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Coagulation factor VII

Initiates the extrinsic pathway of blood coagulation. Serine protease that circulates in the blood in a zymogen form. Factor VII is converted to factor VIIa by factor Xa, factor XIIa, factor IXa, or thrombin by minor proteolysis. In the presence of tissue factor and calcium ions, factor VIIa then converts factor X to factor Xa by limited proteolysis. Factor VIIa also converts factor IX to factor IXa in the presence of tissue factor and calcium.

AlphaFold DB , UniProt , Accession A0A096MAG9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 450 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.1	Very low	36.9	Very low	237 Å²	237	163.4 Å²	163.4	100%	1.167	83%	0.834	S	S	*	*				0	120.4	0	-86	155.3	62.9	0	0	107.7
2	K	32	Very low	37.2	Very low	199 Å²	199	162.5 Å²	162.5	87%	0.865	83%	0.83	S	S	*	*			trans	24.1	119	153.5	-64.1	175	176	-177.6	0	118.1
3	S	33.4	Very low	37.2	Very low	103 Å²	103	163.7 Å²	163.7	72%	0.72	83%	0.826	S	S	*	*				70.9	123.4	88.6	-155.4	0	0	0	0	110.5
4	T	38.8	Very low	37.4	Very low	135 Å²	135	161 Å²	161	83%	0.828	82%	0.822	S	S	*	*				-168.6	148.3	72.3	17.1	0	0	0	0	113
5	M	37.1	Very low	37.4	Very low	167 Å²	167	161.9 Å²	161.9	82%	0.823	82%	0.818	S	S	*	*			trans	-86.6	171.2	171.5	-127.7	-148.8	159.5	0	0	112.4
6	L	39.8	Very low	37.5	Very low	133 Å²	133	159.9 Å²	159.9	70%	0.696	81%	0.808	S	S	*	*			trans	88.1	128.1	163.4	-64.1	124.1	0	0	0	116.2
7	L	35.3	Very low	38	Very low	163 Å²	163	159.8 Å²	159.8	85%	0.853	81%	0.809	S	S	*	*				-157.6	142.1	64.4	-163.8	72.1	0	0	0	114.8
8	R	38.6	Very low	38.1	Very low	205 Å²	205	160 Å²	160	77%	0.774	81%	0.807	S	S	*	*			trans	-54.4	147.3	173.1	-64.1	162.2	170.9	-175.4	-4	115.9
9	V	40.9	Very low	38.2	Very low	151 Å²	151	159.2 Å²	159.2	92%	0.915	81%	0.805	S	S	*	*				-144.5	137.1	128.1	179.2	0	0	0	0	108.9
10	F	37.5	Very low	38.5	Very low	186 Å²	186	157.5 Å²	157.5	82%	0.816	81%	0.808	S	S	*	*			trans	-113.8	174.2	-171.2	-138.6	-95.7	0	0	0	109.6
11	V	37.6	Very low	39.3	Very low	118 Å²	118	157.7 Å²	157.7	72%	0.715	81%	0.806	S	S	*	*			trans	86.4	119.8	165.4	-146.8	0	0	0	0	113.5
12	I	40.2	Very low	40.1	Very low	153 Å²	153	152.1 Å²	152.1	79%	0.785	79%	0.788	S	S	*	*				-154.6	117	54.5	-68.1	160.9	0	0	0	108.4
13	F	37.6	Very low	41	Very low	178 Å²	178	147 Å²	147	78%	0.781	78%	0.782	S	S	*	*				48.6	109.6	107.2	-116	-93.8	0	0	0	116.3
14	V	40	Very low	42.1	Very low	126 Å²	126	146.8 Å²	146.8	76%	0.764	78%	0.781	S	S	*	*				-179.6	121.8	115.7	163.6	0	0	0	0	108.6	I16	V14-I16 PolarHBondContact O-N 3.23Å
15	F	37.8	Very low	43.1	Very low	174 Å²	174	146.7 Å²	146.7	76%	0.763	78%	0.78	S	S	*	*			trans	-58.3	123.2	166.3	-88.9	-103.9	0	0	0	110.9
16	I	38.5	Very low	44.2	Very low	130 Å²	130	147 Å²	147	67%	0.667	78%	0.777	S	S	*	*			trans	-137.2	100.6	137.7	-60.2	-172.4	0	0	0	107	V14 Q18	V14-I16 PolarHBondContact O-N 3.23Å; I16-Q18 HydrophobicContact CG2-CB 3.98Å; I16-Q18 HydrophobicContact CG2-CG 3.72Å; I16-Q18 PolarHBondContact O-N 3.5Å
17	L	45.4	Very low	45.3	Very low	158 Å²	158	145.1 Å²	145.1	83%	0.827	77%	0.767	S	S	*	*			trans	-72.9	105.1	155.9	-80.9	160.7	0	0	0	106.4
18	Q	40.9	Very low	46.6	Very low	164 Å²	164	143.4 Å²	143.4	77%	0.766	76%	0.755	S	S	*	*			trans	-137.9	116.5	161.6	-83.5	-175.9	-40.9	0	0	109.2	I16	I16-Q18 HydrophobicContact CG2-CB 3.98Å; I16-Q18 HydrophobicContact CG2-CG 3.72Å; I16-Q18 PolarHBondContact O-N 3.5Å
