Very high	36 Å²	36	42 Å²	42	23%	0.234	21%	0.206	C	C	.	.			trans	-73.4	157.9	174.8	32.5	-33.3	0	0	0	110.5	F420 F421	P253-F420 CarbonylContact C-O 3.52Å; P253-F420 WeakPolarHBondContact CA-O 3.48Å; P253-F420 WeakPolarHBondContact CB-O 3.49Å; P253-F421 HydrophobicContact CB-CD1 4.29Å; P253-F421 HydrophobicContact CB-CD2 4.09Å; P253-F421 HydrophobicContact CB-CE1 4.14Å; P253-F421 HydrophobicContact CB-CE2 3.89Å; P253-F421 HydrophobicContact CB-CG 4.27Å; P253-F421 HydrophobicContact CB-CZ 3.92Å; P253-F421 VanDerWaalsContact CD-CE1 3.46Å; P253-F421 HydrophobicContact CG-CE1 4.25Å; P253-F421 HydrophobicContact CG-CE2 4.4Å; P253-F421 HydrophobicContact CG-CZ 4Å
254	L	92	Very high	93.2	Very high	5 Å²	5	41.7 Å²	41.7	3%	0.026	20%	0.2	C	C	.	.			trans	-61	143.7	165.9	-67.6	-173.6	0	0	0	110	S258 F261 L278 I329 F331 F420 P422	L254-S258 CarbonylContact C-O 3.58Å; L254-S258 WeakPolarHBondContact CA-O 3.27Å; L254-S258 WeakPolarHBondContact CD2-O 3.21Å; L254-F261 HydrophobicContact CD1-CD1 4.37Å; L254-F261 HydrophobicContact CD2-CD1 4.44Å; L254-L278 HydrophobicContact CD1-CD1 4.22Å; L254-L278 HydrophobicContact CD1-CD2 3.49Å; L254-L278 VanDerWaalsContact CD1-CD2 3.49Å; L254-L278 HydrophobicContact CD1-CG 4.47Å; L254-L278 HydrophobicContact CG-CD2 4.01Å; L254-I329 HydrophobicContact CB-CD1 3.91Å; L254-I329 HydrophobicContact CB-CG1 4.5Å; L254-I329 HydrophobicContact CD1-CD1 4.12Å; L254-I329 HydrophobicContact CD1-CG1 3.95Å; L254-F331 HydrophobicContact CB-CZ 4.32Å; L254-F420 PolarHBondContact N-O 3.4Å; L254-P422 HydrophobicContact CD2-CG 3.69Å; L254-P422 HydrophobicContact CG-CG 3.95Å
255	S	88.9	Confident	93.5	Very high	44 Å²	44	40.5 Å²	40.5	31%	0.308	19%	0.193	S	C	.	.	B	Isolated β-bridge	trans	-138.5	170	-177.5	70.3	0	0	0	0	110.6	R257 S258 H259 F331	S255-R257 PolarHBondContact O-N 3.22Å; S255-R257 PolarHBondContact OG-N 3.07Å; S255-S258 PolarHBondContact N-O 2.96Å; S255-S258 CarbonylContact O-C 3.59Å; S255-S258 PolarHBondContact O-N 2.76Å; S255-S258 VanDerWaalsContact O-N 3.08Å; S255-S258 PolarHBondContact OG-N 3.29Å; S255-H259 WeakPolarHBondContact O-CA 3.31Å; S255-H259 VanDerWaalsContact O-CB 3.31Å; S255-H259 WeakPolarHBondContact O-CB 3.34Å; S255-H259 PolarHBondContact O-N 2.87Å; S255-F331 WeakPolarHBondContact O-CE2 3.35Å
256	T	86.2	Confident	93.7	Very high	83 Å²	83	42.8 Å²	42.8	51%	0.509	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-17.2	176.2	53.1	0	0	0	0	114	F331 Y335	T256-F331 HydrophobicContact CG2-CB 3.82Å; T256-F331 HydrophobicContact CG2-CD1 4.44Å; T256-F331 HydrophobicContact CG2-CD2 4.06Å; T256-F331 HydrophobicContact CG2-CG 3.85Å; T256-Y335 HydrophobicContact CG2-CD1 3.91Å
257	R	82.8	Confident	93.7	Very high	236 Å²	236	45.6 Å²	45.6	89%	0.891	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.6	-27.1	176.7	-62.5	-177.1	-176.4	179.7	1.2	113.7	S255	S255-R257 PolarHBondContact O-N 3.22Å; S255-R257 PolarHBondContact OG-N 3.07Å
258	S	85.7	Confident	93.7	Very high	34 Å²	34	47 Å²	47	24%	0.238	23%	0.232	C	C	.	.	B	Isolated β-bridge	trans	-141.1	92.3	179.2	-176.9	0	0	0	0	107.2	L254 S255 H438	L254-S258 CarbonylContact C-O 3.58Å; L254-S258 WeakPolarHBondContact CA-O 3.27Å; L254-S258 WeakPolarHBondContact CD2-O 3.21Å; S255-S258 PolarHBondContact N-O 2.96Å; S255-S258 CarbonylContact O-C 3.59Å; S255-S258 PolarHBondContact O-N 2.76Å; S255-S258 VanDerWaalsContact O-N 3.08Å; S255-S258 PolarHBondContact OG-N 3.29Å; S258-H438 PolarHBondContact OG-ND1 2.93Å
259	H	91.7	Very high	93.6	Very high	69 Å²	69	48.1 Å²	48.1	32%	0.319	24%	0.243	S	C	.	.			trans	-118.6	4	-162.9	59.2	-84.3	0	0	0	113.4	S255 G328 I329 F331	S255-H259 WeakPolarHBondContact O-CA 3.31Å; S255-H259 VanDerWaalsContact O-CB 3.31Å; S255-H259 WeakPolarHBondContact O-CB 3.34Å; S255-H259 PolarHBondContact O-N 2.87Å; H259-G328 CarbonylContact O-C 3.52Å; H259-G328 WeakPolarHBondContact O-CA 3.43Å; H259-I329 PolarHBondContact O-N 2.99Å; H259-F331 HydrophobicContact CB-CD2 3.86Å; H259-F331 HydrophobicContact CB-CE2 3.58Å
260	Y	95.2	Very high	93.4	Very high	10 Å²	10	55.2 Å²	55.2	4%	0.039	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	144.1	-173.6	176.3	-101	0	0	0	109.9	E262 C327 F400 T402 P439 S441	Y260-E262 HydrophobicContact CD1-CG 4.38Å; Y260-E262 HydrophobicContact CE1-CG 3.4Å; Y260-E262 VanDerWaalsContact CE1-OE1 3.26Å; Y260-E262 WeakPolarHBondContact CE1-OE1 3.46Å; Y260-E262 WeakPolarHBondContact OH-CG 3.31Å; Y260-E262 PolarHBondContact OH-OE1 2.64Å; Y260-C327 WeakPolarHBondContact CA-O 3.28Å; Y260-C327 WeakPolarHBondContact CD2-O 3.5Å; Y260-F400 AromaticContact CD2-CE2 3.54Å; Y260-F400 HydrophobicContact CD2-CE2 3.54Å; Y260-F400 AromaticContact CD2-CZ 3.62Å; Y260-F400 HydrophobicContact CD2-CZ 3.62Å; Y260-F400 AromaticContact CE2-CE2 3.77Å; Y260-F400 HydrophobicContact CE2-CE2 3.77Å; Y260-F400 HydrophobicContact CE2-CZ 4.32Å; Y260-F400 HydrophobicContact CG-CZ 4.3Å; Y260-T402 HydrophobicContact CE2-CG2 3.84Å; Y260-T402 PolarHBondContact OH-OG1 3.1Å; Y260-P439 HydrophobicContact CD1-CG 3.48Å; Y260-P439 VanDerWaalsContact CD1-CG 3.48Å; Y260-P439 HydrophobicContact CE1-CB 4.47Å; Y260-P439 HydrophobicContact CE1-CG 3.76Å; Y260-P439 WeakPolarHBondContact O-CD 3.43Å; Y260-S441 WeakPolarHBondContact CD1-O 3.17Å; Y260-S441 WeakPolarHBondContact CE1-O 3.44Å
261	F	96.3	Very high	93.3	Very high	0 Å²	0	60 Å²	60	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	159.6	177.7	73	-72.1	0	0	0	111.1	L254 L276 G277 L278 G326 C327 P422 I424 D436 L437	L254-F261 HydrophobicContact CD1-CD1 4.37Å; L254-F261 HydrophobicContact CD2-CD1 4.44Å; F261-L276 HydrophobicContact CD2-CD1 3.96Å; F261-L276 HydrophobicContact CE2-CD1 3.13Å; F261-L276 HydrophobicContact CE2-CG 4.14Å; F261-L276 HydrophobicContact CZ-CD1 3.46Å; F261-L276 VanDerWaalsContact CZ-CD1 3.46Å; F261-L276 HydrophobicContact CZ-CG 4Å; F261-G277 WeakPolarHBondContact CZ-O 3.39Å; F261-L278 HydrophobicContact CE1-CD2 3.95Å; F261-G326 VanDerWaalsContact O-CA 3.27Å; F261-G326 WeakPolarHBondContact O-CA 3.45Å; F261-C327 HydrophobicContact CD1-CB 4.25Å; F261-C327 WeakPolarHBondContact CD1-O 3.36Å; F261-C327 HydrophobicContact CE1-CB 3.59Å; F261-C327 HydrophobicContact CZ-CB 4.01Å; F261-C327 PolarHBondContact N-O 2.83Å; F261-C327 PolarHBondContact O-N 3.18Å; F261-P422 HydrophobicContact CD1-CB 3.97Å; F261-P422 HydrophobicContact CD1-CG 4.09Å; F261-P422 HydrophobicContact CD2-CB 4.02Å; F261-P422 HydrophobicContact CE1-CB 3.8Å; F261-P422 HydrophobicContact CE1-CG 4.21Å; F261-P422 HydrophobicContact CE2-CB 3.79Å; F261-P422 HydrophobicContact CG-CB 4.1Å; F261-P422 HydrophobicContact CG-CG 4.41Å; F261-P422 HydrophobicContact CZ-CB 3.71Å; F261-I424 HydrophobicContact CE2-CD1 3.86Å; F261-D436 WeakPolarHBondContact CB-O 3.29Å; F261-L437 HydrophobicContact CB-CD2 4.22Å; F261-L437 HydrophobicContact CD2-CD2 4.06Å; F261-L437 HydrophobicContact CG-CD2 4.36Å
262	E	97.5	Very high	93.5	Very high	29 Å²	29	56.5 Å²	56.5	14%	0.136	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	150.7	-173.7	-69.9	-173.5	158.7	0	0	113.3	Y260 I324 M325 D436 P439	Y260-E262 HydrophobicContact CD1-CG 4.38Å; Y260-E262 HydrophobicContact CE1-CG 3.4Å; Y260-E262 VanDerWaalsContact CE1-OE1 3.26Å; Y260-E262 WeakPolarHBondContact CE1-OE1 3.46Å; Y260-E262 WeakPolarHBondContact OH-CG 3.31Å; Y260-E262 PolarHBondContact OH-OE1 2.64Å; E262-I324 HydrophobicContact CB-CG2 3.96Å; E262-I324 HydrophobicContact CG-CG2 4.13Å; E262-M325 CarbonylContact C-O 3.5Å; E262-M325 WeakPolarHBondContact CA-O 3.34Å; E262-D436 PolarHBondContact N-O 2.85Å; E262-D436 PolarHBondContact O-N 3.46Å; E262-P439 HydrophobicContact CG-CB 4.2Å; E262-P439 HydrophobicContact CG-CG 4.1Å
263	V	97.8	Very high	93.8	Very high	1 Å²	1	54.1 Å²	54.1	1%	0.006	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	119.8	177	175.8	0	0	0	0	109.4	L276 I324 M325 I424 V433 K434 V435	V263-L276 HydrophobicContact CB-CD1 3.99Å; V263-L276 HydrophobicContact CG2-CD1 3.34Å; V263-I324 WeakPolarHBondContact O-CA 3.36Å; V263-M325 PolarHBondContact N-O 3.48Å; V263-M325 PolarHBondContact O-N 3.14Å; V263-I424 HydrophobicContact CG2-CG1 3.93Å; V263-V433 HydrophobicContact CG1-CB 3.56Å; V263-V433 HydrophobicContact CG1-CG1 3.87Å; V263-V433 HydrophobicContact CG1-CG2 3.87Å; V263-K434 CarbonylContact C-O 3.6Å; V263-K434 WeakPolarHBondContact CA-O 3.29Å; V263-V435 HydrophobicContact CG2-CG1 4.16Å; V263-V435 HydrophobicContact CG2-CG2 4.09Å
264	E	98.1	Very high	94.1	Very high	74 Å²	74	52.5 Å²	52.5	35%	0.346	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	126.6	172.2	-178	-169.2	165.5	0	0	109.8	V266 I324 V433 K434	E264-V266 PolarHBondContact O-N 3.12Å; E264-V266 VanDerWaalsContact O-N 3.16Å; E264-I324 HydrophobicContact CB-CG1 4.3Å; E264-I324 HydrophobicContact CG-CG1 4.34Å; E264-V433 CarbonylContact O-C 3.49Å; E264-V433 VanDerWaalsContact O-CA 3.29Å; E264-V433 WeakPolarHBondContact O-CA 3.39Å; E264-K434 HydrophobicContact CB-CB 4.29Å; E264-K434 PolarHBondContact N-O 3.39Å; E264-K434 PolarHBondContact O-N 3.21Å
265	I	98.4	Very high	94.4	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	101.4	175.3	-57	177.6	0	0	0	109.4	P268 I274 A300 C319 G322 D323 M325	I265-P268 HydrophobicContact CG2-CB 4.13Å; I265-I274 HydrophobicContact CD1-CD1 4.49Å; I265-I274 HydrophobicContact CG1-CD1 4.28Å; I265-I274 HydrophobicContact CG2-CD1 3.87Å; I265-A300 HydrophobicContact CD1-CB 4.07Å; I265-C319 HydrophobicContact CD1-CB 3.67Å; I265-G322 PolarHBondContact O-N 3.33Å; I265-D323 PolarHBondContact N-O 2.99Å; I265-M325 HydrophobicContact CD1-SD 3.91Å; I265-M325 HydrophobicContact CG1-SD 4.35Å
266	V	98.1	Very high	94.8	Very high	48 Å²	48	50.3 Å²	50.3	29%	0.291	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	-44.8	179.3	178	0	0	0	0	110.9	L232 E264 K321 K432 K434	L232-V266 HydrophobicContact CD1-CB 4.46Å; L232-V266 HydrophobicContact CD1-CG2 4.17Å; E264-V266 PolarHBondContact O-N 3.12Å; E264-V266 VanDerWaalsContact O-N 3.16Å; V266-K321 WeakPolarHBondContact O-CE 3.45Å; V266-K321 PolarHBondContact O-NZ 2.83Å; V266-K432 HydrophobicContact CB-CB 4.36Å; V266-K432 WeakPolarHBondContact CB-O 3.48Å; V266-K432 PolarHBondContact N-O 3.44Å; V266-K434 HydrophobicContact CG2-CB 3.83Å
267	D	97.5	Very high	95.4	Very high	60 Å²	60	46.3 Å²	46.3	32%	0.321	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	117.1	174.5	-158.7	-34.9	0	0	0	109.3	G269 E431 K432	D267-G269 PolarHBondContact O-N 2.98Å; D267-G269 PolarHBondContact OD1-N 3.44Å; D267-E431 WeakPolarHBondContact O-CA 3.38Å; D267-K432 HydrophobicContact CB-CB 3.92Å; D267-K432 HydrophobicContact CB-CD 4.47Å; D267-K432 HydrophobicContact CB-CG 4.13Å; D267-K432 PolarHBondContact N-O 2.96Å; D267-K432 PolarHBondContact O-N 3.04Å
268	P	97	Very high	96.1	Very high	31 Å²	31	35.1 Å²	35.1	20%	0.201	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	-4.8	178.3	31.3	-36.3	0	0	0	113.2	I265 C272 K321 E431	I265-P268 HydrophobicContact CG2-CB 4.13Å; P268-C272 HydrophobicContact CB-CB 3.77Å; P268-C272 VanDerWaalsContact CB-SG 3.5Å; P268-C272 WeakPolarHBondContact O-CA 3.33Å; P268-C272 PolarHBondContact O-N 2.82Å; P268-K321 HydrophobicContact CG-CB 4.38Å; P268-E431 WeakPolarHBondContact O-CG 3.45Å
269	G	95.2	Very high	96.7	Very high	23 Å²	23	33.5 Å²	33.5	24%	0.237	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.8	-155.6	-172.7	0	0	0	0	0	112.1	D267 C429	D267-G269 PolarHBondContact O-N 2.98Å; D267-G269 PolarHBondContact OD1-N 3.44Å; G269-C429 WeakPolarHBondContact CA-O 3.38Å
270	E	93	Very high	96.9	Very high	153 Å²	153	34.1 Å²	34.1	72%	0.715	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-36.2	-176.8	-62.8	177.7	176.2	0	0	113.7	S428 C429	E270-S428 PolarHBondContact N-OG 2.9Å; E270-C429 PolarHBondContact N-O 2.94Å; E270-C429 VanDerWaalsContact N-O 3.15Å
271	K	92.8	Very high	96.7	Very high	108 Å²	108	39.4 Å²	39.4	47%	0.47	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-125.3	-12.5	-170.1	-59	-178.6	-176.8	175.1	0	115.6	Y273 S428	K271-Y273 VanDerWaalsContact C-N 3.33Å; K271-Y273 HydrophobicContact CB-CD1 4.21Å; K271-Y273 HydrophobicContact CB-CD2 3.82Å; K271-Y273 HydrophobicContact CB-CE1 4.05Å; K271-Y273 HydrophobicContact CB-CE2 3.67Å; K271-Y273 HydrophobicContact CB-CG 4.09Å; K271-Y273 HydrophobicContact CD-CD2 4.04Å; K271-Y273 HydrophobicContact CD-CE2 3.26Å; K271-Y273 HydrophobicContact CG-CE2 4.1Å; K271-S428 PolarHBondContact N-OG 2.97Å; K271-S428 VanDerWaalsContact N-OG 3.07Å