19	D	39.1	Very low	47.4	Very low	145 Å²	145	144.6 Å²	144.6	78%	0.775	76%	0.759	S	S	*	*			trans	28.9	102	158.8	-74.8	-35	0	0	0	119.1	Q21	D19-Q21 VanDerWaalsContact C-N 3.31Å; D19-Q21 PolarHBondContact O-N 3.22Å; D19-Q21 VanDerWaalsContact O-N 3.07Å
20	S	45.1	Very low	48.2	Very low	124 Å²	124	143.8 Å²	143.8	87%	0.867	75%	0.745	S	S	*	*			trans	-70.6	88.4	149	52.5	0	0	0	0	109.4
21	Q	55.8	Low	49.3	Very low	163 Å²	163	140 Å²	140	76%	0.762	73%	0.73	S	S	*	*			trans	-76.7	140.4	156.9	-71.7	-161.9	-15.1	0	0	109.1	D19 A23	D19-Q21 VanDerWaalsContact C-N 3.31Å; D19-Q21 PolarHBondContact O-N 3.22Å; D19-Q21 VanDerWaalsContact O-N 3.07Å; Q21-A23 PolarHBondContact O-N 3.1Å; Q21-A23 VanDerWaalsContact O-N 3.17Å
22	P	51	Low	50.3	Low	120 Å²	120	136.2 Å²	136.2	78%	0.779	71%	0.711	S	S	*	*			trans	-61.1	122.3	172.6	26.6	-31.5	0	0	0	107.8	S24	P22-S24 PolarHBondContact O-N 3.47Å
23	A	51.2	Low	51.2	Low	90 Å²	90	135.8 Å²	135.8	74%	0.744	71%	0.71	S	S	*	*			trans	-55.9	115.1	168.7	0	0	0	0	0	107.6	Q21 V25	Q21-A23 PolarHBondContact O-N 3.1Å; Q21-A23 VanDerWaalsContact O-N 3.17Å; A23-V25 PolarHBondContact O-N 3.42Å; A23-V25 VanDerWaalsContact O-N 3.1Å
24	S	56.9	Low	52.2	Low	99 Å²	99	129.8 Å²	129.8	69%	0.692	70%	0.699	S	S	*	*			trans	-63.9	116.4	171.3	62.9	0	0	0	0	107	P22 F26	P22-S24 PolarHBondContact O-N 3.47Å; S24-F26 WeakPolarHBondContact CB-O 3.44Å; S24-F26 PolarHBondContact O-N 3.37Å; S24-F26 PolarHBondContact OG-O 3.19Å; S24-F26 VanDerWaalsContact OG-O 3.11Å
25	V	58.5	Low	53.2	Low	133 Å²	133	128.5 Å²	128.5	81%	0.806	69%	0.691	S	S	*	*	S	Bend	trans	-71.9	-2	171.6	-176.9	0	0	0	0	110.6	A23	A23-V25 PolarHBondContact O-N 3.42Å; A23-V25 VanDerWaalsContact O-N 3.1Å
26	F	61.5	Low	53.8	Low	174 Å²	174	127.1 Å²	127.1	76%	0.763	69%	0.691	S	S	*	*	S	Bend	trans	-116.6	125.5	177.9	-64.4	-79.5	0	0	0	110	S24	S24-F26 WeakPolarHBondContact CB-O 3.44Å; S24-F26 PolarHBondContact O-N 3.37Å; S24-F26 PolarHBondContact OG-O 3.19Å; S24-F26 VanDerWaalsContact OG-O 3.11Å
27	L	62.6	Low	54.5	Low	93 Å²	93	128 Å²	128	49%	0.487	70%	0.696	S	S	.	*			trans	-73.2	143.7	171.3	-77.8	151.8	0	0	0	110	E31 A32 V35	L27-E31 HydrophobicContact CD2-CB 3.94Å; L27-A32 HydrophobicContact CB-CB 4.19Å; L27-V35 HydrophobicContact CD1-CB 4.26Å; L27-V35 HydrophobicContact CD1-CG1 4.49Å; L27-V35 HydrophobicContact CD1-CG2 3.69Å
28	E	61.9	Low	54.6	Low	128 Å²	128	130.8 Å²	130.8	60%	0.598	70%	0.695	S	S	*	*			trans	-65.2	151	171.6	-71.1	-146	176.1	0	0	111.2	H30 E31 A32	E28-H30 PolarHBondContact O-N 3.16Å; E28-H30 IonicContact OE2-CE1 3.49Å; E28-H30 PolarHBondContact OE2-CE1 2.85Å; E28-H30 IonicContact OE2-ND1 2.75Å; E28-E31 PolarHBondContact O-N 3.07Å; E28-A32 PolarHBondContact O-N 2.74Å
29	R	56.4	Low	55.1	Low	230 Å²	230	128.9 Å²	128.9	87%	0.868	70%	0.695	S	S	*	*	H	α-helix	trans	-53.8	-30.7	-170	-166.4	178.1	-161.1	167.7	5.8	114
30	H	55.9	Low	55.8	Low	134 Å²	134	131.3 Å²	131.3	62%	0.62	69%	0.693	S	S	*	*	H	α-helix	trans	-82.4	-26.9	179.4	56.7	-87.5	0	0	0	112.9	E28	E28-H30 PolarHBondContact O-N 3.16Å; E28-H30 IonicContact OE2-CE1 3.49Å; E28-H30 PolarHBondContact OE2-CE1 2.85Å; E28-H30 IonicContact OE2-ND1 2.75Å
31	E	61.3	Low	56.2	Low	105 Å²	105	134.7 Å²	134.7	49%	0.491	69%	0.687	S	S	.	*	H	α-helix	trans	-84.7	-31	176.1	-60.3	-176.4	140.8	0	0	112.2	L27 E28 N33 G34	L27-E31 HydrophobicContact CD2-CB 3.94Å; E28-E31 PolarHBondContact O-N 3.07Å; E31-N33 PolarHBondContact O-N 2.96Å; E31-G34 PolarHBondContact O-N 3.02Å
32	A	59.5	Low	56.1	Low	39 Å²	39	128.6 Å²	128.6	32%	0.322	66%	0.658	S	S	.	*	H	α-helix	trans	-60	-29.5	179	0	0	0	0	0	113.5	L27 E28 G34 V35	L27-A32 HydrophobicContact CB-CB 4.19Å; E28-A32 PolarHBondContact O-N 2.74Å; A32-G34 PolarHBondContact O-N 3.29Å; A32-V35 PolarHBondContact O-N 3.09Å
33	N	57.8	Low	56.1	Low	144 Å²	144	128.6 Å²	128.6	77%	0.77	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	-15.4	177.1	-83.6	-11	0	0	0	113.9	E31	E31-N33 PolarHBondContact O-N 2.96Å
34	G	60.3	Low	56.4	Low	53 Å²	53	127.7 Å²	127.7	55%	0.546	64%	0.64	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.4	-16.9	179.1	0	0	0	0	0	114.9	E31 A32	E31-G34 PolarHBondContact O-N 3.02Å; A32-G34 PolarHBondContact O-N 3.29Å
35	V	60.3	Low	56.5	Low	99 Å²	99	125.1 Å²	125.1	60%	0.6	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.8	-24.3	-169.7	-176	0	0	0	0	112.8	L27 A32	L27-V35 HydrophobicContact CD1-CB 4.26Å; L27-V35 HydrophobicContact CD1-CG1 4.49Å; L27-V35 HydrophobicContact CD1-CG2 3.69Å; A32-V35 PolarHBondContact O-N 3.09Å
36	L	50.7	Low	56.3	Low	144 Å²	144	130.2 Å²	130.2	75%	0.754	63%	0.634	S	S	*	*			trans	-107.4	77.7	173.1	-67.8	173.1	0	0	0	110.2	R38	L36-R38 PolarHBondContact O-N 3.06Å
37	I	52.3	Low	56.2	Low	150 Å²	150	128.7 Å²	128.7	77%	0.769	63%	0.627	S	S	*	*			trans	-75.2	83.3	163.6	-53.5	176.6	0	0	0	107.3	T39	I37-T39 PolarHBondContact O-N 2.95Å
38	R	48.7	Very low	56.2	Low	215 Å²	215	126.1 Å²	126.1	81%	0.811	61%	0.613	S	S	*	*			trans	-74.2	114.6	159.7	-88.7	-172.2	177.9	-173.8	0.3	107	L36 R40	L36-R38 PolarHBondContact O-N 3.06Å; R38-R40 PolarHBondContact O-N 2.97Å; R38-R40 VanDerWaalsContact O-N 3.17Å
39	T	50.9	Low	56.2	Low	125 Å²	125	128.9 Å²	128.9	77%	0.767	63%	0.625	S	S	*	*			trans	-59	118.4	161.3	21.4	0	0	0	0	108.1	I37 R41	I37-T39 PolarHBondContact O-N 2.95Å; T39-R41 PolarHBondContact O-N 3.49Å
40	R	52.3	Low	56.8	Low	196 Å²	196	124.7 Å²	124.7	74%	0.74	62%	0.62	S	S	*	*			trans	-56.7	127.9	169.8	-77.4	168.8	162.1	-164.1	1.1	107.8	R38 F42	R38-R40 PolarHBondContact O-N 2.97Å; R38-R40 VanDerWaalsContact O-N 3.17Å; R40-F42 HydrophobicContact CB-CD1 3.67Å; R40-F42 HydrophobicContact CB-CD2 4.32Å; R40-F42 HydrophobicContact CB-CE1 3.7Å; R40-F42 HydrophobicContact CB-CE2 4.38Å; R40-F42 HydrophobicContact CB-CG 4.07Å; R40-F42 HydrophobicContact CB-CZ 4.14Å; R40-F42 HydrophobicContact CG-CD1 3.85Å; R40-F42 HydrophobicContact CG-CE1 3.35Å; R40-F42 HydrophobicContact CG-CE2 4.44Å; R40-F42 HydrophobicContact CG-CZ 3.78Å; R40-F42 VanDerWaalsContact NE-CZ 3.29Å; R40-F42 VanDerWaalsContact NH1-CZ 3.3Å
41	R	55	Low	57.5	Low	195 Å²	195	122.3 Å²	122.3	74%	0.736	61%	0.607	S	S	*	*	S	Bend	trans	-82.2	-5.9	177.4	-70.4	-178.5	-176.7	168.8	1.5	112.9	T39	T39-R41 PolarHBondContact O-N 3.49Å
42	F	53.4	Low	58.1	Low	35 Å²	35	124.8 Å²	124.8	15%	0.154	62%	0.621	C	S	.	*	S	Bend	trans	-96.3	158.9	-176.8	68.5	-116.8	0	0	0	112	R40 S44 E62	R40-F42 HydrophobicContact CB-CD1 3.67Å; R40-F42 HydrophobicContact CB-CD2 4.32Å; R40-F42 HydrophobicContact CB-CE1 3.7Å; R40-F42 HydrophobicContact CB-CE2 4.38Å; R40-F42 HydrophobicContact CB-CG 4.07Å; R40-F42 HydrophobicContact CB-CZ 4.14Å; R40-F42 HydrophobicContact CG-CD1 3.85Å; R40-F42 HydrophobicContact CG-CE1 3.35Å; R40-F42 HydrophobicContact CG-CE2 4.44Å; R40-F42 HydrophobicContact CG-CZ 3.78Å; R40-F42 VanDerWaalsContact NE-CZ 3.29Å; R40-F42 VanDerWaalsContact NH1-CZ 3.3Å; F42-S44 VanDerWaalsContact C-N 3.31Å; F42-S44 PolarHBondContact O-N 3.24Å; F42-E62 HydrophobicContact CB-CG 4Å; F42-E62 WeakPolarHBondContact CB-OE1 3.2Å; F42-E62 HydrophobicContact CD1-CG 3.94Å; F42-E62 VanDerWaalsContact CD2-CD 3.5Å; F42-E62 HydrophobicContact CD2-CG 4.36Å; F42-E62 WeakPolarHBondContact CD2-OE1 3.46Å; F42-E62 HydrophobicContact CE1-CG 4.25Å; F42-E62 WeakPolarHBondContact CE2-OE1 3.39Å; F42-E62 HydrophobicContact CG-CG 3.92Å; F42-E62 WeakPolarHBondContact CG-OE1 3.25Å; F42-E62 WeakPolarHBondContact CZ-OE1 3.29Å