272	C	96.1	Very high	96.6	Very high	12 Å²	12	44 Å²	44	8%	0.081	21%	0.214	C	C	.	.			trans	61.7	33.3	-178.4	-155.9	0	0	0	0	114.5	P268 I274 D301 E431	P268-C272 HydrophobicContact CB-CB 3.77Å; P268-C272 VanDerWaalsContact CB-SG 3.5Å; P268-C272 WeakPolarHBondContact O-CA 3.33Å; P268-C272 PolarHBondContact O-N 2.82Å; C272-I274 PolarHBondContact O-N 3.09Å; C272-D301 WeakPolarHBondContact O-CB 3.48Å; C272-D301 PolarHBondContact O-N 3.1Å; C272-E431 VanDerWaalsContact C-OE1 3.28Å; C272-E431 WeakPolarHBondContact CA-OE1 3.41Å; C272-E431 PolarHBondContact N-OE1 3.31Å
273	Y	97.2	Very high	96.4	Very high	81 Å²	81	42.6 Å²	42.6	32%	0.318	21%	0.207	S	C	.	.			trans	-74.2	61.7	171.5	-61.3	-30.1	0	0	0	111.3	K271 H288 D301 M426 L427 E431	K271-Y273 VanDerWaalsContact C-N 3.33Å; K271-Y273 HydrophobicContact CB-CD1 4.21Å; K271-Y273 HydrophobicContact CB-CD2 3.82Å; K271-Y273 HydrophobicContact CB-CE1 4.05Å; K271-Y273 HydrophobicContact CB-CE2 3.67Å; K271-Y273 HydrophobicContact CB-CG 4.09Å; K271-Y273 HydrophobicContact CD-CD2 4.04Å; K271-Y273 HydrophobicContact CD-CE2 3.26Å; K271-Y273 HydrophobicContact CG-CE2 4.1Å; Y273-H288 PolarHBondContact O-NE2 2.91Å; Y273-D301 HydrophobicContact CD1-CB 3.72Å; Y273-D301 WeakPolarHBondContact CD1-OD2 3.45Å; Y273-D301 HydrophobicContact CE1-CB 4.11Å; Y273-D301 WeakPolarHBondContact CE1-OD2 3.26Å; Y273-M426 WeakPolarHBondContact O-CA 3.37Å; Y273-L427 HydrophobicContact CD2-CB 4.31Å; Y273-L427 HydrophobicContact CD2-CD2 4.33Å; Y273-L427 HydrophobicContact CD2-CG 4.33Å; Y273-L427 PolarHBondContact O-N 3.34Å; Y273-E431 VanDerWaalsContact C-OE1 3.31Å; Y273-E431 WeakPolarHBondContact CA-OE1 3.15Å; Y273-E431 PolarHBondContact N-OE1 3.36Å
274	I	98.4	Very high	96.2	Very high	1 Å²	1	44.5 Å²	44.5	1%	0.005	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	129.4	176.8	-60.9	167.2	0	0	0	107.7	I265 C272 A300 G425 M426 E431 V433	I265-I274 HydrophobicContact CD1-CD1 4.49Å; I265-I274 HydrophobicContact CG1-CD1 4.28Å; I265-I274 HydrophobicContact CG2-CD1 3.87Å; C272-I274 PolarHBondContact O-N 3.09Å; I274-A300 HydrophobicContact CB-CB 4.14Å; I274-A300 WeakPolarHBondContact O-CB 3.41Å; I274-A300 PolarHBondContact O-N 3.06Å; I274-G425 WeakPolarHBondContact CA-O 3.46Å; I274-M426 HydrophobicContact CG1-CG 4.39Å; I274-E431 HydrophobicContact CD1-CG 4.18Å; I274-E431 HydrophobicContact CG1-CB 4.41Å; I274-E431 HydrophobicContact CG1-CG 3.99Å; I274-V433 HydrophobicContact CD1-CG1 3.81Å; I274-V433 HydrophobicContact CG1-CG1 4.4Å; I274-V433 HydrophobicContact CG2-CG1 3.91Å
275	A	98.4	Very high	96	Very high	1 Å²	1	46.4 Å²	46.4	1%	0.008	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	147.2	172.4	0	0	0	0	0	112.3	H288 Y298 H299 I424 G425	A275-H288 WeakPolarHBondContact CB-CE1 3.39Å; A275-H288 WeakPolarHBondContact CB-ND1 3.16Å; A275-H288 PolarHBondContact N-CE1 2.96Å; A275-Y298 WeakPolarHBondContact CA-O 3.42Å; A275-H299 WeakPolarHBondContact CB-CD2 3.4Å; A275-H299 WeakPolarHBondContact CB-NE2 3.29Å; A275-I424 WeakPolarHBondContact O-CA 3.38Å; A275-G425 PolarHBondContact N-O 3.41Å; A275-G425 PolarHBondContact O-N 2.91Å
276	L	98.3	Very high	95.6	Very high	2 Å²	2	49.7 Å²	49.7	1%	0.01	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	128.3	178.1	-178	73.5	0	0	0	109	F261 V263 A297 Y298 M325 C327 F401 I424	F261-L276 HydrophobicContact CD2-CD1 3.96Å; F261-L276 HydrophobicContact CE2-CD1 3.13Å; F261-L276 HydrophobicContact CE2-CG 4.14Å; F261-L276 HydrophobicContact CZ-CD1 3.46Å; F261-L276 VanDerWaalsContact CZ-CD1 3.46Å; F261-L276 HydrophobicContact CZ-CG 4Å; V263-L276 HydrophobicContact CB-CD1 3.99Å; V263-L276 HydrophobicContact CG2-CD1 3.34Å; L276-A297 CarbonylContact O-C 3.52Å; L276-A297 WeakPolarHBondContact O-CA 3.39Å; L276-Y298 PolarHBondContact N-O 3.31Å; L276-Y298 PolarHBondContact O-N 3.08Å; L276-M325 HydrophobicContact CB-CE 4.07Å; L276-M325 HydrophobicContact CD2-CB 3.72Å; L276-C327 HydrophobicContact CD2-CB 3.7Å; L276-C327 HydrophobicContact CG-CB 3.83Å; L276-F401 WeakPolarHBondContact O-CE1 3.26Å; L276-I424 HydrophobicContact CD1-CG1 4.34Å
277	G	98.1	Very high	95.5	Very high	0 Å²	0	53 Å²	53	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-172.9	-162.5	176.1	0	0	0	0	0	115.4	F261 V296 T423	F261-G277 WeakPolarHBondContact CZ-O 3.39Å; G277-V296 CarbonylContact C-O 3.48Å; G277-V296 VanDerWaalsContact CA-O 3.25Å; G277-V296 WeakPolarHBondContact CA-O 3.24Å; G277-T423 PolarHBondContact N-O 3.32Å; G277-T423 PolarHBondContact O-N 2.86Å
278	L	98.2	Very high	95.4	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	141	-179.1	-61.7	173.9	0	0	0	109.3	L254 F261 S295 V296 I329 V399 F420 F421	L254-L278 HydrophobicContact CD1-CD1 4.22Å; L254-L278 HydrophobicContact CD1-CD2 3.49Å; L254-L278 VanDerWaalsContact CD1-CD2 3.49Å; L254-L278 HydrophobicContact CD1-CG 4.47Å; L254-L278 HydrophobicContact CG-CD2 4.01Å; F261-L278 HydrophobicContact CE1-CD2 3.95Å; L278-S295 CarbonylContact O-C 3.54Å; L278-S295 WeakPolarHBondContact O-CA 3.46Å; L278-S295 WeakPolarHBondContact O-CB 3.07Å; L278-S295 PolarHBondContact O-OG 2.9Å; L278-V296 HydrophobicContact CB-CG1 4.31Å; L278-V296 PolarHBondContact N-O 3.01Å; L278-V296 PolarHBondContact O-N 2.92Å; L278-I329 HydrophobicContact CD1-CD1 3.76Å; L278-I329 HydrophobicContact CD1-CG1 3.54Å; L278-V399 HydrophobicContact CD1-CG1 3.83Å; L278-V399 HydrophobicContact CD1-CG2 3.89Å; L278-F420 HydrophobicContact CB-CB 3.97Å; L278-F420 HydrophobicContact CB-CD1 3.79Å; L278-F420 HydrophobicContact CB-CE1 4.48Å; L278-F420 HydrophobicContact CB-CG 3.96Å; L278-F420 HydrophobicContact CD1-CB 4.18Å; L278-F420 HydrophobicContact CD1-CG 4.36Å; L278-F420 HydrophobicContact CD2-CB 4.44Å; L278-F420 HydrophobicContact CG-CB 4.42Å; L278-F421 WeakPolarHBondContact CA-O 3.31Å
279	A	97.6	Very high	95.4	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	160.1	176.9	0	0	0	0	0	111.9	Y283 G294 F421 T423	A279-Y283 HydrophobicContact CB-CD1 4.21Å; A279-Y283 HydrophobicContact CB-CD2 3.67Å; A279-Y283 HydrophobicContact CB-CE2 4.28Å; A279-Y283 HydrophobicContact CB-CG 3.63Å; A279-G294 CarbonylContact C-O 3.58Å; A279-G294 WeakPolarHBondContact CA-O 3.3Å; A279-F421 PolarHBondContact N-O 2.88Å; A279-F421 PolarHBondContact O-N 3.01Å; A279-T423 HydrophobicContact CB-CG2 4.38Å; A279-T423 WeakPolarHBondContact CB-OG1 3.34Å
280	R	94.8	Very high	95.5	Very high	83 Å²	83	47.8 Å²	47.8	31%	0.313	22%	0.217	S	C	.	.			trans	-62.8	159.9	169.8	70.4	-178.4	-150.8	-156	4.3	111.5	Q249 D282 Y283 G294 P416	Q249-R280 PolarHBondContact NE2-O 2.84Å; R280-D282 VanDerWaalsContact C-N 3.29Å; R280-D282 VanDerWaalsContact CD-OD1 3.27Å; R280-D282 WeakPolarHBondContact CD-OD1 3.1Å; R280-D282 VanDerWaalsContact CG-OD1 3.3Å; R280-D282 WeakPolarHBondContact CG-OD1 3.45Å; R280-D282 IonicContact CZ-OD1 3.35Å; R280-D282 IonicContact CZ-OD2 3.69Å; R280-D282 VanDerWaalsContact NE-CG 3.33Å; R280-D282 IonicContact NE-OD1 2.63Å; R280-D282 PolarHBondContact NE-OD1 2.79Å; R280-D282 IonicContact NE-OD2 2.92Å; R280-D282 PolarHBondContact NE-OD2 2.77Å; R280-D282 IonicContact NH2-OD1 2.73Å; R280-D282 IonicContact NH2-OD2 2.62Å; R280-D282 PolarHBondContact NH2-OD2 3.43Å; R280-D282 PolarHBondContact O-N 2.96Å; R280-Y283 WeakPolarHBondContact O-CB 3.43Å; R280-Y283 PolarHBondContact O-N 3.28Å; R280-G294 PolarHBondContact N-O 2.77Å; R280-P416 HydrophobicContact CB-CB 3.77Å; R280-P416 HydrophobicContact CB-CG 3.71Å
281	K	92.9	Very high	95.7	Very high	120 Å²	120	42.7 Å²	42.7	52%	0.522	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-37.7	-174.3	-172.6	176.8	-179.5	179	0	114.4	R222 Q249 F421	R222-K281 PolarHBondContact NH1-O 2.98Å; Q249-K281 PolarHBondContact OE1-O 2.78Å; Q249-K281 VanDerWaalsContact OE1-O 3.09Å; K281-F421 HydrophobicContact CB-CD2 4.24Å; K281-F421 HydrophobicContact CB-CE2 3.72Å; K281-F421 HydrophobicContact CB-CZ 4.15Å; K281-F421 HydrophobicContact CD-CZ 4.33Å; K281-F421 HydrophobicContact CG-CE2 4.2Å; K281-F421 HydrophobicContact CG-CZ 4.1Å
282	D	92.7	Very high	95.8	Very high	96 Å²	96	38.5 Å²	38.5	51%	0.513	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.7	25.6	-175.8	67.3	-46.5	0	0	0	112.9	R280	R280-D282 VanDerWaalsContact C-N 3.29Å; R280-D282 VanDerWaalsContact CD-OD1 3.27Å; R280-D282 WeakPolarHBondContact CD-OD1 3.1Å; R280-D282 VanDerWaalsContact CG-OD1 3.3Å; R280-D282 WeakPolarHBondContact CG-OD1 3.45Å; R280-D282 IonicContact CZ-OD1 3.35Å; R280-D282 IonicContact CZ-OD2 3.69Å; R280-D282 VanDerWaalsContact NE-CG 3.33Å; R280-D282 IonicContact NE-OD1 2.63Å; R280-D282 PolarHBondContact NE-OD1 2.79Å; R280-D282 IonicContact NE-OD2 2.92Å; R280-D282 PolarHBondContact NE-OD2 2.77Å; R280-D282 IonicContact NH2-OD1 2.73Å; R280-D282 IonicContact NH2-OD2 2.62Å; R280-D282 PolarHBondContact NH2-OD2 3.43Å; R280-D282 PolarHBondContact O-N 2.96Å
283	Y	94.3	Very high	95.6	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	20%	0.199	C	C	.	.			trans	-53.1	138.9	-178	-164.9	-107.5	0	0	0	113	R222 L247 A279 R280 K285 R287 H288 G290 W291 S292	R222-Y283 PolarHBondContact NH1-O 2.63Å; R222-Y283 PolarHBondContact NH2-O 3.34Å; L247-Y283 HydrophobicContact CD1-CD1 4.35Å; L247-Y283 HydrophobicContact CD2-CD1 4.45Å; A279-Y283 HydrophobicContact CB-CD1 4.21Å; A279-Y283 HydrophobicContact CB-CD2 3.67Å; A279-Y283 HydrophobicContact CB-CE2 4.28Å; A279-Y283 HydrophobicContact CB-CG 3.63Å; R280-Y283 WeakPolarHBondContact O-CB 3.43Å; R280-Y283 PolarHBondContact O-N 3.28Å; Y283-K285 PolarHBondContact O-N 3.02Å; Y283-R287 HydrophobicContact CE1-CB 4.17Å; Y283-R287 WeakPolarHBondContact CE1-O 3.35Å; Y283-H288 PolarHBondContact OH-O 3.27Å; Y283-G290 PolarHBondContact OH-N 3.31Å; Y283-W291 PolarHBondContact OH-N 3.24Å; Y283-W291 VanDerWaalsContact OH-N 3.17Å; Y283-S292 PolarHBondContact OH-N 3.36Å
284	P	93.4	Very high	95.5	Very high	42 Å²	42	42.6 Å²	42.6	27%	0.273	20%	0.197	S	C	.	.			trans	-60	129.9	-178.3	-21.9	32.4	0	0	0	112.3	N286 R287	P284-N286 VanDerWaalsContact C-N 3.26Å; P284-N286 PolarHBondContact O-N 2.98Å; P284-R287 HydrophobicContact CB-CB 4.08Å; P284-R287 HydrophobicContact CB-CG 3.71Å; P284-R287 HydrophobicContact CG-CG 4.21Å; P284-R287 PolarHBondContact O-N 2.77Å
285	K	92.9	Very high	95.4	Very high	113 Å²	113	42.6 Å²	42.6	49%	0.491	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-19.7	-173.1	69.3	-174.4	-172.2	173.8	0	114.7	H224 Y283	H224-K285 HydrophobicContact CB-CB 4Å; H224-K285 PolarHBondContact ND1-O 3.33Å; Y283-K285 PolarHBondContact O-N 3.02Å
286	N	91	Very high	95.4	Very high	69 Å²	69	42.6 Å²	42.6	37%	0.369	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.9	17.7	-177.1	62.6	-35.8	0	0	0	112.6	P284	P284-N286 VanDerWaalsContact C-N 3.26Å; P284-N286 PolarHBondContact O-N 2.98Å
287	R	95.2	Very high	95.4	Very high	119 Å²	119	42.5 Å²	42.5	45%	0.449	20%	0.196	S	C	.	.	S	Bend	trans	-119.9	138.6	177.3	-69.2	-83.2	-162	165.2	2.2	109.1	Y283 P284 S292	Y283-R287 HydrophobicContact CE1-CB 4.17Å; Y283-R287 WeakPolarHBondContact CE1-O 3.35Å; P284-R287 HydrophobicContact CB-CB 4.08Å; P284-R287 HydrophobicContact CB-CG 3.71Å; P284-R287 HydrophobicContact CG-CG 4.21Å; P284-R287 PolarHBondContact O-N 2.77Å; R287-S292 WeakPolarHBondContact CG-OG 3.29Å
288	H	96	Very high	95.4	Very high	3 Å²	3	42.5 Å²	42.5	1%	0.014	20%	0.196	C	C	.	.			trans	-65.5	143.8	174	-139.7	-68.4	0	0	0	110.1	V245 Y273 A275 Y283 G290 W291 H299	V245-H288 HydrophobicContact CG2-CB 4.38Å; Y273-H288 PolarHBondContact O-NE2 2.91Å; A275-H288 WeakPolarHBondContact CB-CE1 3.39Å; A275-H288 WeakPolarHBondContact CB-ND1 3.16Å; A275-H288 PolarHBondContact N-CE1 2.96Å; Y283-H288 PolarHBondContact OH-O 3.27Å; H288-G290 PolarHBondContact O-N 3.07Å; H288-W291 HydrophobicContact CB-CD2 3.41Å; H288-W291 VanDerWaalsContact CB-CD2 3.41Å; H288-W291 HydrophobicContact CB-CE3 3.59Å; H288-W291 HydrophobicContact CB-CG 3.98Å; H288-W291 HydrophobicContact CB-CH2 3.91Å; H288-W291 HydrophobicContact CB-CZ2 3.76Å; H288-W291 HydrophobicContact CB-CZ3 3.83Å; H288-W291 WeakPolarHBondContact O-CB 3.39Å; H288-W291 PolarHBondContact O-N 2.81Å; H288-H299 AromaticContact CG-CE1 3.78Å; H288-H299 AromaticContact ND1-CE1 3.38Å; H288-H299 PolarHBondContact ND1-CE1 2.87Å; H288-H299 AromaticContact ND1-NE2 3.68Å
289	P	97.7	Very high	95.4	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.8	138.5	174.3	-32.2	38.9	0	0	0	112.5	L247 A297 H299 T423	L247-P289 HydrophobicContact CD1-CG 4.06Å; P289-A297 HydrophobicContact CB-CB 3.63Å; P289-A297 VanDerWaalsContact O-CB 3.24Å; P289-A297 WeakPolarHBondContact O-CB 3.3Å; P289-H299 PolarHBondContact O-NE2 2.92Å; P289-T423 HydrophobicContact CB-CG2 4.43Å; P289-T423 HydrophobicContact CG-CG2 3.69Å