43	N	50.3	Low	58.8	Low	119 Å²	119	123.6 Å²	123.6	64%	0.636	61%	0.613	S	S	*	*			trans	56.1	42.4	-177.4	-81.3	-67	0	0	0	112.6	G45 E48 E62	N43-G45 PolarHBondContact O-N 3.47Å; N43-G45 VanDerWaalsContact O-N 3.11Å; N43-E48 WeakPolarHBondContact CA-OE2 3.43Å; N43-E48 PolarHBondContact N-OE1 2.82Å; N43-E48 PolarHBondContact N-OE2 2.86Å; N43-E62 PolarHBondContact ND2-OE1 3.36Å
44	S	57.1	Low	60.1	Low	72 Å²	72	120.2 Å²	120.2	50%	0.503	59%	0.594	S	S	.	*			trans	-74.6	6.7	-178.8	60.2	0	0	0	0	114.4	F42 E48 K51	F42-S44 VanDerWaalsContact C-N 3.31Å; F42-S44 PolarHBondContact O-N 3.24Å; S44-E48 PolarHBondContact N-OE2 3.34Å; S44-K51 PolarHBondContact OG-NZ 3.05Å
45	G	59.6	Low	61.3	Low	45 Å²	45	120.2 Å²	120.2	46%	0.464	58%	0.582	S	S	.	*			trans	87.9	-164.4	-179.9	0	0	0	0	0	113.5	N43 F47 E48	N43-G45 PolarHBondContact O-N 3.47Å; N43-G45 VanDerWaalsContact O-N 3.11Å; G45-F47 PolarHBondContact O-N 2.92Å; G45-E48 PolarHBondContact O-N 3.18Å; G45-E48 VanDerWaalsContact O-N 3.11Å
46	W	55.3	Low	62.3	Low	240 Å²	240	121.3 Å²	121.3	91%	0.909	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-36.5	-27.1	-165.5	-158.3	-47.2	0	0	0	117.3
47	F	57.8	Low	63.9	Low	141 Å²	141	116.3 Å²	116.3	62%	0.618	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.8	12.9	-171.6	-55.8	-69.4	0	0	0	115.2	G45 E49 L50	G45-F47 PolarHBondContact O-N 2.92Å; F47-E49 VanDerWaalsContact C-N 3.33Å; F47-E49 PolarHBondContact O-N 3.16Å; F47-L50 HydrophobicContact CB-CD1 4.29Å; F47-L50 HydrophobicContact CD1-CD1 3.63Å; F47-L50 HydrophobicContact CE1-CD1 4.48Å; F47-L50 HydrophobicContact CG-CD1 4.41Å; F47-L50 PolarHBondContact O-N 3.24Å
48	E	63.7	Low	65.3	Low	40 Å²	40	110.1 Å²	110.1	19%	0.187	52%	0.519	C	S	.	.	G	3₁₀ helix	trans	-61.6	-39.3	179.4	-170.4	153.7	-153.2	0	0	112.8	N43 S44 G45 L50 K51	N43-E48 WeakPolarHBondContact CA-OE2 3.43Å; N43-E48 PolarHBondContact N-OE1 2.82Å; N43-E48 PolarHBondContact N-OE2 2.86Å; S44-E48 PolarHBondContact N-OE2 3.34Å; G45-E48 PolarHBondContact O-N 3.18Å; G45-E48 VanDerWaalsContact O-N 3.11Å; E48-L50 PolarHBondContact O-N 3.28Å; E48-K51 WeakPolarHBondContact O-CB 3.47Å; E48-K51 PolarHBondContact O-N 3.19Å; E48-K51 VanDerWaalsContact O-N 3.14Å
49	E	62.6	Low	67.1	Low	186 Å²	186	100.1 Å²	100.1	87%	0.869	48%	0.482	S	S	*	.	G	3₁₀ helix	trans	-66.4	-10.6	174.9	-66.8	-179.9	172.9	0	0	114.6	F47	F47-E49 VanDerWaalsContact C-N 3.33Å; F47-E49 PolarHBondContact O-N 3.16Å
50	L	67.2	Low	68.6	Low	142 Å²	142	99.8 Å²	99.8	74%	0.743	48%	0.475	S	S	*	.	G	3₁₀ helix	trans	-89.5	-6.3	175	-70	175.5	0	0	0	113	F47 E48	F47-L50 HydrophobicContact CB-CD1 4.29Å; F47-L50 HydrophobicContact CD1-CD1 3.63Å; F47-L50 HydrophobicContact CE1-CD1 4.48Å; F47-L50 HydrophobicContact CG-CD1 4.41Å; F47-L50 PolarHBondContact O-N 3.24Å; E48-L50 PolarHBondContact O-N 3.28Å
51	K	70.5	Confident	69.9	Low	84 Å²	84	94.5 Å²	94.5	37%	0.365	46%	0.459	S	S	.	.	S	Bend	trans	-86.4	143.7	178.3	-64.7	177.5	-172.2	163	0	109.2	S44 E48 G53	S44-K51 PolarHBondContact OG-NZ 3.05Å; E48-K51 WeakPolarHBondContact O-CB 3.47Å; E48-K51 PolarHBondContact O-N 3.19Å; E48-K51 VanDerWaalsContact O-N 3.14Å; K51-G53 PolarHBondContact O-N 2.91Å