290	G	97.4	Very high	95.5	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	88	-14.3	-176.9	0	0	0	0	0	115.5	Y283 H288 S295 F306 H307 G308 S309	Y283-G290 PolarHBondContact OH-N 3.31Å; H288-G290 PolarHBondContact O-N 3.07Å; G290-S295 PolarHBondContact N-OG 2.62Å; G290-F306 CarbonylContact O-C 3.57Å; G290-H307 CarbonylContact O-C 3.57Å; G290-H307 PolarHBondContact O-N 3.14Å; G290-G308 PolarHBondContact O-N 2.56Å; G290-S309 PolarHBondContact O-N 3.1Å
291	W	96.1	Very high	95.5	Very high	46 Å²	46	40.4 Å²	40.4	17%	0.174	19%	0.191	C	C	.	.	S	Bend	trans	-81.9	-21.9	-177	-68.5	0	0	0	0	115.2	I242 Y283 H288 H299 F306 S309 L427	I242-W291 HydrophobicContact CB-CH2 4.45Å; I242-W291 HydrophobicContact CB-CZ3 4.19Å; Y283-W291 PolarHBondContact OH-N 3.24Å; Y283-W291 VanDerWaalsContact OH-N 3.17Å; H288-W291 HydrophobicContact CB-CD2 3.41Å; H288-W291 VanDerWaalsContact CB-CD2 3.41Å; H288-W291 HydrophobicContact CB-CE3 3.59Å; H288-W291 HydrophobicContact CB-CG 3.98Å; H288-W291 HydrophobicContact CB-CH2 3.91Å; H288-W291 HydrophobicContact CB-CZ2 3.76Å; H288-W291 HydrophobicContact CB-CZ3 3.83Å; H288-W291 WeakPolarHBondContact O-CB 3.39Å; H288-W291 PolarHBondContact O-N 2.81Å; W291-H299 AromaticContact NE1-CE1 3.36Å; W291-H299 PolarHBondContact NE1-CE1 3.35Å; W291-F306 AromaticContact CD1-CD1 3.51Å; W291-F306 AromaticContact CD1-CG 3.97Å; W291-F306 AromaticContact NE1-CD1 3.5Å; W291-F306 AromaticContact NE1-CE1 3.56Å; W291-S309 WeakPolarHBondContact CA-O 3.34Å; W291-S309 CarbonylContact O-C 3.46Å; W291-S309 WeakPolarHBondContact O-CA 3.32Å; W291-S309 PolarHBondContact O-N 3.12Å; W291-L427 HydrophobicContact CH2-CD2 4.36Å
292	S	94.4	Very high	95.7	Very high	20 Å²	20	36.9 Å²	36.9	14%	0.14	18%	0.178	C	C	.	.	S	Bend	trans	-121.4	153.3	-179.9	-57.3	0	0	0	0	111.5	Y283 R287 S295 G308	Y283-S292 PolarHBondContact OH-N 3.36Å; R287-S292 WeakPolarHBondContact CG-OG 3.29Å; S292-S295 WeakPolarHBondContact O-CB 3.22Å; S292-S295 PolarHBondContact O-N 2.9Å; S292-G308 WeakPolarHBondContact O-CA 3.46Å
293	R	93.1	Very high	95.9	Very high	154 Å²	154	32.4 Å²	32.4	58%	0.581	15%	0.154	S	C	*	.	S	Bend	trans	-49.6	145.2	-175.8	-64.4	-176.7	-173.1	-124	-0.9	112.8	S295 E386	R293-S295 VanDerWaalsContact C-N 3.34Å; R293-E386 IonicContact CZ-OE2 3.28Å; R293-E386 IonicContact NE-OE2 2.73Å; R293-E386 PolarHBondContact NE-OE2 3.44Å; R293-E386 IonicContact NH2-OE2 2.65Å
294	G	93.6	Very high	96.1	Very high	26 Å²	26	36 Å²	36	27%	0.268	17%	0.17	S	C	.	.	S	Bend	trans	73.4	25.6	-177.9	0	0	0	0	0	113.3	A279 R280 F420	A279-G294 CarbonylContact C-O 3.58Å; A279-G294 WeakPolarHBondContact CA-O 3.3Å; R280-G294 PolarHBondContact N-O 2.77Å; G294-F420 WeakPolarHBondContact O-CE1 3.27Å
295	S	97.5	Very high	96.4	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.007	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	145.1	173.4	-177.2	0	0	0	0	112.4	L278 G290 S292 R293 H307 G308	L278-S295 CarbonylContact O-C 3.54Å; L278-S295 WeakPolarHBondContact O-CA 3.46Å; L278-S295 WeakPolarHBondContact O-CB 3.07Å; L278-S295 PolarHBondContact O-OG 2.9Å; G290-S295 PolarHBondContact N-OG 2.62Å; S292-S295 WeakPolarHBondContact O-CB 3.22Å; S292-S295 PolarHBondContact O-N 2.9Å; R293-S295 VanDerWaalsContact C-N 3.34Å; S295-H307 WeakPolarHBondContact O-CA 3.23Å; S295-H307 PolarHBondContact O-CD2 2.7Å; S295-G308 PolarHBondContact O-N 3.07Å
296	V	98.1	Very high	96.6	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	131.8	173.9	58.1	0	0	0	0	109.4	G277 L278 I305 F306 H307 V399 F401 K411 A413	G277-V296 CarbonylContact C-O 3.48Å; G277-V296 VanDerWaalsContact CA-O 3.25Å; G277-V296 WeakPolarHBondContact CA-O 3.24Å; L278-V296 HydrophobicContact CB-CG1 4.31Å; L278-V296 PolarHBondContact N-O 3.01Å; L278-V296 PolarHBondContact O-N 2.92Å; V296-I305 HydrophobicContact CG2-CD1 4Å; V296-I305 HydrophobicContact CG2-CG1 4.18Å; V296-F306 CarbonylContact C-O 3.59Å; V296-F306 VanDerWaalsContact CA-O 3.3Å; V296-F306 WeakPolarHBondContact CA-O 3.36Å; V296-H307 HydrophobicContact CG2-CB 4.36Å; V296-V399 HydrophobicContact CG1-CB 4.26Å; V296-V399 HydrophobicContact CG1-CG1 4.11Å; V296-V399 HydrophobicContact CG1-CG2 3.91Å; V296-F401 HydrophobicContact CG2-CE2 4.34Å; V296-F401 HydrophobicContact CG2-CZ 4.25Å; V296-K411 HydrophobicContact CG2-CB 4.49Å; V296-K411 HydrophobicContact CG2-CG 4.37Å; V296-A413 HydrophobicContact CG1-CB 4.38Å
297	A	98.5	Very high	96.9	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	153.5	-174.3	0	0	0	0	0	113.3	L276 P289 I305 F306	L276-A297 CarbonylContact O-C 3.52Å; L276-A297 WeakPolarHBondContact O-CA 3.39Å; P289-A297 HydrophobicContact CB-CB 3.63Å; P289-A297 VanDerWaalsContact O-CB 3.24Å; P289-A297 WeakPolarHBondContact O-CB 3.3Å; A297-I305 WeakPolarHBondContact O-CA 3.46Å; A297-I305 WeakPolarHBondContact O-CG1 3.39Å; A297-F306 PolarHBondContact N-O 3.23Å; A297-F306 PolarHBondContact O-N 2.92Å
298	Y	98.4	Very high	96.8	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	129.5	173.4	175.4	-123.2	0	0	0	109.7	A275 L276 G303 K304 F315 P317 M325 F401 I408	A275-Y298 WeakPolarHBondContact CA-O 3.42Å; L276-Y298 PolarHBondContact N-O 3.31Å; L276-Y298 PolarHBondContact O-N 3.08Å; Y298-G303 WeakPolarHBondContact CE2-O 3.41Å; Y298-K304 WeakPolarHBondContact CD2-O 3.39Å; Y298-F315 AromaticContact CD2-CD1 3.85Å; Y298-F315 HydrophobicContact CD2-CD1 3.85Å; Y298-F315 HydrophobicContact CD2-CE1 4.42Å; Y298-F315 HydrophobicContact CE2-CD1 4.15Å; Y298-P317 VanDerWaalsContact OH-C 3.29Å; Y298-P317 PolarHBondContact OH-O 3.27Å; Y298-M325 HydrophobicContact CD1-CE 3.43Å; Y298-M325 VanDerWaalsContact CD1-CE 3.43Å; Y298-M325 HydrophobicContact CE1-CE 3.72Å; Y298-M325 HydrophobicContact CG-CE 4.35Å; Y298-F401 VanDerWaalsContact CB-CD1 3.41Å; Y298-F401 HydrophobicContact CG-CD1 4.33Å; Y298-I408 HydrophobicContact CD1-CD1 3.87Å; Y298-I408 HydrophobicContact CD2-CD1 4.16Å; Y298-I408 HydrophobicContact CE1-CD1 3.46Å; Y298-I408 VanDerWaalsContact CE1-CD1 3.46Å; Y298-I408 HydrophobicContact CE2-CD1 3.74Å; Y298-I408 HydrophobicContact CG-CD1 4.21Å; Y298-I408 VanDerWaalsContact CZ-CD1 3.4Å
299	H	98.2	Very high	96.5	Very high	7 Å²	7	27.6 Å²	27.6	3%	0.032	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	131.8	-174.1	-73.8	-142	0	0	0	110.7	A275 H288 P289 W291 D301 G303 K304 F306	A275-H299 WeakPolarHBondContact CB-CD2 3.4Å; A275-H299 WeakPolarHBondContact CB-NE2 3.29Å; H288-H299 AromaticContact CG-CE1 3.78Å; H288-H299 AromaticContact ND1-CE1 3.38Å; H288-H299 PolarHBondContact ND1-CE1 2.87Å; H288-H299 AromaticContact ND1-NE2 3.68Å; P289-H299 PolarHBondContact O-NE2 2.92Å; W291-H299 AromaticContact NE1-CE1 3.36Å; W291-H299 PolarHBondContact NE1-CE1 3.35Å; H299-D301 WeakPolarHBondContact CB-OD1 3.25Å; H299-G303 WeakPolarHBondContact O-CA 3.48Å; H299-G303 PolarHBondContact O-N 2.89Å; H299-G303 VanDerWaalsContact O-N 3.07Å; H299-K304 PolarHBondContact N-O 2.91Å; H299-K304 VanDerWaalsContact N-O 3.09Å; H299-F306 HydrophobicContact CB-CD2 4.22Å; H299-F306 HydrophobicContact CB-CE2 3.87Å; H299-F306 AromaticContact CD2-CD2 3.35Å; H299-F306 WeakPolarHBondContact CD2-CD2 3.34Å; H299-F306 AromaticContact CD2-CE2 3.81Å; H299-F306 AromaticContact CE1-CD2 3.74Å; H299-F306 AromaticContact CE1-CE2 3.84Å; H299-F306 AromaticContact CG-CD2 3.53Å; H299-F306 AromaticContact CG-CE2 3.45Å; H299-F306 VanDerWaalsContact CG-CE2 3.45Å; H299-F306 AromaticContact ND1-CD2 3.77Å; H299-F306 AromaticContact ND1-CE2 3.48Å; H299-F306 WeakPolarHBondContact ND1-CE2 3.2Å; H299-F306 AromaticContact NE2-CD2 3.5Å; H299-F306 AromaticContact NE2-CG 3.92Å
300	A	98.1	Very high	96.1	Very high	0 Å²	0	30 Å²	30	0%	0	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-35.6	-173	0	0	0	0	0	113	I265 I274 R318 C319 M325	I265-A300 HydrophobicContact CD1-CB 4.07Å; I274-A300 HydrophobicContact CB-CB 4.14Å; I274-A300 WeakPolarHBondContact O-CB 3.41Å; I274-A300 PolarHBondContact O-N 3.06Å; A300-R318 CarbonylContact O-C 3.54Å; A300-R318 WeakPolarHBondContact O-CA 3.25Å; A300-C319 HydrophobicContact CB-CB 3.95Å; A300-C319 PolarHBondContact O-N 2.84Å; A300-M325 HydrophobicContact CB-CE 3.97Å; A300-M325 HydrophobicContact CB-SD 3.81Å
301	D	96.8	Very high	95.8	Very high	32 Å²	32	35.3 Å²	35.3	17%	0.171	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-37	-172.5	65.7	-45.2	0	0	0	113	C272 Y273 H299 R318	C272-D301 WeakPolarHBondContact O-CB 3.48Å; C272-D301 PolarHBondContact O-N 3.1Å; Y273-D301 HydrophobicContact CD1-CB 3.72Å; Y273-D301 WeakPolarHBondContact CD1-OD2 3.45Å; Y273-D301 HydrophobicContact CE1-CB 4.11Å; Y273-D301 WeakPolarHBondContact CE1-OD2 3.26Å; H299-D301 WeakPolarHBondContact CB-OD1 3.25Å; D301-R318 WeakPolarHBondContact O-CD 3.17Å; D301-R318 WeakPolarHBondContact O-CG 3.37Å; D301-R318 PolarHBondContact O-NE 2.88Å; D301-R318 PolarHBondContact O-NH2 2.97Å
302	D	96.5	Very high	95.8	Very high	47 Å²	47	33.9 Å²	33.9	25%	0.251	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-122.1	-12.4	-175.8	72.9	-0.6	0	0	0	114	K304	D302-K304 VanDerWaalsContact C-N 3.28Å; D302-K304 HydrophobicContact CB-CG 4.39Å; D302-K304 VanDerWaalsContact OD1-CB 3.29Å; D302-K304 WeakPolarHBondContact OD1-CB 3.35Å; D302-K304 PolarHBondContact OD1-N 2.84Å; D302-K304 WeakPolarHBondContact OD2-CD 3.33Å; D302-K304 WeakPolarHBondContact OD2-CE 3.4Å; D302-K304 VanDerWaalsContact OD2-CG 3.28Å; D302-K304 WeakPolarHBondContact OD2-CG 3.16Å; D302-K304 IonicContact OD2-NZ 2.71Å; D302-K304 PolarHBondContact OD2-NZ 2.87Å
303	G	97.5	Very high	95.9	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.01	21%	0.214	C	C	.	.			trans	73.4	18.1	-178.3	0	0	0	0	0	113.5	Y298 H299 G316	Y298-G303 WeakPolarHBondContact CE2-O 3.41Å; H299-G303 WeakPolarHBondContact O-CA 3.48Å; H299-G303 PolarHBondContact O-N 2.89Å; H299-G303 VanDerWaalsContact O-N 3.07Å; G303-G316 CarbonylContact C-O 3.55Å; G303-G316 WeakPolarHBondContact CA-O 3.48Å; G303-G316 CarbonylContact O-C 3.47Å; G303-G316 PolarHBondContact O-N 3.39Å
304	K	98.2	Very high	96.1	Very high	76 Å²	76	35.2 Å²	35.2	33%	0.33	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	160.4	177.2	-64	-164.3	-155.6	106.8	0	112.3	Y298 H299 D302 F306 G312 D313	Y298-K304 WeakPolarHBondContact CD2-O 3.39Å; H299-K304 PolarHBondContact N-O 2.91Å; H299-K304 VanDerWaalsContact N-O 3.09Å; D302-K304 VanDerWaalsContact C-N 3.28Å; D302-K304 HydrophobicContact CB-CG 4.39Å; D302-K304 VanDerWaalsContact OD1-CB 3.29Å; D302-K304 WeakPolarHBondContact OD1-CB 3.35Å; D302-K304 PolarHBondContact OD1-N 2.84Å; D302-K304 WeakPolarHBondContact OD2-CD 3.33Å; D302-K304 WeakPolarHBondContact OD2-CE 3.4Å; D302-K304 VanDerWaalsContact OD2-CG 3.28Å; D302-K304 WeakPolarHBondContact OD2-CG 3.16Å; D302-K304 IonicContact OD2-NZ 2.71Å; D302-K304 PolarHBondContact OD2-NZ 2.87Å; K304-F306 HydrophobicContact CB-CD2 4.43Å; K304-F306 HydrophobicContact CB-CE2 3.83Å; K304-F306 HydrophobicContact CB-CZ 4.42Å; K304-G312 WeakPolarHBondContact CD-O 3.39Å; K304-D313 VanDerWaalsContact CA-O 3.22Å; K304-D313 WeakPolarHBondContact CA-O 3.27Å; K304-D313 VanDerWaalsContact CB-O 3.25Å; K304-D313 WeakPolarHBondContact CB-O 3.45Å
305	I	98.1	Very high	96.3	Very high	3 Å²	3	36.3 Å²	36.3	2%	0.015	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	133.9	168.4	-169.2	168.7	0	0	0	109.8	V296 A297 G312 D313 F315 F401 K411	V296-I305 HydrophobicContact CG2-CD1 4Å; V296-I305 HydrophobicContact CG2-CG1 4.18Å; A297-I305 WeakPolarHBondContact O-CA 3.46Å; A297-I305 WeakPolarHBondContact O-CG1 3.39Å; I305-G312 CarbonylContact O-C 3.4Å; I305-G312 VanDerWaalsContact O-CA 3.24Å; I305-G312 WeakPolarHBondContact O-CA 3.15Å; I305-D313 HydrophobicContact CG2-CB 3.93Å; I305-D313 PolarHBondContact N-O 3.45Å; I305-D313 PolarHBondContact O-N 3.06Å; I305-F315 HydrophobicContact CB-CB 3.74Å; I305-F315 HydrophobicContact CB-CD1 4.12Å; I305-F315 HydrophobicContact CB-CD2 3.91Å; I305-F315 HydrophobicContact CB-CE2 4.5Å; I305-F315 HydrophobicContact CB-CG 3.68Å; I305-F315 HydrophobicContact CD1-CD2 3.99Å; I305-F315 HydrophobicContact CD1-CE1 4.33Å; I305-F315 HydrophobicContact CD1-CE2 3.72Å; I305-F315 HydrophobicContact CD1-CG 4.39Å; I305-F315 HydrophobicContact CD1-CZ 3.88Å; I305-F315 HydrophobicContact CG2-CB 3.7Å; I305-F315 HydrophobicContact CG2-CD2 3.71Å; I305-F315 HydrophobicContact CG2-CE2 4.49Å; I305-F315 HydrophobicContact CG2-CG 3.84Å; I305-F401 HydrophobicContact CD1-CD2 4.34Å; I305-F401 HydrophobicContact CD1-CE2 3.77Å; I305-F401 HydrophobicContact CG1-CE2 4.47Å; I305-K411 HydrophobicContact CD1-CB 3.6Å; I305-K411 HydrophobicContact CD1-CD 4.18Å; I305-K411 HydrophobicContact CD1-CG 3.9Å