52	M	74.1	Confident	70.9	Confident	156 Å²	156	88 Å²	88	77%	0.768	44%	0.436	S	S	*	.	P	Polyproline II helix	trans	-58.6	137.1	170.6	-164.7	176.9	80.4	0	0	109.7	R57	M52-R57 PolarHBondContact O-NH2 3.18Å
53	G	74.8	Confident	72.1	Confident	15 Å²	15	95.5 Å²	95.5	16%	0.155	47%	0.469	C	S	.	.	P	Polyproline II helix	trans	-52.9	137.3	-178.8	0	0	0	0	0	111.6	K51	K51-G53 PolarHBondContact O-N 2.91Å
54	N	85.6	Confident	73.7	Confident	72 Å²	72	90.1 Å²	90.1	39%	0.385	44%	0.441	S	S	.	.			trans	-138.8	116.2	179.7	-177	-84.6	0	0	0	111.5	E56 R57 E58	N54-E56 VanDerWaalsContact C-N 3.31Å; N54-E56 PolarHBondContact O-N 3.22Å; N54-E56 PolarHBondContact OD1-N 3.5Å; N54-R57 HydrophobicContact CB-CB 4.12Å; N54-R57 PolarHBondContact O-N 3.02Å; N54-R57 PolarHBondContact OD1-N 2.99Å; N54-E58 PolarHBondContact N-OE1 3.11Å; N54-E58 PolarHBondContact N-OE2 3.34Å; N54-E58 WeakPolarHBondContact O-CB 2.96Å; N54-E58 PolarHBondContact O-N 2.87Å
55	L	84.5	Confident	75.1	Confident	54 Å²	54	89.3 Å²	89.3	28%	0.283	44%	0.435	S	S	.	.	H	α-helix	trans	-54.3	-44.2	-175	-173.4	62.4	0	0	0	113.6	C59 L60 V72 F73 F82	L55-C59 HydrophobicContact CD1-CB 3.97Å; L55-C59 PolarHBondContact O-N 3.45Å; L55-L60 HydrophobicContact CG-CD1 4.46Å; L55-L60 HydrophobicContact CG-CG 4.4Å; L55-L60 PolarHBondContact O-N 3.39Å; L55-L60 VanDerWaalsContact O-N 3.08Å; L55-V72 HydrophobicContact CB-CG1 3.65Å; L55-V72 HydrophobicContact CD1-CG1 4.1Å; L55-V72 HydrophobicContact CG-CG1 4.45Å; L55-F73 HydrophobicContact CD1-CE2 3.97Å; L55-F73 HydrophobicContact CD1-CZ 3.61Å; L55-F73 HydrophobicContact CD2-CE1 4.37Å; L55-F73 HydrophobicContact CD2-CZ 4Å; L55-F73 HydrophobicContact CG-CZ 4.38Å; L55-F82 HydrophobicContact CD1-CD2 4.28Å; L55-F82 HydrophobicContact CD1-CE1 4.33Å; L55-F82 HydrophobicContact CD1-CE2 3.65Å; L55-F82 HydrophobicContact CD1-CZ 3.67Å
56	E	81.8	Confident	76.3	Confident	121 Å²	121	90.5 Å²	90.5	57%	0.565	43%	0.427	S	S	*	.	I	π-helix	trans	-67.6	-47.5	-176.9	-170.3	171.3	-171.5	0	0	110.8	N54 L60 E61	N54-E56 VanDerWaalsContact C-N 3.31Å; N54-E56 PolarHBondContact O-N 3.22Å; N54-E56 PolarHBondContact OD1-N 3.5Å; E56-L60 HydrophobicContact CB-CD1 4.48Å; E56-L60 PolarHBondContact O-N 2.89Å; E56-E61 WeakPolarHBondContact O-CB 3.45Å; E56-E61 WeakPolarHBondContact O-CG 3.33Å; E56-E61 PolarHBondContact O-N 3.37Å
57	R	83.9	Confident	77.7	Confident	40 Å²	40	83.4 Å²	83.4	15%	0.151	41%	0.405	C	S	.	.	I	π-helix	trans	-66.2	-47.7	-179.7	-178.6	-179.3	64.1	-142	-0.3	113	M52 N54	M52-R57 PolarHBondContact O-NH2 3.18Å; N54-R57 HydrophobicContact CB-CB 4.12Å; N54-R57 PolarHBondContact O-N 3.02Å; N54-R57 PolarHBondContact OD1-N 2.99Å
58	E	83	Confident	79.1	Confident	20 Å²	20	80.4 Å²	80.4	9%	0.093	39%	0.392	C	S	.	.	I	π-helix	trans	-88.5	-40.2	-168.7	-76	155.6	-148.5	0	0	112.1	N54 E62 C64 V72	N54-E58 PolarHBondContact N-OE1 3.11Å; N54-E58 PolarHBondContact N-OE2 3.34Å; N54-E58 WeakPolarHBondContact O-CB 2.96Å; N54-E58 PolarHBondContact O-N 2.87Å; E58-E62 CarbonylContact O-C 3.5Å; E58-C64 HydrophobicContact CB-CB 4.46Å; E58-C64 WeakPolarHBondContact O-CB 3.33Å; E58-C64 PolarHBondContact O-N 3.05Å; E58-V72 WeakPolarHBondContact OE2-CG2 3.44Å
59	C	84.9	Confident	80.2	Confident	4 Å²	4	78.5 Å²	78.5	3%	0.027	38%	0.384	C	S	.	.	I	π-helix	trans	-113.2	-21.6	-171.3	-59	0	0	0	0	114.9	L55 E62 C64 F82 Y86	L55-C59 HydrophobicContact CD1-CB 3.97Å; L55-C59 PolarHBondContact O-N 3.45Å; C59-E62 CarbonylContact C-O 3.45Å; C59-E62 WeakPolarHBondContact CA-O 3.39Å; C59-C64 HydrophobicContact CB-CB 3.98Å; C59-C64 WeakPolarHBondContact CB-SG 3.38Å; C59-C64 WeakPolarHBondContact SG-CB 3.35Å; C59-C64 CovalentContact SG-SG 2.04Å; C59-C64 PolarHBondContact SG-SG 3.02Å; C59-F82 HydrophobicContact CB-CE1 4.27Å; C59-F82 HydrophobicContact CB-CZ 3.79Å; C59-Y86 WeakPolarHBondContact CA-OH 3.31Å; C59-Y86 HydrophobicContact CB-CE2 4.06Å; C59-Y86 WeakPolarHBondContact O-CE2 3.44Å; C59-Y86 VanDerWaalsContact O-CZ 3.26Å; C59-Y86 PolarHBondContact O-OH 3.09Å
60	L	82.3	Confident	81.4	Confident	118 Å²	118	73.5 Å²	73.5	62%	0.618	36%	0.357	S	S	*	.	I	π-helix	trans	-98.2	-39.9	178.8	-58.7	179.7	0	0	0	112.8	L55 E56 E62	L55-L60 HydrophobicContact CG-CD1 4.46Å; L55-L60 HydrophobicContact CG-CG 4.4Å; L55-L60 PolarHBondContact O-N 3.39Å; L55-L60 VanDerWaalsContact O-N 3.08Å; E56-L60 HydrophobicContact CB-CD1 4.48Å; E56-L60 PolarHBondContact O-N 2.89Å; L60-E62 VanDerWaalsContact C-N 3.35Å
61	E	80.4	Confident	82.4	Confident	86 Å²	86	70.9 Å²	70.9	40%	0.402	34%	0.34	S	S	.	.	S	Bend	trans	-78	-23.4	173.9	-69.7	-176.8	176	0	0	111.8	E56	E56-E61 WeakPolarHBondContact O-CB 3.45Å; E56-E61 WeakPolarHBondContact O-CG 3.33Å; E56-E61 PolarHBondContact O-N 3.37Å
62	E	75.4	Confident	83.2	Confident	57 Å²	57	68.2 Å²	68.2	27%	0.266	33%	0.331	S	S	.	.	S	Bend	trans	-139.9	173.5	-178.7	-55.4	-157.5	119.8	0	0	113.2	F42 N43 E58 C59 L60 Y86	F42-E62 HydrophobicContact CB-CG 4Å; F42-E62 WeakPolarHBondContact CB-OE1 3.2Å; F42-E62 HydrophobicContact CD1-CG 3.94Å; F42-E62 VanDerWaalsContact CD2-CD 3.5Å; F42-E62 HydrophobicContact CD2-CG 4.36Å; F42-E62 WeakPolarHBondContact CD2-OE1 3.46Å; F42-E62 HydrophobicContact CE1-CG 4.25Å; F42-E62 WeakPolarHBondContact CE2-OE1 3.39Å; F42-E62 HydrophobicContact CG-CG 3.92Å; F42-E62 WeakPolarHBondContact CG-OE1 3.25Å; F42-E62 WeakPolarHBondContact CZ-OE1 3.29Å; N43-E62 PolarHBondContact ND2-OE1 3.36Å; E58-E62 CarbonylContact O-C 3.5Å; C59-E62 CarbonylContact C-O 3.45Å; C59-E62 WeakPolarHBondContact CA-O 3.39Å; L60-E62 VanDerWaalsContact C-N 3.35Å; E62-Y86 PolarHBondContact O-OH 2.97Å
63	K	78.4	Confident	83.9	Confident	194 Å²	194	63.5 Å²	63.5	84%	0.843	31%	0.307	S	S	*	.			trans	-90.5	106.3	171.9	-171.4	175.6	-179.9	176.4	0	110.2	Y86	K63-Y86 VanDerWaalsContact CA-OH 3.23Å; K63-Y86 WeakPolarHBondContact CA-OH 3.43Å
64	C	84.3	Confident	84.3	Confident	6 Å²	6	70.3 Å²	70.3	4%	0.041	34%	0.335	C	S	.	.			trans	-85.6	156.9	176.3	68.8	0	0	0	0	113	E58 C59 E68 W83 Y86	E58-C64 HydrophobicContact CB-CB 4.46Å; E58-C64 WeakPolarHBondContact O-CB 3.33Å; E58-C64 PolarHBondContact O-N 3.05Å; C59-C64 HydrophobicContact CB-CB 3.98Å; C59-C64 WeakPolarHBondContact CB-SG 3.38Å; C59-C64 WeakPolarHBondContact SG-CB 3.35Å; C59-C64 CovalentContact SG-SG 2.04Å; C59-C64 PolarHBondContact SG-SG 3.02Å; C64-E68 WeakPolarHBondContact CA-OE2 3.39Å; C64-E68 HydrophobicContact CB-CB 3.97Å; C64-W83 WeakPolarHBondContact O-CH2 3.37Å; C64-Y86 PolarHBondContact N-OH 2.96Å; C64-Y86 WeakPolarHBondContact SG-CE1 3.4Å
65	S	86.9	Confident	84.4	Confident	54 Å²	54	71.4 Å²	71.4	38%	0.378	34%	0.337	S	S	.	.			trans	-79.9	166	167.3	67.9	0	0	0	0	111.5	E67 E68 A69 W83	S65-E67 PolarHBondContact O-N 3.44Å; S65-E68 WeakPolarHBondContact CB-OE2 3.48Å; S65-E68 PolarHBondContact N-OE2 2.83Å; S65-E68 PolarHBondContact O-N 3.39Å; S65-E68 WeakPolarHBondContact OG-CG 3.29Å; S65-E68 PolarHBondContact OG-N 2.82Å; S65-E68 PolarHBondContact OG-OE2 2.92Å; S65-A69 PolarHBondContact O-N 3.14Å; S65-W83 WeakPolarHBondContact O-CZ3 3.29Å