306	F	97.7	Very high	96.2	Very high	14 Å²	14	37.2 Å²	37.2	6%	0.061	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	135.8	176.4	-66.9	-101.1	0	0	0	108.9	G290 W291 V296 A297 H299 K304 G310 G312	G290-F306 CarbonylContact O-C 3.57Å; W291-F306 AromaticContact CD1-CD1 3.51Å; W291-F306 AromaticContact CD1-CG 3.97Å; W291-F306 AromaticContact NE1-CD1 3.5Å; W291-F306 AromaticContact NE1-CE1 3.56Å; V296-F306 CarbonylContact C-O 3.59Å; V296-F306 VanDerWaalsContact CA-O 3.3Å; V296-F306 WeakPolarHBondContact CA-O 3.36Å; A297-F306 PolarHBondContact N-O 3.23Å; A297-F306 PolarHBondContact O-N 2.92Å; H299-F306 HydrophobicContact CB-CD2 4.22Å; H299-F306 HydrophobicContact CB-CE2 3.87Å; H299-F306 AromaticContact CD2-CD2 3.35Å; H299-F306 WeakPolarHBondContact CD2-CD2 3.34Å; H299-F306 AromaticContact CD2-CE2 3.81Å; H299-F306 AromaticContact CE1-CD2 3.74Å; H299-F306 AromaticContact CE1-CE2 3.84Å; H299-F306 AromaticContact CG-CD2 3.53Å; H299-F306 AromaticContact CG-CE2 3.45Å; H299-F306 VanDerWaalsContact CG-CE2 3.45Å; H299-F306 AromaticContact ND1-CD2 3.77Å; H299-F306 AromaticContact ND1-CE2 3.48Å; H299-F306 WeakPolarHBondContact ND1-CE2 3.2Å; H299-F306 AromaticContact NE2-CD2 3.5Å; H299-F306 AromaticContact NE2-CG 3.92Å; K304-F306 HydrophobicContact CB-CD2 4.43Å; K304-F306 HydrophobicContact CB-CE2 3.83Å; K304-F306 HydrophobicContact CB-CZ 4.42Å; F306-G310 WeakPolarHBondContact CE1-O 3.27Å; F306-G312 VanDerWaalsContact CE1-N 3.31Å
307	H	96.8	Very high	96.1	Very high	78 Å²	78	40.3 Å²	40.3	36%	0.361	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	98.2	-177.8	-177.2	-158.7	0	0	0	110.4	G290 S295 V296 S309	G290-H307 CarbonylContact O-C 3.57Å; G290-H307 PolarHBondContact O-N 3.14Å; S295-H307 WeakPolarHBondContact O-CA 3.23Å; S295-H307 PolarHBondContact O-CD2 2.7Å; V296-H307 HydrophobicContact CG2-CB 4.36Å; H307-S309 PolarHBondContact O-N 2.81Å
308	G	93.8	Very high	96.1	Very high	24 Å²	24	46.2 Å²	46.2	25%	0.247	27%	0.273	C	S	.	.	S	Bend	trans	65	13.4	178.1	0	0	0	0	0	115.8	G290 S292 S295	G290-G308 PolarHBondContact O-N 2.56Å; S292-G308 WeakPolarHBondContact O-CA 3.46Å; S295-G308 PolarHBondContact O-N 3.07Å
309	S	90.7	Very high	96	Very high	50 Å²	50	46.3 Å²	46.3	35%	0.35	27%	0.274	S	S	.	.	S	Bend	trans	-152.8	145.9	-168.9	175.7	0	0	0	0	111.4	G290 W291 H307 V311	G290-S309 PolarHBondContact O-N 3.1Å; W291-S309 WeakPolarHBondContact CA-O 3.34Å; W291-S309 CarbonylContact O-C 3.46Å; W291-S309 WeakPolarHBondContact O-CA 3.32Å; W291-S309 PolarHBondContact O-N 3.12Å; H307-S309 PolarHBondContact O-N 2.81Å; S309-V311 PolarHBondContact O-N 2.87Å; S309-V311 PolarHBondContact OG-N 3.4Å
310	G	88.4	Confident	96	Very high	52 Å²	52	52 Å²	52	54%	0.536	30%	0.295	S	S	.	.	S	Bend	trans	-67.7	-5.2	172.3	0	0	0	0	0	114.3	F306	F306-G310 WeakPolarHBondContact CE1-O 3.27Å
311	V	92	Very high	96	Very high	111 Å²	111	58.7 Å²	58.7	67%	0.673	33%	0.325	S	S	*	.	P	Polyproline II helix	trans	-102.8	121.1	177.1	-175.6	0	0	0	0	110.2	S309	S309-V311 PolarHBondContact O-N 2.87Å; S309-V311 PolarHBondContact OG-N 3.4Å
312	G	94.7	Very high	96	Very high	15 Å²	15	59.4 Å²	59.4	16%	0.155	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-99.2	148.1	-179.7	0	0	0	0	0	114.2	K304 I305 F306	K304-G312 WeakPolarHBondContact CD-O 3.39Å; I305-G312 CarbonylContact O-C 3.4Å; I305-G312 VanDerWaalsContact O-CA 3.24Å; I305-G312 WeakPolarHBondContact O-CA 3.15Å; F306-G312 VanDerWaalsContact CE1-N 3.31Å
313	D	96.7	Very high	96.1	Very high	83 Å²	83	57.9 Å²	57.9	44%	0.444	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	146.9	175.2	-65.6	-46.9	0	0	0	111.4	K304 I305 F315 K411	K304-D313 VanDerWaalsContact CA-O 3.22Å; K304-D313 WeakPolarHBondContact CA-O 3.27Å; K304-D313 VanDerWaalsContact CB-O 3.25Å; K304-D313 WeakPolarHBondContact CB-O 3.45Å; I305-D313 HydrophobicContact CG2-CB 3.93Å; I305-D313 PolarHBondContact N-O 3.45Å; I305-D313 PolarHBondContact O-N 3.06Å; D313-F315 PolarHBondContact O-N 3.08Å; D313-K411 IonicContact OD2-NZ 2.65Å; D313-K411 PolarHBondContact OD2-NZ 2.85Å
314	P	97.3	Very high	96.1	Very high	120 Å²	120	60.6 Å²	60.6	78%	0.779	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-55.7	130	168.5	-23.2	33.5	0	0	0	111.7
315	F	97.6	Very high	96.1	Very high	48 Å²	48	57 Å²	57	21%	0.211	33%	0.329	C	S	.	.			trans	-142.7	-60.7	-172.3	-173.8	-105.7	0	0	0	114	Y298 I305 D313 F401 I408	Y298-F315 AromaticContact CD2-CD1 3.85Å; Y298-F315 HydrophobicContact CD2-CD1 3.85Å; Y298-F315 HydrophobicContact CD2-CE1 4.42Å; Y298-F315 HydrophobicContact CE2-CD1 4.15Å; I305-F315 HydrophobicContact CB-CB 3.74Å; I305-F315 HydrophobicContact CB-CD1 4.12Å; I305-F315 HydrophobicContact CB-CD2 3.91Å; I305-F315 HydrophobicContact CB-CE2 4.5Å; I305-F315 HydrophobicContact CB-CG 3.68Å; I305-F315 HydrophobicContact CD1-CD2 3.99Å; I305-F315 HydrophobicContact CD1-CE1 4.33Å; I305-F315 HydrophobicContact CD1-CE2 3.72Å; I305-F315 HydrophobicContact CD1-CG 4.39Å; I305-F315 HydrophobicContact CD1-CZ 3.88Å; I305-F315 HydrophobicContact CG2-CB 3.7Å; I305-F315 HydrophobicContact CG2-CD2 3.71Å; I305-F315 HydrophobicContact CG2-CE2 4.49Å; I305-F315 HydrophobicContact CG2-CG 3.84Å; D313-F315 PolarHBondContact O-N 3.08Å; F315-F401 HydrophobicContact CE1-CB 3.95Å; F315-F401 AromaticContact CE1-CD2 3.71Å; F315-F401 HydrophobicContact CE1-CD2 3.71Å; F315-F401 HydrophobicContact CE1-CG 4.08Å; F315-F401 HydrophobicContact CZ-CB 4.47Å; F315-F401 AromaticContact CZ-CD2 3.71Å; F315-F401 HydrophobicContact CZ-CD2 3.71Å; F315-F401 HydrophobicContact CZ-CE2 4.46Å; F315-F401 HydrophobicContact CZ-CG 4.47Å; F315-I408 HydrophobicContact CD1-CD1 4.25Å; F315-I408 HydrophobicContact CE1-CD1 4.11Å; F315-I408 HydrophobicContact CE1-CG1 4.08Å
316	G	95.2	Very high	96.1	Very high	21 Å²	21	56.8 Å²	56.8	22%	0.216	33%	0.329	C	S	.	.	S	Bend	trans	-134.6	-179.6	-174.4	0	0	0	0	0	113	G303	G303-G316 CarbonylContact C-O 3.55Å; G303-G316 WeakPolarHBondContact CA-O 3.48Å; G303-G316 CarbonylContact O-C 3.47Å; G303-G316 PolarHBondContact O-N 3.39Å
317	P	97.1	Very high	96.1	Very high	64 Å²	64	56.1 Å²	56.1	42%	0.416	33%	0.326	S	S	.	.			trans	-89.7	134.6	178.4	33.3	-31.9	0	0	0	112	Y298 R403	Y298-P317 VanDerWaalsContact OH-C 3.29Å; Y298-P317 PolarHBondContact OH-O 3.27Å; P317-R403 PolarHBondContact O-NH1 2.81Å; P317-R403 VanDerWaalsContact O-NH1 3.1Å
318	R	97.9	Very high	96.1	Very high	125 Å²	125	52.4 Å²	52.4	47%	0.472	31%	0.308	S	S	.	.			trans	-38.8	139	172	-58.5	179.5	67.3	172.1	16.2	114	A300 D301 Y320 R403	A300-R318 CarbonylContact O-C 3.54Å; A300-R318 WeakPolarHBondContact O-CA 3.25Å; D301-R318 WeakPolarHBondContact O-CD 3.17Å; D301-R318 WeakPolarHBondContact O-CG 3.37Å; D301-R318 PolarHBondContact O-NE 2.88Å; D301-R318 PolarHBondContact O-NH2 2.97Å; R318-Y320 HydrophobicContact CB-CE2 4.35Å; R318-Y320 WeakPolarHBondContact O-CE2 3.3Å; R318-R403 VanDerWaalsContact O-CZ 3.23Å; R318-R403 PolarHBondContact O-NH1 3.04Å; R318-R403 PolarHBondContact O-NH2 3.09Å
319	C	97.3	Very high	96.1	Very high	2 Å²	2	51.4 Å²	51.4	1%	0.014	30%	0.297	C	S	.	.			trans	-102.9	155.8	179.4	-60.4	0	0	0	0	111.8	I265 A300 D323 M325	I265-C319 HydrophobicContact CD1-CB 3.67Å; A300-C319 HydrophobicContact CB-CB 3.95Å; A300-C319 PolarHBondContact O-N 2.84Å; C319-D323 WeakPolarHBondContact CA-OD2 3.48Å; C319-D323 HydrophobicContact CB-CB 4.11Å; C319-M325 HydrophobicContact CB-CG 4.25Å; C319-M325 HydrophobicContact CB-SD 4.04Å
320	Y	97.7	Very high	96.2	Very high	125 Å²	125	52.3 Å²	52.3	49%	0.49	30%	0.297	S	S	.	.			trans	-137.5	175.3	-176	-56.1	-81.8	0	0	0	110.9	R318 G322 D323	R318-Y320 HydrophobicContact CB-CE2 4.35Å; R318-Y320 WeakPolarHBondContact O-CE2 3.3Å; Y320-G322 PolarHBondContact O-N 2.92Å; Y320-D323 PolarHBondContact N-OD2 3.39Å; Y320-D323 VanDerWaalsContact O-CB 3.31Å; Y320-D323 WeakPolarHBondContact O-CB 3.36Å; Y320-D323 PolarHBondContact O-N 2.85Å
321	K	98	Very high	96.2	Very high	142 Å²	142	51.6 Å²	51.6	62%	0.617	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.5	127.3	172.7	-176.2	166	179.4	148	0	111.8	V266 P268 D323	V266-K321 WeakPolarHBondContact O-CE 3.45Å; V266-K321 PolarHBondContact O-NZ 2.83Å; P268-K321 HydrophobicContact CG-CB 4.38Å; K321-D323 VanDerWaalsContact C-N 3.33Å
322	G	97.3	Very high	95.9	Very high	47 Å²	47	48.7 Å²	48.7	49%	0.485	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	85	-6	-178.6	0	0	0	0	0	115.1	I265 Y320	I265-G322 PolarHBondContact O-N 3.33Å; Y320-G322 PolarHBondContact O-N 2.92Å
323	D	98	Very high	95.2	Very high	15 Å²	15	60.6 Å²	60.6	8%	0.08	30%	0.303	C	S	.	.			trans	-71	142.4	168.5	-77.4	-52.3	0	0	0	110.4	I265 C319 Y320 K321 R403 N404	I265-D323 PolarHBondContact N-O 2.99Å; C319-D323 WeakPolarHBondContact CA-OD2 3.48Å; C319-D323 HydrophobicContact CB-CB 4.11Å; Y320-D323 PolarHBondContact N-OD2 3.39Å; Y320-D323 VanDerWaalsContact O-CB 3.31Å; Y320-D323 WeakPolarHBondContact O-CB 3.36Å; Y320-D323 PolarHBondContact O-N 2.85Å; K321-D323 VanDerWaalsContact C-N 3.33Å; D323-R403 VanDerWaalsContact CG-NH2 3.34Å; D323-R403 IonicContact OD1-CZ 3.33Å; D323-R403 IonicContact OD1-NE 3.39Å; D323-R403 PolarHBondContact OD1-NE 3.14Å; D323-R403 VanDerWaalsContact OD1-NE 3.08Å; D323-R403 IonicContact OD1-NH2 3.19Å; D323-R403 PolarHBondContact OD1-NH2 2.84Å; D323-R403 VanDerWaalsContact OD1-NH2 3.17Å; D323-R403 IonicContact OD2-CZ 3.38Å; D323-R403 IonicContact OD2-NE 3.56Å; D323-R403 PolarHBondContact OD2-NE 3.24Å; D323-R403 IonicContact OD2-NH2 3.62Å; D323-R403 PolarHBondContact OD2-NH2 2.9Å; D323-N404 WeakPolarHBondContact CA-OD1 3.28Å; D323-N404 PolarHBondContact OD1-ND2 3Å
324	I	97.6	Very high	94.4	Very high	57 Å²	57	62.7 Å²	62.7	29%	0.292	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	116.3	171.7	-58.4	174.2	0	0	0	107.9	E262 V263 E264 R403 N404	E262-I324 HydrophobicContact CB-CG2 3.96Å; E262-I324 HydrophobicContact CG-CG2 4.13Å; V263-I324 WeakPolarHBondContact O-CA 3.36Å; E264-I324 HydrophobicContact CB-CG1 4.3Å; E264-I324 HydrophobicContact CG-CG1 4.34Å; I324-R403 CarbonylContact O-C 3.59Å; I324-R403 WeakPolarHBondContact O-CA 3.41Å; I324-N404 PolarHBondContact N-OD1 2.79Å; I324-N404 PolarHBondContact O-N 3.21Å
325	M	97.6	Very high	93.6	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	137.7	172.6	-61.9	168.6	69.9	0	0	108.6	E262 V263 I265 L276 Y298 A300 C319	E262-M325 CarbonylContact C-O 3.5Å; E262-M325 WeakPolarHBondContact CA-O 3.34Å; V263-M325 PolarHBondContact N-O 3.48Å; V263-M325 PolarHBondContact O-N 3.14Å; I265-M325 HydrophobicContact CD1-SD 3.91Å; I265-M325 HydrophobicContact CG1-SD 4.35Å; L276-M325 HydrophobicContact CB-CE 4.07Å; L276-M325 HydrophobicContact CD2-CB 3.72Å; Y298-M325 HydrophobicContact CD1-CE 3.43Å; Y298-M325 VanDerWaalsContact CD1-CE 3.43Å; Y298-M325 HydrophobicContact CE1-CE 3.72Å; Y298-M325 HydrophobicContact CG-CE 4.35Å; A300-M325 HydrophobicContact CB-CE 3.97Å; A300-M325 HydrophobicContact CB-SD 3.81Å; C319-M325 HydrophobicContact CB-CG 4.25Å; C319-M325 HydrophobicContact CB-SD 4.04Å
326	G	97.6	Very high	92.3	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	154.3	174	0	0	0	0	0	112.6	F261 F401 T402	F261-G326 VanDerWaalsContact O-CA 3.27Å; F261-G326 WeakPolarHBondContact O-CA 3.45Å; G326-F401 CarbonylContact O-C 3.56Å; G326-F401 VanDerWaalsContact O-CA 3.24Å; G326-F401 WeakPolarHBondContact O-CA 3.21Å; G326-T402 WeakPolarHBondContact CA-OG1 3.04Å; G326-T402 PolarHBondContact N-O 2.87Å; G326-T402 PolarHBondContact N-OG1 2.99Å; G326-T402 VanDerWaalsContact N-OG1 3.16Å; G326-T402 PolarHBondContact O-N 2.81Å
327	C	98.1	Very high	91	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	135.8	179.4	-178.5	0	0	0	0	109.6	Y260 F261 L276 F400 F401	Y260-C327 WeakPolarHBondContact CA-O 3.28Å; Y260-C327 WeakPolarHBondContact CD2-O 3.5Å; F261-C327 HydrophobicContact CD1-CB 4.25Å; F261-C327 WeakPolarHBondContact CD1-O 3.36Å; F261-C327 HydrophobicContact CE1-CB 3.59Å; F261-C327 HydrophobicContact CZ-CB 4.01Å; F261-C327 PolarHBondContact N-O 2.83Å; F261-C327 PolarHBondContact O-N 3.18Å; L276-C327 HydrophobicContact CD2-CB 3.7Å; L276-C327 HydrophobicContact CG-CB 3.83Å; C327-F400 WeakPolarHBondContact CA-O 3.28Å; C327-F401 HydrophobicContact CB-CD1 3.86Å; C327-F401 HydrophobicContact CB-CE1 3.89Å; C327-F401 WeakPolarHBondContact SG-CE1 3.32Å
328	G	96.5	Very high	89.2	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	175.7	178.6	0	0	0	0	0	114	H259 V399 F400	H259-G328 CarbonylContact O-C 3.52Å; H259-G328 WeakPolarHBondContact O-CA 3.43Å; G328-V399 CarbonylContact O-C 3.5Å; G328-V399 WeakPolarHBondContact O-CA 3.36Å; G328-V399 WeakPolarHBondContact O-CG1 3.34Å; G328-F400 VanDerWaalsContact C-CD1 3.43Å; G328-F400 PolarHBondContact N-O 3.18Å; G328-F400 VanDerWaalsContact O-CD1 3.25Å; G328-F400 WeakPolarHBondContact O-CD1 3.26Å; G328-F400 PolarHBondContact O-N 2.78Å
329	I	95.2	Very high	86.9	Confident	3 Å²	3	64.2 Å²	64.2	2%	0.015	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	128	-179.4	-56	177.2	0	0	0	109.6	L254 H259 L278 F331 V397 V399 F420	L254-I329 HydrophobicContact CB-CD1 3.91Å; L254-I329 HydrophobicContact CB-CG1 4.5Å; L254-I329 HydrophobicContact CD1-CD1 4.12Å; L254-I329 HydrophobicContact CD1-CG1 3.95Å; H259-I329 PolarHBondContact O-N 2.99Å; L278-I329 HydrophobicContact CD1-CD1 3.76Å; L278-I329 HydrophobicContact CD1-CG1 3.54Å; I329-F331 HydrophobicContact CB-CD2 4.17Å; I329-F331 HydrophobicContact CB-CE1 4.16Å; I329-F331 HydrophobicContact CB-CE2 3.77Å; I329-F331 HydrophobicContact CB-CZ 3.78Å; I329-F331 HydrophobicContact CD1-CE1 4.07Å; I329-F331 HydrophobicContact CD1-CE2 4.47Å; I329-F331 HydrophobicContact CD1-CZ 3.72Å; I329-F331 HydrophobicContact CG1-CZ 4.3Å; I329-F331 HydrophobicContact CG2-CD1 3.74Å; I329-F331 HydrophobicContact CG2-CD2 4.11Å; I329-F331 HydrophobicContact CG2-CE1 3.64Å; I329-F331 HydrophobicContact CG2-CE2 4.02Å; I329-F331 HydrophobicContact CG2-CG 3.99Å; I329-F331 HydrophobicContact CG2-CZ 3.81Å; I329-F331 PolarHBondContact O-N 2.83Å; I329-V397 HydrophobicContact CG2-CB 3.66Å; I329-V397 HydrophobicContact CG2-CG1 4.1Å; I329-V397 HydrophobicContact CG2-CG2 3.8Å; I329-V399 HydrophobicContact CG1-CG2 4.45Å; I329-F420 HydrophobicContact CD1-CB 3.96Å; I329-F420 HydrophobicContact CD1-CD2 4.21Å
330	M	92.4	Very high	84.3	Confident	69 Å²	69	70.8 Å²	70.8	34%	0.34	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	91.3	164.3	-61.3	-177.7	177.7	0	0	108.3	V398 F400 I407 K410	M330-V398 HydrophobicContact CB-CB 4.24Å; M330-V398 PolarHBondContact N-O 2.81Å; M330-F400 HydrophobicContact CE-CB 4.06Å; M330-F400 HydrophobicContact CE-CD1 3.83Å; M330-F400 HydrophobicContact CE-CE1 4.37Å; M330-F400 HydrophobicContact CE-CG 3.89Å; M330-F400 HydrophobicContact CG-CD1 3.69Å; M330-F400 HydrophobicContact CG-CE1 4.04Å; M330-I407 HydrophobicContact CE-CD1 4.12Å; M330-K410 HydrophobicContact CE-CD 4.26Å; M330-K410 HydrophobicContact SD-CD 4.19Å; M330-K410 PolarHBondContact SD-NZ 2.94Å; M330-K410 VanDerWaalsContact SD-NZ 3.45Å
331	F	89	Confident	81.2	Confident	37 Å²	37	68.2 Å²	68.2	16%	0.162	36%	0.364	C	S	.	.			trans	-68.5	134.3	177.4	-68.4	-72.9	0	0	0	111.2	L254 S255 T256 H259 I329 Y335 V397	L254-F331 HydrophobicContact CB-CZ 4.32Å; S255-F331 WeakPolarHBondContact O-CE2 3.35Å; T256-F331 HydrophobicContact CG2-CB 3.82Å; T256-F331 HydrophobicContact CG2-CD1 4.44Å; T256-F331 HydrophobicContact CG2-CD2 4.06Å; T256-F331 HydrophobicContact CG2-CG 3.85Å; H259-F331 HydrophobicContact CB-CD2 3.86Å; H259-F331 HydrophobicContact CB-CE2 3.58Å; I329-F331 HydrophobicContact CB-CD2 4.17Å; I329-F331 HydrophobicContact CB-CE1 4.16Å; I329-F331 HydrophobicContact CB-CE2 3.77Å; I329-F331 HydrophobicContact CB-CZ 3.78Å; I329-F331 HydrophobicContact CD1-CE1 4.07Å; I329-F331 HydrophobicContact CD1-CE2 4.47Å; I329-F331 HydrophobicContact CD1-CZ 3.72Å; I329-F331 HydrophobicContact CG1-CZ 4.3Å; I329-F331 HydrophobicContact CG2-CD1 3.74Å; I329-F331 HydrophobicContact CG2-CD2 4.11Å; I329-F331 HydrophobicContact CG2-CE1 3.64Å; I329-F331 HydrophobicContact CG2-CE2 4.02Å; I329-F331 HydrophobicContact CG2-CG 3.99Å; I329-F331 HydrophobicContact CG2-CZ 3.81Å; I329-F331 PolarHBondContact O-N 2.83Å; F331-Y335 HydrophobicContact CB-CD1 4.48Å; F331-Y335 HydrophobicContact CB-CG 4.23Å; F331-Y335 AromaticContact CD1-CD1 3.39Å; F331-Y335 HydrophobicContact CD1-CD1 3.39Å; F331-Y335 AromaticContact CD1-CD2 3.76Å; F331-Y335 HydrophobicContact CD1-CD2 3.76Å; F331-Y335 AromaticContact CD1-CE1 3.43Å; F331-Y335 HydrophobicContact CD1-CE1 3.43Å; F331-Y335 VanDerWaalsContact CD1-CE1 3.43Å; F331-Y335 AromaticContact CD1-CE2 3.81Å; F331-Y335 HydrophobicContact CD1-CE2 3.81Å; F331-Y335 AromaticContact CD1-CG 3.53Å; F331-Y335 HydrophobicContact CD1-CG 3.53Å; F331-Y335 AromaticContact CD1-CZ 3.63Å; F331-Y335 AromaticContact CE1-CD1 3.83Å; F331-Y335 HydrophobicContact CE1-CD1 3.83Å; F331-Y335 HydrophobicContact CE1-CD2 4.4Å; F331-Y335 AromaticContact CE1-CE1 3.34Å; F331-Y335 HydrophobicContact CE1-CE1 3.34Å; F331-Y335 AromaticContact CE1-CE2 4Å; F331-Y335 HydrophobicContact CE1-CE2 4Å; F331-Y335 HydrophobicContact CE1-CG 4.3Å; F331-Y335 AromaticContact CE1-CZ 3.43Å; F331-Y335 VanDerWaalsContact CE1-CZ 3.43Å; F331-Y335 HydrophobicContact CG-CD1 4.13Å; F331-Y335 HydrophobicContact CG-CE1 4.48Å; F331-Y335 HydrophobicContact CG-CG 4.25Å; F331-Y335 HydrophobicContact CZ-CE1 4.33Å; F331-V397 HydrophobicContact CD1-CG1 4.38Å
332	P	85.9	Confident	77.9	Confident	50 Å²	50	69 Å²	69	33%	0.325	38%	0.375	S	S	.	.			trans	-54.8	151.8	165.3	-25.3	34.5	0	0	0	111.7	D334 Y335	P332-D334 WeakPolarHBondContact CB-OD1 3.2Å; P332-D334 PolarHBondContact O-N 3.21Å; P332-Y335 WeakPolarHBondContact O-CB 3.33Å; P332-Y335 PolarHBondContact O-N 3.47Å
333	R	80.2	Confident	75	Confident	264 Å²	264	72.1 Å²	72.1	100%	0.996	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-27.8	-177.8	-70.3	-173.9	179.1	-154	-0.4	113.3
334	D	79.9	Confident	71.8	Confident	127 Å²	127	79 Å²	79	68%	0.679	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	12.9	179.5	59.3	-30.6	0	0	0	112.7	P332 I336	P332-D334 WeakPolarHBondContact CB-OD1 3.2Å; P332-D334 PolarHBondContact O-N 3.21Å; D334-I336 PolarHBondContact O-N 3.11Å; D334-I336 VanDerWaalsContact O-N 3.12Å
335	Y	79.4	Confident	69.1	Low	29 Å²	29	83.2 Å²	83.2	11%	0.114	45%	0.449	C	S	.	.			trans	-65.2	115.4	179.1	-173.1	-95.1	0	0	0	111.6	T256 F331 P332 L337 V397 V415	T256-Y335 HydrophobicContact CG2-CD1 3.91Å; F331-Y335 HydrophobicContact CB-CD1 4.48Å; F331-Y335 HydrophobicContact CB-CG 4.23Å; F331-Y335 AromaticContact CD1-CD1 3.39Å; F331-Y335 HydrophobicContact CD1-CD1 3.39Å; F331-Y335 AromaticContact CD1-CD2 3.76Å; F331-Y335 HydrophobicContact CD1-CD2 3.76Å; F331-Y335 AromaticContact CD1-CE1 3.43Å; F331-Y335 HydrophobicContact CD1-CE1 3.43Å; F331-Y335 VanDerWaalsContact CD1-CE1 3.43Å; F331-Y335 AromaticContact CD1-CE2 3.81Å; F331-Y335 HydrophobicContact CD1-CE2 3.81Å; F331-Y335 AromaticContact CD1-CG 3.53Å; F331-Y335 HydrophobicContact CD1-CG 3.53Å; F331-Y335 AromaticContact CD1-CZ 3.63Å; F331-Y335 AromaticContact CE1-CD1 3.83Å; F331-Y335 HydrophobicContact CE1-CD1 3.83Å; F331-Y335 HydrophobicContact CE1-CD2 4.4Å; F331-Y335 AromaticContact CE1-CE1 3.34Å; F331-Y335 HydrophobicContact CE1-CE1 3.34Å; F331-Y335 AromaticContact CE1-CE2 4Å; F331-Y335 HydrophobicContact CE1-CE2 4Å; F331-Y335 HydrophobicContact CE1-CG 4.3Å; F331-Y335 AromaticContact CE1-CZ 3.43Å; F331-Y335 VanDerWaalsContact CE1-CZ 3.43Å; F331-Y335 HydrophobicContact CG-CD1 4.13Å; F331-Y335 HydrophobicContact CG-CE1 4.48Å; F331-Y335 HydrophobicContact CG-CG 4.25Å; F331-Y335 HydrophobicContact CZ-CE1 4.33Å; P332-Y335 WeakPolarHBondContact O-CB 3.33Å; P332-Y335 PolarHBondContact O-N 3.47Å; Y335-L337 HydrophobicContact CE1-CB 4.45Å; Y335-L337 HydrophobicContact CE1-CD1 3.76Å; Y335-L337 WeakPolarHBondContact OH-CD1 3.41Å; Y335-V397 HydrophobicContact CD2-CG1 4.2Å; Y335-V397 HydrophobicContact CE2-CG1 3.88Å; Y335-V415 HydrophobicContact CE2-CG2 4.27Å
336	I	71.3	Confident	66.1	Low	120 Å²	120	88.2 Å²	88.2	62%	0.615	48%	0.484	S	S	*	.			trans	-114.3	126.7	167.6	-61	171.5	0	0	0	105.6	D334 D338 R395	D334-I336 PolarHBondContact O-N 3.11Å; D334-I336 VanDerWaalsContact O-N 3.12Å; I336-D338 PolarHBondContact O-N 3.2Å; I336-R395 PolarHBondContact O-NH1 3.49Å
337	L	67.4	Low	63.1	Low	66 Å²	66	94.3 Å²	94.3	35%	0.346	53%	0.525	S	S	.	.			trans	-65.3	129.3	168.9	-148.2	94.9	0	0	0	105.9	Y335 S339	Y335-L337 HydrophobicContact CE1-CB 4.45Å; Y335-L337 HydrophobicContact CE1-CD1 3.76Å; Y335-L337 WeakPolarHBondContact OH-CD1 3.41Å; L337-S339 VanDerWaalsContact C-N 3.29Å; L337-S339 PolarHBondContact O-N 3.39Å
338	D	59.5	Low	60.1	Low	104 Å²	104	101.1 Å²	101.1	56%	0.556	56%	0.562	S	S	*	*			trans	-57.7	102.8	170.4	-68.5	-44.4	0	0	0	106.7	I336 E340 R395	I336-D338 PolarHBondContact O-N 3.2Å; D338-E340 PolarHBondContact O-N 2.99Å; D338-R395 IonicContact OD1-CZ 2.86Å; D338-R395 IonicContact OD1-NE 2.82Å; D338-R395 PolarHBondContact OD1-NE 3.49Å; D338-R395 IonicContact OD1-NH2 3.75Å; D338-R395 PolarHBondContact OD1-NH2 3.4Å; D338-R395 IonicContact OD2-CZ 3.41Å; D338-R395 IonicContact OD2-NE 3.95Å; D338-R395 PolarHBondContact OD2-NE 2.89Å; D338-R395 IonicContact OD2-NH2 3.24Å
339	S	49.4	Very low	56.9	Low	92 Å²	92	106.9 Å²	106.9	64%	0.643	60%	0.597	S	S	*	*			trans	-55.9	125.5	167.5	177.8	0	0	0	0	104.9	L337 G341	L337-S339 VanDerWaalsContact C-N 3.29Å; L337-S339 PolarHBondContact O-N 3.39Å; S339-G341 PolarHBondContact O-N 3.31Å
340	E	41.6	Very low	54.1	Low	140 Å²	140	113.7 Å²	113.7	65%	0.654	64%	0.638	S	S	*	*			trans	-25.8	111.2	170.7	-66.1	-92.5	166.4	0	0	109.2	D338 D342	D338-E340 PolarHBondContact O-N 2.99Å; E340-D342 PolarHBondContact O-N 2.87Å
341	G	32.5	Very low	51.1	Low	70 Å²	70	117 Å²	117	72%	0.722	66%	0.656	S	S	*	*			trans	-56	111.3	-172.1	0	0	0	0	0	110.2	S339 S343	S339-G341 PolarHBondContact O-N 3.31Å; G341-S343 PolarHBondContact O-N 2.78Å
342	D	29.9	Very low	48.4	Very low	160 Å²	160	123.8 Å²	123.8	86%	0.856	69%	0.693	S	S	*	*			trans	-60.1	85.6	148.5	-87.2	-31.1	0	0	0	106.4	E340 D344	E340-D342 PolarHBondContact O-N 2.87Å; D342-D344 PolarHBondContact O-N 2.85Å; D342-D344 VanDerWaalsContact O-N 3.07Å
343	S	35.9	Very low	45.7	Very low	111 Å²	111	126.6 Å²	126.6	78%	0.776	71%	0.714	S	S	*	*			trans	-80.1	71.3	163	68.4	0	0	0	0	108.1	G341 D345	G341-S343 PolarHBondContact O-N 2.78Å; S343-D345 PolarHBondContact O-N 2.82Å
344	D	31.9	Very low	43.5	Very low	161 Å²	161	119.8 Å²	119.8	86%	0.861	70%	0.704	S	S	*	*			trans	-73.8	90.6	145.9	-91.6	-15.1	0	0	0	105.8	D342	D342-D344 PolarHBondContact O-N 2.85Å; D342-D344 VanDerWaalsContact O-N 3.07Å
345	D	40	Very low	41.3	Very low	145 Å²	145	121 Å²	121	78%	0.775	72%	0.716	S	S	*	*			trans	-142.7	131.8	152.6	-138.4	-14.6	0	0	0	113.1	S343	S343-D345 PolarHBondContact O-N 2.82Å
346	S	34.9	Very low	38.9	Very low	105 Å²	105	124 Å²	124	73%	0.734	75%	0.747	S	S	*	*			trans	-61.2	138.6	179.2	56.9	0	0	0	0	112.5
347	C	34.6	Very low	37	Very low	128 Å²	128	130.1 Å²	130.1	87%	0.865	76%	0.762	S	S	*	*			trans	-159.8	135.9	140.2	-168.4	0	0	0	0	111.1
348	D	35.7	Very low	35.2	Very low	142 Å²	142	130.6 Å²	130.6	76%	0.759	78%	0.776	S	S	*	*			trans	-60.3	143.1	-174.5	-71	-59.6	0	0	0	115.6	V350	D348-V350 PolarHBondContact O-N 2.99Å
349	T	29.2	Very low	33.8	Very low	121 Å²	121	131.2 Å²	131.2	74%	0.742	78%	0.783	S	S	*	*			trans	-12.9	112.3	143.5	-38.4	0	0	0	0	115.7
350	V	35.5	Very low	32.9	Very low	146 Å²	146	138.1 Å²	138.1	89%	0.885	80%	0.795	S	S	*	*			trans	-142.2	124.1	144.3	-128	0	0	0	0	111.4	D348	D348-V350 PolarHBondContact O-N 2.99Å
351	I	30.3	Very low	32.2	Very low	138 Å²	138	138.9 Å²	138.9	71%	0.708	80%	0.804	S	S	*	*			trans	-80	125.5	-178.5	-64.3	163.6	0	0	0	109
352	L	32.2	Very low	32	Very low	181 Å²	181	142.8 Å²	142.8	95%	0.948	81%	0.813	S	S	*	*			trans	-144.9	127.3	146.7	-78.6	179.6	0	0	0	110.6
353	S	28.6	Very low	31.7	Very low	108 Å²	108	145.6 Å²	145.6	76%	0.755	81%	0.812	S	S	*	*			trans	-104.1	167.8	-176	70.3	0	0	0	0	110.9
354	P	33.9	Very low	31.2	Very low	122 Å²	122	146.7 Å²	146.7	79%	0.792	81%	0.809	S	S	*	*			trans	-103.5	165.7	-136	39.1	-38.3	0	0	0	115.7
355	T	32.8	Very low	31.1	Very low	151 Å²	151	144.3 Å²	144.3	93%	0.926	80%	0.8	S	S	*	*			trans	-139.2	142.9	159.6	38.4	0	0	0	0	114.1
356	A	29	Very low	30.5	Very low	92 Å²	92	144.6 Å²	144.6	76%	0.76	80%	0.798	S	S	*	*			trans	-67.2	155.6	-168.4	0	0	0	0	0	118.4
357	R	31.7	Very low	30.2	Very low	249 Å²	249	150.6 Å²	150.6	94%	0.94	81%	0.807	S	S	*	*				171.9	151.3	126.7	-97.8	168.8	171.2	172.3	-2	108.9
358	A	30.3	Very low	29.9	Very low	76 Å²	76	151.2 Å²	151.2	63%	0.628	80%	0.801	S	S	*	*			cis	176.1	137.8	-27.1	0	0	0	0	0	105.7
359	V	30.1	Very low	29.9	Very low	118 Å²	118	152 Å²	152	72%	0.715	80%	0.799	S	S	*	*			trans	80	133.3	144.2	177.2	0	0	0	0	115.9
360	R	29.9	Very low	29.9	Very low	236 Å²	236	153 Å²	153	89%	0.891	80%	0.795	S	S	*	*			cis	-166.5	152.1	27.6	-130.7	154.6	-149.1	175.2	1.9	111.8
361	N	26.3	Very low	29.8	Very low	157 Å²	157	154.3 Å²	154.3	84%	0.84	79%	0.792	S	S	*	*			trans	-72.1	153.9	169.4	-66.3	-41.2	0	0	0	114.4
362	V	28.6	Very low	30	Very low	151 Å²	151	151 Å²	151	92%	0.915	79%	0.792	S	S	*	*			trans	-146.9	144.8	141.8	-176.3	0	0	0	0	111