66	F	86	Confident	84.5	Confident	70 Å²	70	73.7 Å²	73.7	31%	0.307	35%	0.349	S	S	.	.	H	α-helix	trans	-60.7	-36.1	177.7	-178.3	-92.9	0	0	0	111.4	A69 R70 T79 W83	F66-A69 PolarHBondContact O-N 3.06Å; F66-R70 WeakPolarHBondContact O-CB 3.46Å; F66-R70 PolarHBondContact O-N 3.45Å; F66-T79 HydrophobicContact CE1-CG2 4.44Å; F66-T79 HydrophobicContact CE2-CG2 3.98Å; F66-T79 HydrophobicContact CZ-CG2 3.93Å; F66-W83 HydrophobicContact CB-CD2 4.19Å; F66-W83 HydrophobicContact CB-CE3 4.33Å; F66-W83 HydrophobicContact CB-CH2 4.07Å; F66-W83 HydrophobicContact CB-CZ2 3.86Å; F66-W83 HydrophobicContact CB-CZ3 4.28Å; F66-W83 HydrophobicContact CD2-CB 3.93Å; F66-W83 AromaticContact CD2-CD1 3.58Å; F66-W83 AromaticContact CD2-CD2 3.52Å; F66-W83 HydrophobicContact CD2-CD2 3.52Å; F66-W83 AromaticContact CD2-CE2 3.76Å; F66-W83 HydrophobicContact CD2-CE3 4.12Å; F66-W83 AromaticContact CD2-CG 3.4Å; F66-W83 HydrophobicContact CD2-CG 3.4Å; F66-W83 VanDerWaalsContact CD2-CG 3.4Å; F66-W83 AromaticContact CD2-NE1 3.76Å; F66-W83 HydrophobicContact CE2-CB 3.91Å; F66-W83 HydrophobicContact CE2-CD2 4.39Å; F66-W83 AromaticContact CE2-CG 3.84Å; F66-W83 HydrophobicContact CE2-CG 3.84Å; F66-W83 HydrophobicContact CG-CD2 4.34Å
67	E	84.3	Confident	84.7	Confident	92 Å²	92	74.8 Å²	74.8	43%	0.43	35%	0.354	S	S	.	.	H	α-helix	trans	-68.8	-41.5	-177.9	-170.8	64.3	178.6	0	0	111.6	S65 R70 E71	S65-E67 PolarHBondContact O-N 3.44Å; E67-R70 VanDerWaalsContact O-CB 3.32Å; E67-R70 WeakPolarHBondContact O-CB 3.21Å; E67-R70 PolarHBondContact O-N 3.49Å; E67-R70 VanDerWaalsContact O-N 3.14Å; E67-R70 IonicContact OE1-CZ 3.43Å; E67-R70 IonicContact OE1-NE 3.41Å; E67-R70 PolarHBondContact OE1-NE 3.11Å; E67-R70 IonicContact OE1-NH2 2.65Å; E67-R70 PolarHBondContact OE1-NH2 2.99Å; E67-R70 IonicContact OE2-CZ 3.7Å; E67-R70 IonicContact OE2-NE 2.88Å; E67-R70 PolarHBondContact OE2-NE 3.04Å; E67-R70 IonicContact OE2-NH2 3.67Å; E67-E71 WeakPolarHBondContact O-CG 3.47Å; E67-E71 PolarHBondContact O-N 3.42Å
68	E	86.3	Confident	84.9	Confident	78 Å²	78	76 Å²	76	36%	0.364	37%	0.366	S	S	.	.	H	α-helix	trans	-64.5	-42.5	173.4	-70.6	162.9	146.3	0	0	111.3	C64 S65 R70 E71 V72	C64-E68 WeakPolarHBondContact CA-OE2 3.39Å; C64-E68 HydrophobicContact CB-CB 3.97Å; S65-E68 WeakPolarHBondContact CB-OE2 3.48Å; S65-E68 PolarHBondContact N-OE2 2.83Å; S65-E68 PolarHBondContact O-N 3.39Å; S65-E68 WeakPolarHBondContact OG-CG 3.29Å; S65-E68 PolarHBondContact OG-N 2.82Å; S65-E68 PolarHBondContact OG-OE2 2.92Å; E68-R70 VanDerWaalsContact C-N 3.25Å; E68-R70 PolarHBondContact O-N 3.06Å; E68-E71 PolarHBondContact O-N 2.96Å; E68-E71 VanDerWaalsContact O-N 3.16Å; E68-V72 WeakPolarHBondContact O-CG2 3.22Å; E68-V72 PolarHBondContact O-N 2.87Å
69	A	87.2	Confident	85.1	Confident	0 Å²	0	75 Å²	75	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-60.4	-36.6	173	0	0	0	0	0	112.1	S65 F66 E71 V72 F73 T79 F82 W83	S65-A69 PolarHBondContact O-N 3.14Å; F66-A69 PolarHBondContact O-N 3.06Å; A69-E71 VanDerWaalsContact C-N 3.35Å; A69-V72 WeakPolarHBondContact O-CB 3.45Å; A69-V72 PolarHBondContact O-N 2.69Å; A69-F73 WeakPolarHBondContact O-CD2 3.4Å; A69-F73 PolarHBondContact O-N 2.72Å; A69-T79 HydrophobicContact CB-CG2 4.25Å; A69-F82 HydrophobicContact CB-CD1 3.97Å; A69-F82 HydrophobicContact CB-CE1 3.9Å; A69-W83 HydrophobicContact CB-CE3 4Å; A69-W83 HydrophobicContact CB-CZ3 4.23Å