363	R	25.3	Very low	30.1	Very low	220 Å²	220	151.5 Å²	151.5	83%	0.83	79%	0.789	S	S	*	*			trans	-118	154.5	-174.1	-111.6	179.9	176.1	170.3	-2.1	110.6
364	N	25.5	Very low	30.3	Very low	134 Å²	134	155 Å²	155	72%	0.717	79%	0.793	S	S	*	*			trans	88.2	120.6	137.2	-78.5	11.6	0	0	0	124.4
365	V	29.8	Very low	30.4	Very low	111 Å²	111	157.6 Å²	157.6	67%	0.673	80%	0.795	S	S	*	*				90.6	120.1	112.7	176.8	0	0	0	0	122.3
366	M	25.8	Very low	30.4	Very low	150 Å²	150	159.4 Å²	159.4	74%	0.739	79%	0.793	S	S	*	*			trans	59	138	144.8	-63.2	-91.9	-169.5	0	0	121.7
367	Y	29.7	Very low	30.5	Very low	232 Å²	232	163.2 Å²	163.2	91%	0.91	80%	0.795	S	S	*	*				-176.1	160.1	104.1	-87	-68.4	0	0	0	112.6
368	L	28	Very low	30.7	Very low	141 Å²	141	160.5 Å²	160.5	74%	0.738	79%	0.793	S	S	*	*			trans	-98.9	171.9	-161.6	-144.5	98.9	0	0	0	113.6
369	H	34.9	Very low	31	Very low	158 Å²	158	165 Å²	165	73%	0.731	80%	0.801	S	S	*	*			trans	95.3	152.6	164.6	-66.2	-76.7	0	0	0	118
370	Q	30.6	Very low	31.3	Very low	141 Å²	141	168 Å²	168	66%	0.659	81%	0.808	S	S	*	*			cis	-174.8	144.1	-43	-149.5	-175.7	-27.7	0	0	104.2
371	E	32.5	Very low	31.8	Very low	175 Å²	175	164.8 Å²	164.8	82%	0.818	80%	0.803	S	S	*	*			trans	76.3	127.9	159	-50.9	-173.6	173.7	0	0	119.4
372	G	33.6	Very low	32.2	Very low	68 Å²	68	166 Å²	166	70%	0.701	80%	0.803	S	S	*	*			trans	133.7	87.7	149.4	0	0	0	0	0	116
373	E	36	Very low	32.5	Very low	191 Å²	191	168.1 Å²	168.1	89%	0.893	80%	0.803	S	S	*	*			trans	60.8	109.3	134.6	-61.1	175.2	176.7	0	0	120.2
374	E	33.1	Very low	33.2	Very low	181 Å²	181	164.4 Å²	164.4	85%	0.846	80%	0.8	S	S	*	*			trans	23.5	114.8	137.1	-57.1	179.5	-178.2	0	0	118.5
375	E	34.1	Very low	33.7	Very low	177 Å²	177	161.9 Å²	161.9	83%	0.827	81%	0.805	S	S	*	*				169.9	125.5	122.5	-89.5	170.7	-166.7	0	0	111.3
376	E	33.1	Very low	34.1	Very low	189 Å²	189	162.9 Å²	162.9	88%	0.883	80%	0.802	S	S	*	*			trans	44.7	97.4	152.1	-54.2	-173.1	171.6	0	0	119.3
377	E	32.3	Very low	34.7	Very low	173 Å²	173	164.6 Å²	164.6	81%	0.808	81%	0.809	S	S	*	*			trans	-106.3	109.7	166	-71	-173.4	172.7	0	0	111	E379	E377-E379 PolarHBondContact O-N 2.87Å
378	E	35.7	Very low	35	Very low	191 Å²	191	161.2 Å²	161.2	89%	0.893	80%	0.804	S	S	*	*			trans	-68.1	105.7	156.1	-65.3	-177.7	158.5	0	0	107.5	E380	E378-E380 PolarHBondContact O-N 2.71Å
379	E	35.8	Very low	35.5	Very low	170 Å²	170	162.4 Å²	162.4	79%	0.794	81%	0.806	S	S	*	*			trans	-84.3	111.1	175	-73.9	-173.8	175.7	0	0	110.2	E377	E377-E379 PolarHBondContact O-N 2.87Å
380	E	37.5	Very low	35.7	Very low	183 Å²	183	159.6 Å²	159.6	86%	0.855	80%	0.802	S	S	*	*			trans	-61.7	130.6	172	-62.7	-176.6	156.6	0	0	110.8	E378 E382	E378-E380 PolarHBondContact O-N 2.71Å; E380-E382 PolarHBondContact O-N 3.12Å
381	E	39.2	Very low	36.3	Very low	168 Å²	168	162.4 Å²	162.4	79%	0.785	82%	0.815	S	S	*	*			trans	-65.5	113.1	175.6	-65.8	-171.9	163.2	0	0	110.3	E383	E381-E383 PolarHBondContact O-N 2.8Å; E381-E383 VanDerWaalsContact O-N 3.12Å
382	E	34.8	Very low	37	Very low	182 Å²	182	161.8 Å²	161.8	85%	0.85	81%	0.812	S	S	*	*			trans	-67.5	106.3	164.7	-69.2	-159.6	165.7	0	0	109.2	E380 D384	E380-E382 PolarHBondContact O-N 3.12Å; E382-D384 PolarHBondContact O-N 3.4Å
383	E	36.4	Very low	38	Very low	195 Å²	195	168.3 Å²	168.3	91%	0.911	82%	0.824	S	S	*	*			trans	-61.7	94.4	164.4	-86.3	-172.9	145.4	0	0	109.3	E381 G385	E381-E383 PolarHBondContact O-N 2.8Å; E381-E383 VanDerWaalsContact O-N 3.12Å; E383-G385 PolarHBondContact O-N 2.92Å; E383-G385 VanDerWaalsContact O-N 3.09Å
384	D	39.3	Very low	39.3	Very low	143 Å²	143	160.4 Å²	160.4	77%	0.765	79%	0.794	S	S	*	*			trans	-59	111.6	162.4	-87.7	-35.2	0	0	0	108.9	E382 E386	E382-D384 PolarHBondContact O-N 3.4Å; D384-E386 PolarHBondContact O-N 3.33Å
385	G	35.2	Very low	41.6	Very low	80 Å²	80	156.2 Å²	156.2	83%	0.825	77%	0.771	S	S	*	*			trans	-61.9	96.7	177.4	0	0	0	0	0	111.9	E383 E387	E383-G385 PolarHBondContact O-N 2.92Å; E383-G385 VanDerWaalsContact O-N 3.09Å; G385-E387 PolarHBondContact O-N 3.06Å
386	E	38.9	Very low	44.3	Very low	132 Å²	132	155.3 Å²	155.3	62%	0.617	76%	0.764	S	S	*	*			trans	-72	117.1	171.6	-69.6	-172.3	157.7	0	0	110.4	R293 D384 I388	R293-E386 IonicContact CZ-OE2 3.28Å; R293-E386 IonicContact NE-OE2 2.73Å; R293-E386 PolarHBondContact NE-OE2 3.44Å; R293-E386 IonicContact NH2-OE2 2.65Å; D384-E386 PolarHBondContact O-N 3.33Å; E386-I388 PolarHBondContact O-N 3.09Å
387	E	37.3	Very low	47.2	Very low	187 Å²	187	146.5 Å²	146.5	87%	0.874	72%	0.723	S	S	*	*			trans	-53.9	127	164.8	-72.6	-176.3	155.8	0	0	109.7	G385 E389	G385-E387 PolarHBondContact O-N 3.06Å; E387-E389 PolarHBondContact O-N 3.24Å
388	I	35.9	Very low	50.2	Low	160 Å²	160	140.2 Å²	140.2	82%	0.821	70%	0.696	S	S	*	*			trans	-68.3	94.1	-179.6	-58	170.3	0	0	0	108.6	E386	E386-I388 PolarHBondContact O-N 3.09Å
389	E	38.5	Very low	53.2	Low	166 Å²	166	131.1 Å²	131.1	78%	0.776	65%	0.654	S	S	*	*			trans	-66.6	137.4	163.9	-71.9	-160.7	159.5	0	0	109.8	E387 E391	E387-E389 PolarHBondContact O-N 3.24Å; E389-E391 PolarHBondContact O-N 3.28Å
390	P	40.3	Very low	56.1	Low	100 Å²	100	123.3 Å²	123.3	65%	0.649	62%	0.617	S	S	*	*			trans	-61.7	133.2	-178.6	24.1	-31.8	0	0	0	110.8	H392	P390-H392 PolarHBondContact O-N 3.48Å; P390-H392 PolarHBondContact O-ND1 2.83Å
391	E	42.4	Very low	59	Low	199 Å²	199	114.6 Å²	114.6	93%	0.93	58%	0.577	S	S	*	*			trans	-47.8	101.7	172.9	-68.6	-176.6	163.6	0	0	109.7	E389 E393	E389-E391 PolarHBondContact O-N 3.28Å; E391-E393 PolarHBondContact O-N 3.42Å
392	H	47.4	Very low	61.8	Low	162 Å²	162	106.8 Å²	106.8	75%	0.75	54%	0.54	S	S	*	.			trans	-65	132	167.3	-85.6	43.7	0	0	0	107.6	P390 G394	P390-H392 PolarHBondContact O-N 3.48Å; P390-H392 PolarHBondContact O-ND1 2.83Å; H392-G394 PolarHBondContact O-N 3.5Å
393	E	54.8	Low	64.7	Low	206 Å²	206	100.4 Å²	100.4	96%	0.963	51%	0.508	S	S	*	.			trans	-63.7	67.9	167.1	-75.8	-174.3	152.5	0	0	109.8	E391	E391-E393 PolarHBondContact O-N 3.42Å
394	G	64.2	Low	67.6	Low	25 Å²	25	95.3 Å²	95.3	26%	0.258	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-73.7	148.7	177.9	0	0	0	0	0	110.4	H392 K396 V414	H392-G394 PolarHBondContact O-N 3.5Å; G394-K396 PolarHBondContact O-N 2.89Å; G394-V414 VanDerWaalsContact CA-CG1 3.44Å
395	R	81.6	Confident	70.1	Confident	93 Å²	93	91.5 Å²	91.5	35%	0.351	48%	0.482	S	S	.	.	P	Polyproline II helix	trans	-62.8	128.3	179.6	-63.3	175.7	-171.6	-131	-13	109.8	I336 D338 V415	I336-R395 PolarHBondContact O-NH1 3.49Å; D338-R395 IonicContact OD1-CZ 2.86Å; D338-R395 IonicContact OD1-NE 2.82Å; D338-R395 PolarHBondContact OD1-NE 3.49Å; D338-R395 IonicContact OD1-NH2 3.75Å; D338-R395 PolarHBondContact OD1-NH2 3.4Å; D338-R395 IonicContact OD2-CZ 3.41Å; D338-R395 IonicContact OD2-NE 3.95Å; D338-R395 PolarHBondContact OD2-NE 2.89Å; D338-R395 IonicContact OD2-NH2 3.24Å; R395-V415 WeakPolarHBondContact O-CG2 3.43Å; R395-V415 PolarHBondContact O-N 2.84Å
396	K	89.5	Confident	72.9	Confident	158 Å²	158	95.3 Å²	95.3	69%	0.687	48%	0.476	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.6	134.7	175.7	-67.9	-177.2	-179.6	-179.1	0	110.3	G394 A413 V414	G394-K396 PolarHBondContact O-N 2.89Å; K396-A413 WeakPolarHBondContact CA-O 3.41Å; K396-V414 HydrophobicContact CG-CG2 4.22Å
397	V	93.9	Very high	75.7	Confident	3 Å²	3	92.8 Å²	92.8	2%	0.018	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	161.9	172.7	-63.1	0	0	0	0	109.9	I329 F331 Y335 V399 A413 V415 F420	I329-V397 HydrophobicContact CG2-CB 3.66Å; I329-V397 HydrophobicContact CG2-CG1 4.1Å; I329-V397 HydrophobicContact CG2-CG2 3.8Å; F331-V397 HydrophobicContact CD1-CG1 4.38Å; Y335-V397 HydrophobicContact CD2-CG1 4.2Å; Y335-V397 HydrophobicContact CE2-CG1 3.88Å; V397-V399 HydrophobicContact CG2-CG2 4.46Å; V397-A413 PolarHBondContact N-O 3.47Å; V397-A413 PolarHBondContact O-N 3.04Å; V397-V415 HydrophobicContact CB-CG2 4.09Å; V397-V415 HydrophobicContact CG1-CG2 3.46Å; V397-V415 VanDerWaalsContact CG1-CG2 3.46Å; V397-V415 HydrophobicContact CG2-CG2 3.48Å; V397-V415 VanDerWaalsContact CG2-CG2 3.48Å; V397-F420 HydrophobicContact CG2-CD2 4.42Å; V397-F420 HydrophobicContact CG2-CE2 4.29Å
398	V	96.5	Very high	78.5	Confident	42 Å²	42	85.9 Å²	85.9	26%	0.255	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	115.2	173.7	-178.6	0	0	0	0	108.7	M330 K410	M330-V398 HydrophobicContact CB-CB 4.24Å; M330-V398 PolarHBondContact N-O 2.81Å; V398-K410 HydrophobicContact CG1-CB 3.79Å; V398-K410 HydrophobicContact CG1-CD 3.98Å; V398-K410 HydrophobicContact CG1-CG 4.31Å
399	V	97.3	Very high	81.3	Confident	0 Å²	0	79 Å²	79	0%	0	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	134.8	171.3	-177.5	0	0	0	0	108.4	L278 V296 G328 I329 V397 F401 K410 K411 A413	L278-V399 HydrophobicContact CD1-CG1 3.83Å; L278-V399 HydrophobicContact CD1-CG2 3.89Å; V296-V399 HydrophobicContact CG1-CB 4.26Å; V296-V399 HydrophobicContact CG1-CG1 4.11Å; V296-V399 HydrophobicContact CG1-CG2 3.91Å; G328-V399 CarbonylContact O-C 3.5Å; G328-V399 WeakPolarHBondContact O-CA 3.36Å; G328-V399 WeakPolarHBondContact O-CG1 3.34Å; I329-V399 HydrophobicContact CG1-CG2 4.45Å; V397-V399 HydrophobicContact CG2-CG2 4.46Å; V399-F401 HydrophobicContact CG1-CD2 4.48Å; V399-F401 HydrophobicContact CG1-CE2 3.75Å; V399-F401 HydrophobicContact CG1-CZ 3.86Å; V399-K410 CarbonylContact O-C 3.52Å; V399-K410 WeakPolarHBondContact O-CA 3.2Å; V399-K411 PolarHBondContact N-O 2.83Å; V399-K411 PolarHBondContact O-N 3.3Å; V399-A413 HydrophobicContact CG2-CB 3.93Å
400	F	97.3	Very high	84.1	Confident	6 Å²	6	76.3 Å²	76.3	3%	0.026	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	153.2	176.4	70.3	-85.3	0	0	0	110.7	Y260 C327 G328 M330 T402 I407 G409 K410	Y260-F400 AromaticContact CD2-CE2 3.54Å; Y260-F400 HydrophobicContact CD2-CE2 3.54Å; Y260-F400 AromaticContact CD2-CZ 3.62Å; Y260-F400 HydrophobicContact CD2-CZ 3.62Å; Y260-F400 AromaticContact CE2-CE2 3.77Å; Y260-F400 HydrophobicContact CE2-CE2 3.77Å; Y260-F400 HydrophobicContact CE2-CZ 4.32Å; Y260-F400 HydrophobicContact CG-CZ 4.3Å; C327-F400 WeakPolarHBondContact CA-O 3.28Å; G328-F400 VanDerWaalsContact C-CD1 3.43Å; G328-F400 PolarHBondContact N-O 3.18Å; G328-F400 VanDerWaalsContact O-CD1 3.25Å; G328-F400 WeakPolarHBondContact O-CD1 3.26Å; G328-F400 PolarHBondContact O-N 2.78Å; M330-F400 HydrophobicContact CE-CB 4.06Å; M330-F400 HydrophobicContact CE-CD1 3.83Å; M330-F400 HydrophobicContact CE-CE1 4.37Å; M330-F400 HydrophobicContact CE-CG 3.89Å; M330-F400 HydrophobicContact CG-CD1 3.69Å; M330-F400 HydrophobicContact CG-CE1 4.04Å; F400-T402 HydrophobicContact CD2-CG2 4.1Å; F400-T402 HydrophobicContact CE2-CG2 4.1Å; F400-I407 HydrophobicContact CD2-CD1 4.42Å; F400-I407 HydrophobicContact CD2-CG1 4.25Å; F400-G409 WeakPolarHBondContact CA-O 3.39Å; F400-K410 HydrophobicContact CB-CG 4Å
401	F	98.1	Very high	86.8	Confident	0 Å²	0	74.4 Å²	74.4	0%	0	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	146.5	178.2	-62.7	-91.6	0	0	0	110.1	L276 V296 Y298 I305 F315 G326 C327 V399 I407 I408 G409	L276-F401 WeakPolarHBondContact O-CE1 3.26Å; V296-F401 HydrophobicContact CG2-CE2 4.34Å; V296-F401 HydrophobicContact CG2-CZ 4.25Å; Y298-F401 VanDerWaalsContact CB-CD1 3.41Å; Y298-F401 HydrophobicContact CG-CD1 4.33Å; I305-F401 HydrophobicContact CD1-CD2 4.34Å; I305-F401 HydrophobicContact CD1-CE2 3.77Å; I305-F401 HydrophobicContact CG1-CE2 4.47Å; F315-F401 HydrophobicContact CE1-CB 3.95Å; F315-F401 AromaticContact CE1-CD2 3.71Å; F315-F401 HydrophobicContact CE1-CD2 3.71Å; F315-F401 HydrophobicContact CE1-CG 4.08Å; F315-F401 HydrophobicContact CZ-CB 4.47Å; F315-F401 AromaticContact CZ-CD2 3.71Å; F315-F401 HydrophobicContact CZ-CD2 3.71Å; F315-F401 HydrophobicContact CZ-CE2 4.46Å; F315-F401 HydrophobicContact CZ-CG 4.47Å; G326-F401 CarbonylContact O-C 3.56Å; G326-F401 VanDerWaalsContact O-CA 3.24Å; G326-F401 WeakPolarHBondContact O-CA 3.21Å; C327-F401 HydrophobicContact CB-CD1 3.86Å; C327-F401 HydrophobicContact CB-CE1 3.89Å; C327-F401 WeakPolarHBondContact SG-CE1 3.32Å; V399-F401 HydrophobicContact CG1-CD2 4.48Å; V399-F401 HydrophobicContact CG1-CE2 3.75Å; V399-F401 HydrophobicContact CG1-CZ 3.86Å; F401-I407 CarbonylContact O-C 3.59Å; F401-I407 WeakPolarHBondContact O-CA 3.15Å; F401-I408 HydrophobicContact CB-CD1 4.1Å; F401-I408 HydrophobicContact CB-CG1 3.91Å; F401-I408 WeakPolarHBondContact O-CG1 3.48Å; F401-I408 PolarHBondContact O-N 3.28Å; F401-G409 PolarHBondContact N-O 3.05Å; F401-G409 VanDerWaalsContact N-O 3.12Å
402	T	97.2	Very high	89.3	Confident	4 Å²	4	70.5 Å²	70.5	3%	0.025	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	155.2	178	66.4	0	0	0	0	110.6	Y260 G326 F400 K406 I407	Y260-T402 HydrophobicContact CE2-CG2 3.84Å; Y260-T402 PolarHBondContact OH-OG1 3.1Å; G326-T402 WeakPolarHBondContact CA-OG1 3.04Å; G326-T402 PolarHBondContact N-O 2.87Å; G326-T402 PolarHBondContact N-OG1 2.99Å; G326-T402 VanDerWaalsContact N-OG1 3.16Å; G326-T402 PolarHBondContact O-N 2.81Å; F400-T402 HydrophobicContact CD2-CG2 4.1Å; F400-T402 HydrophobicContact CE2-CG2 4.1Å; T402-K406 CarbonylContact C-O 3.53Å; T402-K406 WeakPolarHBondContact CA-O 3.35Å; T402-I407 HydrophobicContact CG2-CG1 4.04Å
403	R	97.1	Very high	91.5	Very high	47 Å²	47	63 Å²	63	18%	0.177	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	125.4	163.3	-179.3	-176.6	170.2	178.4	2.8	108.3	P317 R318 D323 I324 G405 K406 I408	P317-R403 PolarHBondContact O-NH1 2.81Å; P317-R403 VanDerWaalsContact O-NH1 3.1Å; R318-R403 VanDerWaalsContact O-CZ 3.23Å; R318-R403 PolarHBondContact O-NH1 3.04Å; R318-R403 PolarHBondContact O-NH2 3.09Å; D323-R403 VanDerWaalsContact CG-NH2 3.34Å; D323-R403 IonicContact OD1-CZ 3.33Å; D323-R403 IonicContact OD1-NE 3.39Å; D323-R403 PolarHBondContact OD1-NE 3.14Å; D323-R403 VanDerWaalsContact OD1-NE 3.08Å; D323-R403 IonicContact OD1-NH2 3.19Å; D323-R403 PolarHBondContact OD1-NH2 2.84Å; D323-R403 VanDerWaalsContact OD1-NH2 3.17Å; D323-R403 IonicContact OD2-CZ 3.38Å; D323-R403 IonicContact OD2-NE 3.56Å; D323-R403 PolarHBondContact OD2-NE 3.24Å; D323-R403 IonicContact OD2-NH2 3.62Å; D323-R403 PolarHBondContact OD2-NH2 2.9Å; I324-R403 CarbonylContact O-C 3.59Å; I324-R403 WeakPolarHBondContact O-CA 3.41Å; R403-G405 PolarHBondContact O-N 3.06Å; R403-K406 PolarHBondContact N-O 2.85Å; R403-K406 PolarHBondContact O-N 3.02Å; R403-I408 HydrophobicContact CB-CG2 3.79Å
404	N	95.9	Very high	93.3	Very high	89 Å²	89	56.3 Å²	56.3	48%	0.476	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.4	47.6	-178.7	-56.5	-30.8	0	0	0	111.7	D323 I324 K406	D323-N404 WeakPolarHBondContact CA-OD1 3.28Å; D323-N404 PolarHBondContact OD1-ND2 3Å; I324-N404 PolarHBondContact N-OD1 2.79Å; I324-N404 PolarHBondContact O-N 3.21Å; N404-K406 VanDerWaalsContact C-N 3.26Å; N404-K406 PolarHBondContact O-N 3.33Å
405	G	92.6	Very high	94.6	Very high	62 Å²	62	55.9 Å²	55.9	64%	0.639	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.1	0.3	179.3	0	0	0	0	0	116.1	R403	R403-G405 PolarHBondContact O-N 3.06Å
406	K	95.1	Very high	95	Very high	160 Å²	160	52.7 Å²	52.7	70%	0.696	28%	0.279	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.6	128.8	177.9	-173.4	-179.6	177.2	-176.1	0	111.2	T402 R403 N404 I408	T402-K406 CarbonylContact C-O 3.53Å; T402-K406 WeakPolarHBondContact CA-O 3.35Å; R403-K406 PolarHBondContact N-O 2.85Å; R403-K406 PolarHBondContact O-N 3.02Å; N404-K406 VanDerWaalsContact C-N 3.26Å; N404-K406 PolarHBondContact O-N 3.33Å; K406-I408 PolarHBondContact O-N 3.26Å
407	I	95.8	Very high	94.8	Very high	80 Å²	80	50.7 Å²	50.7	41%	0.41	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	122.6	172.3	-62.2	175.2	0	0	0	109.7	M330 F400 F401 T402 K410	M330-I407 HydrophobicContact CE-CD1 4.12Å; F400-I407 HydrophobicContact CD2-CD1 4.42Å; F400-I407 HydrophobicContact CD2-CG1 4.25Å; F401-I407 CarbonylContact O-C 3.59Å; F401-I407 WeakPolarHBondContact O-CA 3.15Å; T402-I407 HydrophobicContact CG2-CG1 4.04Å; I407-K410 HydrophobicContact CG2-CG 4.47Å
408	I	96.4	Very high	94.3	Very high	41 Å²	41	51.7 Å²	51.7	21%	0.21	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	-25.1	177	55.7	167.7	0	0	0	112.2	Y298 F315 F401 R403 K406	Y298-I408 HydrophobicContact CD1-CD1 3.87Å; Y298-I408 HydrophobicContact CD2-CD1 4.16Å; Y298-I408 HydrophobicContact CE1-CD1 3.46Å; Y298-I408 VanDerWaalsContact CE1-CD1 3.46Å; Y298-I408 HydrophobicContact CE2-CD1 3.74Å; Y298-I408 HydrophobicContact CG-CD1 4.21Å; Y298-I408 VanDerWaalsContact CZ-CD1 3.4Å; F315-I408 HydrophobicContact CD1-CD1 4.25Å; F315-I408 HydrophobicContact CE1-CD1 4.11Å; F315-I408 HydrophobicContact CE1-CG1 4.08Å; F401-I408 HydrophobicContact CB-CD1 4.1Å; F401-I408 HydrophobicContact CB-CG1 3.91Å; F401-I408 WeakPolarHBondContact O-CG1 3.48Å; F401-I408 PolarHBondContact O-N 3.28Å; R403-I408 HydrophobicContact CB-CG2 3.79Å; K406-I408 PolarHBondContact O-N 3.26Å
409	G	96	Very high	94.1	Very high	17 Å²	17	49.7 Å²	49.7	18%	0.175	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	179.2	177.8	177.6	0	0	0	0	0	113.3	F400 F401	F400-G409 WeakPolarHBondContact CA-O 3.39Å; F401-G409 PolarHBondContact N-O 3.05Å; F401-G409 VanDerWaalsContact N-O 3.12Å
410	K	97.2	Very high	94	Very high	109 Å²	109	49.9 Å²	49.9	47%	0.474	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	152.5	179.7	-54.9	-175.1	-173.5	-174.9	0	110.5	M330 V398 V399 F400 I407	M330-K410 HydrophobicContact CE-CD 4.26Å; M330-K410 HydrophobicContact SD-CD 4.19Å; M330-K410 PolarHBondContact SD-NZ 2.94Å; M330-K410 VanDerWaalsContact SD-NZ 3.45Å; V398-K410 HydrophobicContact CG1-CB 3.79Å; V398-K410 HydrophobicContact CG1-CD 3.98Å; V398-K410 HydrophobicContact CG1-CG 4.31Å; V399-K410 CarbonylContact O-C 3.52Å; V399-K410 WeakPolarHBondContact O-CA 3.2Å; F400-K410 HydrophobicContact CB-CG 4Å; I407-K410 HydrophobicContact CG2-CG 4.47Å
411	K	95.8	Very high	94	Very high	60 Å²	60	50.2 Å²	50.2	26%	0.261	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	134.1	176.8	-168.2	75.6	171.6	-163.7	0	109.7	V296 I305 D313 V399	V296-K411 HydrophobicContact CG2-CB 4.49Å; V296-K411 HydrophobicContact CG2-CG 4.37Å; I305-K411 HydrophobicContact CD1-CB 3.6Å; I305-K411 HydrophobicContact CD1-CD 4.18Å; I305-K411 HydrophobicContact CD1-CG 3.9Å; D313-K411 IonicContact OD2-NZ 2.65Å; D313-K411 PolarHBondContact OD2-NZ 2.85Å; V399-K411 PolarHBondContact N-O 2.83Å; V399-K411 PolarHBondContact O-N 3.3Å
412	D	95.7	Very high	94	Very high	116 Å²	116	50.4 Å²	50.4	62%	0.62	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71	134.4	169.5	-63.6	-53.9	0	0	0	109.8
413	A	94.2	Very high	94.1	Very high	4 Å²	4	50.2 Å²	50.2	3%	0.033	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	150.7	177	0	0	0	0	0	110.7	V296 K396 V397 V399 F420	V296-A413 HydrophobicContact CG1-CB 4.38Å; K396-A413 WeakPolarHBondContact CA-O 3.41Å; V397-A413 PolarHBondContact N-O 3.47Å; V397-A413 PolarHBondContact O-N 3.04Å; V399-A413 HydrophobicContact CG2-CB 3.93Å; A413-F420 HydrophobicContact CB-CE2 3.91Å; A413-F420 HydrophobicContact CB-CZ 4Å
414	V	92.6	Very high	94.1	Very high	67 Å²	67	48 Å²	48	41%	0.406	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	123.6	173.6	177.5	0	0	0	0	108	G394 K396 P416 F420	G394-V414 VanDerWaalsContact CA-CG1 3.44Å; K396-V414 HydrophobicContact CG-CG2 4.22Å; V414-P416 WeakPolarHBondContact O-CD 3.35Å; V414-F420 WeakPolarHBondContact O-CE2 3.14Å; V414-F420 WeakPolarHBondContact O-CZ 3.13Å
415	V	90.6	Very high	94.2	Very high	16 Å²	16	43.8 Å²	43.8	10%	0.097	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-68.5	122.1	179.4	-176.6	0	0	0	0	109.2	Y335 R395 V397 F420	Y335-V415 HydrophobicContact CE2-CG2 4.27Å; R395-V415 WeakPolarHBondContact O-CG2 3.43Å; R395-V415 PolarHBondContact O-N 2.84Å; V397-V415 HydrophobicContact CB-CG2 4.09Å; V397-V415 HydrophobicContact CG1-CG2 3.46Å; V397-V415 VanDerWaalsContact CG1-CG2 3.46Å; V397-V415 HydrophobicContact CG2-CG2 3.48Å; V397-V415 VanDerWaalsContact CG2-CG2 3.48Å; V415-F420 HydrophobicContact CB-CD2 4.37Å; V415-F420 HydrophobicContact CB-CE2 4.39Å; V415-F420 HydrophobicContact CG1-CD2 4.32Å; V415-F420 HydrophobicContact CG2-CD2 4.05Å; V415-F420 HydrophobicContact CG2-CE2 4.15Å
416	P	90.6	Very high	94.5	Very high	26 Å²	26	40.9 Å²	40.9	17%	0.169	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-70.4	160.8	176.6	30	-34.8	0	0	0	110.7	R280 V414 G418 G419 F420	R280-P416 HydrophobicContact CB-CB 3.77Å; R280-P416 HydrophobicContact CB-CG 3.71Å; V414-P416 WeakPolarHBondContact O-CD 3.35Å; P416-G418 PolarHBondContact O-N 3.47Å; P416-G419 WeakPolarHBondContact CG-O 3.38Å; P416-G419 PolarHBondContact O-N 2.92Å; P416-F420 VanDerWaalsContact CD-CE1 3.42Å; P416-F420 VanDerWaalsContact CD-CZ 3.47Å; P416-F420 HydrophobicContact CG-CD1 3.91Å; P416-F420 HydrophobicContact CG-CE1 3.9Å; P416-F420 HydrophobicContact CG-CG 4.43Å; P416-F420 HydrophobicContact CG-CZ 4.42Å
417	S	85.1	Confident	94.5	Very high	116 Å²	116	34 Å²	34	81%	0.811	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.2	133.4	171.6	-173.1	0	0	0	0	110.5	G419	S417-G419 VanDerWaalsContact C-N 3.29Å; S417-G419 PolarHBondContact O-N 3.32Å
418	G	84	Confident	94.5	Very high	23 Å²	23	30.3 Å²	30.3	24%	0.237	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.9	-6.3	-174.2	0	0	0	0	0	115.6	P416 F421	P416-G418 PolarHBondContact O-N 3.47Å; G418-F421 WeakPolarHBondContact O-CE2 3.23Å
419	G	91.6	Very high	94.4	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.01	18%	0.183	C	C	.	.			trans	94.8	176	173.9	0	0	0	0	0	115.3	P416 S417 F421	P416-G419 WeakPolarHBondContact CG-O 3.38Å; P416-G419 PolarHBondContact O-N 2.92Å; S417-G419 VanDerWaalsContact C-N 3.29Å; S417-G419 PolarHBondContact O-N 3.32Å; G419-F421 WeakPolarHBondContact O-CD2 3.21Å; G419-F421 WeakPolarHBondContact O-CE2 3.22Å
420	F	95.7	Very high	94.2	Very high	4 Å²	4	31.8 Å²	31.8	2%	0.018	19%	0.194	C	C	.	.	P	Polyproline II helix	trans	-96.2	123.3	178.8	-90.6	-49.9	0	0	0	111.4	P253 L254 L278 G294 I329 V397 A413 V414 V415 P416	P253-F420 CarbonylContact C-O 3.52Å; P253-F420 WeakPolarHBondContact CA-O 3.48Å; P253-F420 WeakPolarHBondContact CB-O 3.49Å; L254-F420 PolarHBondContact N-O 3.4Å; L278-F420 HydrophobicContact CB-CB 3.97Å; L278-F420 HydrophobicContact CB-CD1 3.79Å; L278-F420 HydrophobicContact CB-CE1 4.48Å; L278-F420 HydrophobicContact CB-CG 3.96Å; L278-F420 HydrophobicContact CD1-CB 4.18Å; L278-F420 HydrophobicContact CD1-CG 4.36Å; L278-F420 HydrophobicContact CD2-CB 4.44Å; L278-F420 HydrophobicContact CG-CB 4.42Å; G294-F420 WeakPolarHBondContact O-CE1 3.27Å; I329-F420 HydrophobicContact CD1-CB 3.96Å; I329-F420 HydrophobicContact CD1-CD2 4.21Å; V397-F420 HydrophobicContact CG2-CD2 4.42Å; V397-F420 HydrophobicContact CG2-CE2 4.29Å; A413-F420 HydrophobicContact CB-CE2 3.91Å; A413-F420 HydrophobicContact CB-CZ 4Å; V414-F420 WeakPolarHBondContact O-CE2 3.14Å; V414-F420 WeakPolarHBondContact O-CZ 3.13Å; V415-F420 HydrophobicContact CB-CD2 4.37Å; V415-F420 HydrophobicContact CB-CE2 4.39Å; V415-F420 HydrophobicContact CG1-CD2 4.32Å; V415-F420 HydrophobicContact CG2-CD2 4.05Å; V415-F420 HydrophobicContact CG2-CE2 4.15Å; P416-F420 VanDerWaalsContact CD-CE1 3.42Å; P416-F420 VanDerWaalsContact CD-CZ 3.47Å; P416-F420 HydrophobicContact CG-CD1 3.91Å; P416-F420 HydrophobicContact CG-CE1 3.9Å; P416-F420 HydrophobicContact CG-CG 4.43Å; P416-F420 HydrophobicContact CG-CZ 4.42Å
421	F	97	Very high	94.3	Very high	13 Å²	13	26.7 Å²	26.7	6%	0.057	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	132.6	-177.4	-66.7	-105.5	0	0	0	110.9	Q249 A250 R251 H252 P253 L278 A279 K281 G418 G419 T423	Q249-F421 HydrophobicContact CG-CB 3.84Å; A250-F421 WeakPolarHBondContact O-CD1 3.49Å; R251-F421 WeakPolarHBondContact O-CE1 3.4Å; H252-F421 VanDerWaalsContact C-CD1 3.4Å; P253-F421 HydrophobicContact CB-CD1 4.29Å; P253-F421 HydrophobicContact CB-CD2 4.09Å; P253-F421 HydrophobicContact CB-CE1 4.14Å; P253-F421 HydrophobicContact CB-CE2 3.89Å; P253-F421 HydrophobicContact CB-CG 4.27Å; P253-F421 HydrophobicContact CB-CZ 3.92Å; P253-F421 VanDerWaalsContact CD-CE1 3.46Å; P253-F421 HydrophobicContact CG-CE1 4.25Å; P253-F421 HydrophobicContact CG-CE2 4.4Å; P253-F421 HydrophobicContact CG-CZ 4Å; L278-F421 WeakPolarHBondContact CA-O 3.31Å; A279-F421 PolarHBondContact N-O 2.88Å; A279-F421 PolarHBondContact O-N 3.01Å; K281-F421 HydrophobicContact CB-CD2 4.24Å; K281-F421 HydrophobicContact CB-CE2 3.72Å; K281-F421 HydrophobicContact CB-CZ 4.15Å; K281-F421 HydrophobicContact CD-CZ 4.33Å; K281-F421 HydrophobicContact CG-CE2 4.2Å; K281-F421 HydrophobicContact CG-CZ 4.1Å; G418-F421 WeakPolarHBondContact O-CE2 3.23Å; G419-F421 WeakPolarHBondContact O-CD2 3.21Å; G419-F421 WeakPolarHBondContact O-CE2 3.22Å; F421-T423 PolarHBondContact O-N 2.88Å; F421-T423 PolarHBondContact O-OG1 3.14Å
422	P	97.9	Very high	94.4	Very high	4 Å²	4	27.2 Å²	27.2	3%	0.026	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-49.9	124.8	168	-27.5	35	0	0	0	111.1	Q249 A250 H252 L254 F261 L437	Q249-P422 WeakPolarHBondContact CA-O 3.34Å; A250-P422 HydrophobicContact CB-CB 3.84Å; A250-P422 HydrophobicContact CB-CG 4.04Å; A250-P422 PolarHBondContact N-O 3.29Å; H252-P422 WeakPolarHBondContact O-CD 3.3Å; L254-P422 HydrophobicContact CD2-CG 3.69Å; L254-P422 HydrophobicContact CG-CG 3.95Å; F261-P422 HydrophobicContact CD1-CB 3.97Å; F261-P422 HydrophobicContact CD1-CG 4.09Å; F261-P422 HydrophobicContact CD2-CB 4.02Å; F261-P422 HydrophobicContact CE1-CB 3.8Å; F261-P422 HydrophobicContact CE1-CG 4.21Å; F261-P422 HydrophobicContact CE2-CB 3.79Å; F261-P422 HydrophobicContact CG-CB 4.1Å; F261-P422 HydrophobicContact CG-CG 4.41Å; F261-P422 HydrophobicContact CZ-CB 3.71Å; P422-L437 HydrophobicContact CB-CD2 3.92Å; P422-L437 HydrophobicContact CG-CD2 4.33Å
423	T	98.2	Very high	94.5	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	127.4	-174.5	-50.9	0	0	0	0	110.1	L247 A248 Q249 G277 A279 P289 F421	L247-T423 HydrophobicContact CD1-CG2 3.54Å; L247-T423 HydrophobicContact CG-CG2 4.14Å; A248-T423 WeakPolarHBondContact O-CA 3.49Å; Q249-T423 HydrophobicContact CB-CG2 4.25Å; Q249-T423 PolarHBondContact NE2-OG1 3.12Å; Q249-T423 VanDerWaalsContact NE2-OG1 3.14Å; G277-T423 PolarHBondContact N-O 3.32Å; G277-T423 PolarHBondContact O-N 2.86Å; A279-T423 HydrophobicContact CB-CG2 4.38Å; A279-T423 WeakPolarHBondContact CB-OG1 3.34Å; P289-T423 HydrophobicContact CB-CG2 4.43Å; P289-T423 HydrophobicContact CG-CG2 3.69Å; F421-T423 PolarHBondContact O-N 2.88Å; F421-T423 PolarHBondContact O-OG1 3.14Å
424	I	98.3	Very high	94.6	Very high	1 Å²	1	26.1 Å²	26.1	1%	0.005	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	134.2	178.9	-62.5	72.3	0	0	0	108	W220 L233 A248 F261 V263 A275 L276 V433	W220-I424 HydrophobicContact CH2-CD1 3.57Å; W220-I424 HydrophobicContact CH2-CG1 4.46Å; W220-I424 HydrophobicContact CZ3-CD1 3.84Å; L233-I424 HydrophobicContact CD1-CB 4.43Å; L233-I424 HydrophobicContact CD1-CG2 4.43Å; A248-I424 PolarHBondContact N-O 2.82Å; A248-I424 PolarHBondContact O-N 2.72Å; F261-I424 HydrophobicContact CE2-CD1 3.86Å; V263-I424 HydrophobicContact CG2-CG1 3.93Å; A275-I424 WeakPolarHBondContact O-CA 3.38Å; L276-I424 HydrophobicContact CD1-CG1 4.34Å; I424-V433 HydrophobicContact CG2-CG2 4.32Å
425	G	98	Very high	94.8	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	140.8	172.4	0	0	0	0	0	111.3	G246 I274 A275	G246-G425 WeakPolarHBondContact O-CA 3.36Å; I274-G425 WeakPolarHBondContact CA-O 3.46Å; A275-G425 PolarHBondContact N-O 3.41Å; A275-G425 PolarHBondContact O-N 2.91Å
426	M	98.3	Very high	94.9	Very high	1 Å²	1	26.1 Å²	26.1	1%	0.005	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	144.7	172.2	-70.2	-179.6	-68.7	0	0	108.7	V226 L233 Y235 G246 Y273 I274 E431 V433	V226-M426 HydrophobicContact CB-CE 4.3Å; V226-M426 HydrophobicContact CG1-CE 3.7Å; V226-M426 HydrophobicContact CG2-CE 3.59Å; L233-M426 HydrophobicContact CB-CE 3.96Å; Y235-M426 HydrophobicContact CD2-CB 3.84Å; Y235-M426 WeakPolarHBondContact CE2-O 3.28Å; Y235-M426 HydrophobicContact CG-CB 4.1Å; G246-M426 WeakPolarHBondContact CA-O 3.39Å; G246-M426 PolarHBondContact N-O 2.98Å; G246-M426 PolarHBondContact O-N 2.62Å; Y273-M426 WeakPolarHBondContact O-CA 3.37Å; I274-M426 HydrophobicContact CG1-CG 4.39Å; M426-E431 WeakPolarHBondContact CA-OE2 3.36Å; M426-E431 HydrophobicContact CB-CB 4.34Å; M426-E431 VanDerWaalsContact CB-OE2 3.28Å; M426-E431 WeakPolarHBondContact CB-OE2 3.5Å; M426-E431 HydrophobicContact CG-CB 4.21Å; M426-E431 HydrophobicContact SD-CB 3.97Å; M426-V433 HydrophobicContact SD-CG2 4.29Å
427	L	96.4	Very high	95	Very high	14 Å²	14	25.5 Å²	25.5	7%	0.073	16%	0.156	C	C	.	.			trans	-144	-1.5	-174	-173.8	60.5	0	0	0	113.2	G239 S241 D244 V245 Y273 W291 E431	G239-L427 WeakPolarHBondContact CA-O 3.49Å; S241-L427 WeakPolarHBondContact O-CD1 3.48Å; D244-L427 HydrophobicContact CB-CD1 4.31Å; V245-L427 HydrophobicContact CB-CD1 4.4Å; V245-L427 HydrophobicContact CG2-CD1 3.79Å; V245-L427 HydrophobicContact CG2-CD2 4.45Å; Y273-L427 HydrophobicContact CD2-CB 4.31Å; Y273-L427 HydrophobicContact CD2-CD2 4.33Å; Y273-L427 HydrophobicContact CD2-CG 4.33Å; Y273-L427 PolarHBondContact O-N 3.34Å; W291-L427 HydrophobicContact CH2-CD2 4.36Å; L427-E431 PolarHBondContact N-OE2 3.06Å
428	S	95.1	Very high	95.1	Very high	4 Å²	4	25.4 Å²	25.4	3%	0.028	14%	0.142	C	C	.	.	S	Bend	trans	-118.1	137.5	180	-166.5	0	0	0	0	112.1	Y235 E270 K271 G430 E431	Y235-S428 VanDerWaalsContact CD1-C 3.5Å; Y235-S428 WeakPolarHBondContact CD1-O 3.5Å; E270-S428 PolarHBondContact N-OG 2.9Å; K271-S428 PolarHBondContact N-OG 2.97Å; K271-S428 VanDerWaalsContact N-OG 3.07Å; S428-G430 PolarHBondContact O-N 2.96Å; S428-E431 VanDerWaalsContact CB-CD 3.43Å; S428-E431 WeakPolarHBondContact CB-OE1 3.11Å; S428-E431 PolarHBondContact N-OE2 3.5Å; S428-E431 WeakPolarHBondContact O-CB 3.16Å; S428-E431 VanDerWaalsContact O-CG 3.26Å; S428-E431 WeakPolarHBondContact O-CG 3.41Å; S428-E431 PolarHBondContact O-N 3.38Å
429	C	93.7	Very high	95.2	Very high	49 Å²	49	25.2 Å²	25.2	33%	0.331	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.9	134.4	173	-68.5	0	0	0	0	111.5	G269 E270	G269-C429 WeakPolarHBondContact CA-O 3.38Å; E270-C429 PolarHBondContact N-O 2.94Å; E270-C429 VanDerWaalsContact N-O 3.15Å
430	G	92.9	Very high	94.2	Very high	40 Å²	40	34.1 Å²	34.1	41%	0.412	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	88.1	-5.2	177.8	0	0	0	0	0	115.6	S428 K432	S428-G430 PolarHBondContact O-N 2.96Å; G430-K432 PolarHBondContact O-N 3.49Å
431	E	98.1	Very high	92.5	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.005	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	131.5	179.2	-76.9	172	168.3	0	0	112.6	Y235 D267 P268 C272 Y273 I274 M426 L427 S428	Y235-E431 PolarHBondContact N-O 2.92Å; D267-E431 WeakPolarHBondContact O-CA 3.38Å; P268-E431 WeakPolarHBondContact O-CG 3.45Å; C272-E431 VanDerWaalsContact C-OE1 3.28Å; C272-E431 WeakPolarHBondContact CA-OE1 3.41Å; C272-E431 PolarHBondContact N-OE1 3.31Å; Y273-E431 VanDerWaalsContact C-OE1 3.31Å; Y273-E431 WeakPolarHBondContact CA-OE1 3.15Å; Y273-E431 PolarHBondContact N-OE1 3.36Å; I274-E431 HydrophobicContact CD1-CG 4.18Å; I274-E431 HydrophobicContact CG1-CB 4.41Å; I274-E431 HydrophobicContact CG1-CG 3.99Å; M426-E431 WeakPolarHBondContact CA-OE2 3.36Å; M426-E431 HydrophobicContact CB-CB 4.34Å; M426-E431 VanDerWaalsContact CB-OE2 3.28Å; M426-E431 WeakPolarHBondContact CB-OE2 3.5Å; M426-E431 HydrophobicContact CG-CB 4.21Å; M426-E431 HydrophobicContact SD-CB 3.97Å; L427-E431 PolarHBondContact N-OE2 3.06Å; S428-E431 VanDerWaalsContact CB-CD 3.43Å; S428-E431 WeakPolarHBondContact CB-OE1 3.11Å; S428-E431 PolarHBondContact N-OE2 3.5Å; S428-E431 WeakPolarHBondContact O-CB 3.16Å; S428-E431 VanDerWaalsContact O-CG 3.26Å; S428-E431 WeakPolarHBondContact O-CG 3.41Å; S428-E431 PolarHBondContact O-N 3.38Å
432	K	98.1	Very high	90.2	Very high	71 Å²	71	40.9 Å²	40.9	31%	0.309	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	133.1	175.8	-55.1	-172.5	-176.4	-158.3	0	110.7	L232 L233 E234 V266 D267 G430	L232-K432 HydrophobicContact CD1-CB 4.3Å; L233-K432 VanDerWaalsContact O-CA 3.3Å; L233-K432 WeakPolarHBondContact O-CA 3.4Å; E234-K432 HydrophobicContact CB-CG 4.48Å; E234-K432 HydrophobicContact CG-CD 4.09Å; E234-K432 HydrophobicContact CG-CG 4.07Å; E234-K432 VanDerWaalsContact OE1-CE 3.31Å; E234-K432 WeakPolarHBondContact OE1-CE 3.28Å; E234-K432 IonicContact OE1-NZ 3.17Å; E234-K432 PolarHBondContact OE1-NZ 3.49Å; V266-K432 HydrophobicContact CB-CB 4.36Å; V266-K432 WeakPolarHBondContact CB-O 3.48Å; V266-K432 PolarHBondContact N-O 3.44Å; D267-K432 HydrophobicContact CB-CB 3.92Å; D267-K432 HydrophobicContact CB-CD 4.47Å; D267-K432 HydrophobicContact CB-CG 4.13Å; D267-K432 PolarHBondContact N-O 2.96Å; D267-K432 PolarHBondContact O-N 3.04Å; G430-K432 PolarHBondContact O-N 3.49Å
433	V	98.3	Very high	89.8	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	148.2	176.8	-59.7	0	0	0	0	111.2	L232 L233 V263 E264 I274 I424 M426 V435	L232-V433 WeakPolarHBondContact CA-O 3.41Å; L233-V433 HydrophobicContact CB-CG2 3.88Å; L233-V433 HydrophobicContact CD1-CG2 4.26Å; L233-V433 HydrophobicContact CG-CG2 4.43Å; L233-V433 PolarHBondContact N-O 3.1Å; L233-V433 PolarHBondContact O-N 2.88Å; V263-V433 HydrophobicContact CG1-CB 3.56Å; V263-V433 HydrophobicContact CG1-CG1 3.87Å; V263-V433 HydrophobicContact CG1-CG2 3.87Å; E264-V433 CarbonylContact O-C 3.49Å; E264-V433 VanDerWaalsContact O-CA 3.29Å; E264-V433 WeakPolarHBondContact O-CA 3.39Å; I274-V433 HydrophobicContact CD1-CG1 3.81Å; I274-V433 HydrophobicContact CG1-CG1 4.4Å; I274-V433 HydrophobicContact CG2-CG1 3.91Å; I424-V433 HydrophobicContact CG2-CG2 4.32Å; M426-V433 HydrophobicContact SD-CG2 4.29Å; V433-V435 HydrophobicContact CG2-CG2 4.12Å
434	K	96.7	Very high	89.3	Confident	98 Å²	98	44.9 Å²	44.9	43%	0.426	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	130.1	169.8	-173.8	-174.2	175.7	-166.8	0	108.5	T231 V263 E264 V266	T231-K434 CarbonylContact O-C 3.52Å; T231-K434 WeakPolarHBondContact O-CA 3.27Å; T231-K434 WeakPolarHBondContact OG1-CE 3.45Å; V263-K434 CarbonylContact C-O 3.6Å; V263-K434 WeakPolarHBondContact CA-O 3.29Å; E264-K434 HydrophobicContact CB-CB 4.29Å; E264-K434 PolarHBondContact N-O 3.39Å; E264-K434 PolarHBondContact O-N 3.21Å; V266-K434 HydrophobicContact CG2-CB 3.83Å
435	V	95.7	Very high	88.8	Confident	9 Å²	9	47.4 Å²	47.4	6%	0.055	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	137.3	-175.4	-172.2	0	0	0	0	110.1	W220 T231 L233 V263 V433 L437	W220-V435 HydrophobicContact CH2-CB 4.47Å; W220-V435 HydrophobicContact CH2-CG1 4.05Å; W220-V435 HydrophobicContact CH2-CG2 4.21Å; W220-V435 HydrophobicContact CZ2-CB 4.11Å; W220-V435 HydrophobicContact CZ2-CG1 4.05Å; W220-V435 HydrophobicContact CZ2-CG2 4.05Å; T231-V435 PolarHBondContact O-N 3.41Å; L233-V435 HydrophobicContact CD1-CG2 3.65Å; L233-V435 HydrophobicContact CG-CG2 3.88Å; V263-V435 HydrophobicContact CG2-CG1 4.16Å; V263-V435 HydrophobicContact CG2-CG2 4.09Å; V433-V435 HydrophobicContact CG2-CG2 4.12Å; V435-L437 HydrophobicContact CG1-CD2 4.05Å; V435-L437 HydrophobicContact CG1-CG 4.13Å
436	D	93.3	Very high	88.3	Confident	74 Å²	74	50.2 Å²	50.2	40%	0.396	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	107.7	166	-172.3	-10.2	0	0	0	108.1	F261 E262 H438 P439	F261-D436 WeakPolarHBondContact CB-O 3.29Å; E262-D436 PolarHBondContact N-O 2.85Å; E262-D436 PolarHBondContact O-N 3.46Å; D436-H438 WeakPolarHBondContact OD1-CA 3.39Å; D436-H438 PolarHBondContact OD1-N 2.8Å; D436-P439 WeakPolarHBondContact OD2-CA 3.44Å
437	L	92.1	Very high	87.7	Confident	12 Å²	12	53.3 Å²	53.3	6%	0.063	32%	0.319	C	S	.	.	S	Bend	trans	-78.1	-13.1	177.8	-69.5	175.8	0	0	0	112.6	E219 A250 F261 P422 V435 P439	E219-L437 HydrophobicContact CB-CD1 3.77Å; E219-L437 HydrophobicContact CG-CD1 4.46Å; A250-L437 HydrophobicContact CB-CD1 4.14Å; A250-L437 HydrophobicContact CB-CD2 4.25Å; F261-L437 HydrophobicContact CB-CD2 4.22Å; F261-L437 HydrophobicContact CD2-CD2 4.06Å; F261-L437 HydrophobicContact CG-CD2 4.36Å; P422-L437 HydrophobicContact CB-CD2 3.92Å; P422-L437 HydrophobicContact CG-CD2 4.33Å; V435-L437 HydrophobicContact CG1-CD2 4.05Å; V435-L437 HydrophobicContact CG1-CG 4.13Å; L437-P439 VanDerWaalsContact C-CD 3.48Å
438	H	87.8	Confident	87.1	Confident	115 Å²	115	55.9 Å²	55.9	53%	0.532	34%	0.335	S	S	.	.	S	Bend	trans	-137	52.4	-172.7	-59.2	-37.7	0	0	0	112.2	E219 S258 D436	E219-H438 IonicContact OE1-CD2 3.1Å; S258-H438 PolarHBondContact OG-ND1 2.93Å; D436-H438 WeakPolarHBondContact OD1-CA 3.39Å; D436-H438 PolarHBondContact OD1-N 2.8Å
439	P	86.5	Confident	86.5	Confident	19 Å²	19	59.6 Å²	59.6	12%	0.123	36%	0.357	C	S	.	.			trans	-63.2	141.8	-178.8	30.2	-38.2	0	0	0	110.8	Y260 E262 D436 L437 S441	Y260-P439 HydrophobicContact CD1-CG 3.48Å; Y260-P439 VanDerWaalsContact CD1-CG 3.48Å; Y260-P439 HydrophobicContact CE1-CB 4.47Å; Y260-P439 HydrophobicContact CE1-CG 3.76Å; Y260-P439 WeakPolarHBondContact O-CD 3.43Å; E262-P439 HydrophobicContact CG-CB 4.2Å; E262-P439 HydrophobicContact CG-CG 4.1Å; D436-P439 WeakPolarHBondContact OD2-CA 3.44Å; L437-P439 VanDerWaalsContact C-CD 3.48Å; P439-S441 PolarHBondContact O-N 3.35Å
440	L	71.1	Confident	86	Confident	188 Å²	188	60.4 Å²	60.4	98%	0.984	36%	0.359	S	S	*	.	S	Bend	trans	-68.9	-19.8	179	-66.3	175.8	0	0	0	113.2
441	S	58.2	Low	85.4	Confident	81 Å²	81	62.1 Å²	62.1	57%	0.566	35%	0.354	S	S	*	.			trans	-111.7	115.4	174.6	51.4	0	0	0	0	109.4	Y260 P439	Y260-S441 WeakPolarHBondContact CD1-O 3.17Å; Y260-S441 WeakPolarHBondContact CE1-O 3.44Å; P439-S441 PolarHBondContact O-N 3.35Å
442	G	48.8	Very low	84.2	Confident	77 Å²	77	67.6 Å²	67.6	79%	0.794	39%	0.386	S	S	*	.			trans	-131.1	0	172.7	0	0	0	0	0	112.9

Retrieved 442 of 442 residues in 82 ms (Link to these results)

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