70	R	88.3	Confident	85.1	Confident	80 Å²	80	78.1 Å²	78.1	30%	0.302	38%	0.378	S	S	.	.	H	α-helix	trans	-65.9	-37.4	176.2	-165.3	-173.1	64.8	67	6.4	111.9	F66 E67 E68 V72 E74 T79	F66-R70 WeakPolarHBondContact O-CB 3.46Å; F66-R70 PolarHBondContact O-N 3.45Å; E67-R70 VanDerWaalsContact O-CB 3.32Å; E67-R70 WeakPolarHBondContact O-CB 3.21Å; E67-R70 PolarHBondContact O-N 3.49Å; E67-R70 VanDerWaalsContact O-N 3.14Å; E67-R70 IonicContact OE1-CZ 3.43Å; E67-R70 IonicContact OE1-NE 3.41Å; E67-R70 PolarHBondContact OE1-NE 3.11Å; E67-R70 IonicContact OE1-NH2 2.65Å; E67-R70 PolarHBondContact OE1-NH2 2.99Å; E67-R70 IonicContact OE2-CZ 3.7Å; E67-R70 IonicContact OE2-NE 2.88Å; E67-R70 PolarHBondContact OE2-NE 3.04Å; E67-R70 IonicContact OE2-NH2 3.67Å; E68-R70 VanDerWaalsContact C-N 3.25Å; E68-R70 PolarHBondContact O-N 3.06Å; R70-V72 VanDerWaalsContact C-N 3.33Å; R70-E74 WeakPolarHBondContact O-CA 3.41Å; R70-E74 PolarHBondContact O-N 2.05Å; R70-T79 HydrophobicContact CB-CG2 3.9Å; R70-T79 HydrophobicContact CG-CG2 4.36Å
71	E	87.4	Confident	85.3	Confident	87 Å²	87	78.6 Å²	78.6	41%	0.407	38%	0.377	S	S	.	.	H	α-helix	trans	-69.3	-29.1	174.7	-70.5	179.3	177.1	0	0	112.9	E67 E68 A69	E67-E71 WeakPolarHBondContact O-CG 3.47Å; E67-E71 PolarHBondContact O-N 3.42Å; E68-E71 PolarHBondContact O-N 2.96Å; E68-E71 VanDerWaalsContact O-N 3.16Å; A69-E71 VanDerWaalsContact C-N 3.35Å
72	V	87.3	Confident	85.6	Confident	28 Å²	28	76.3 Å²	76.3	17%	0.17	37%	0.366	C	S	.	.	H	α-helix	trans	-69.9	-44.4	175.1	170.7	0	0	0	0	112.5	L55 E58 E68 A69 R70	L55-V72 HydrophobicContact CB-CG1 3.65Å; L55-V72 HydrophobicContact CD1-CG1 4.1Å; L55-V72 HydrophobicContact CG-CG1 4.45Å; E58-V72 WeakPolarHBondContact OE2-CG2 3.44Å; E68-V72 WeakPolarHBondContact O-CG2 3.22Å; E68-V72 PolarHBondContact O-N 2.87Å; A69-V72 WeakPolarHBondContact O-CB 3.45Å; A69-V72 PolarHBondContact O-N 2.69Å; R70-V72 VanDerWaalsContact C-N 3.33Å
73	F	88.9	Confident	86.1	Confident	58 Å²	58	76.6 Å²	76.6	25%	0.254	36%	0.364	S	S	.	.	H	α-helix	trans	-95.5	-17	-173.9	-64.1	-70.2	0	0	0	113.7	L55 A69 H75 V78 F82	L55-F73 HydrophobicContact CD1-CE2 3.97Å; L55-F73 HydrophobicContact CD1-CZ 3.61Å; L55-F73 HydrophobicContact CD2-CE1 4.37Å; L55-F73 HydrophobicContact CD2-CZ 4Å; L55-F73 HydrophobicContact CG-CZ 4.38Å; A69-F73 WeakPolarHBondContact O-CD2 3.4Å; A69-F73 PolarHBondContact O-N 2.72Å; F73-H75 PolarHBondContact O-N 3.42Å; F73-V78 HydrophobicContact CB-CB 4.37Å; F73-V78 HydrophobicContact CB-CG1 4.19Å; F73-V78 HydrophobicContact CD1-CG1 3.67Å; F73-V78 HydrophobicContact CE1-CG1 4.24Å; F73-V78 HydrophobicContact CG-CG1 3.96Å; F73-F82 HydrophobicContact CD2-CB 4.3Å; F73-F82 HydrophobicContact CD2-CD1 4.46Å; F73-F82 HydrophobicContact CD2-CG 4.42Å; F73-F82 HydrophobicContact CE2-CB 3.59Å; F73-F82 AromaticContact CE2-CD1 3.56Å; F73-F82 HydrophobicContact CE2-CD1 3.56Å; F73-F82 AromaticContact CE2-CD2 3.9Å; F73-F82 HydrophobicContact CE2-CD2 3.9Å; F73-F82 HydrophobicContact CE2-CE1 4.19Å; F73-F82 AromaticContact CE2-CG 3.38Å; F73-F82 HydrophobicContact CE2-CG 3.38Å; F73-F82 HydrophobicContact CZ-CB 3.92Å; F73-F82 HydrophobicContact CZ-CD1 4.3Å; F73-F82 AromaticContact CZ-CD2 3.79Å; F73-F82 HydrophobicContact CZ-CD2 3.79Å; F73-F82 HydrophobicContact CZ-CE2 4.41Å; F73-F82 AromaticContact CZ-CG 3.72Å; F73-F82 HydrophobicContact CZ-CG 3.72Å
74	E	83.9	Confident	86.2	Confident	158 Å²	158	74.6 Å²	74.6	74%	0.738	36%	0.356	S	S	*	.			trans	50.1	19.5	-177.3	-59.9	-176.1	172.7	0	0	114	R70	R70-E74 WeakPolarHBondContact O-CA 3.41Å; R70-E74 PolarHBondContact O-N 2.05Å
75	H	87.8	Confident	85.8	Confident	95 Å²	95	83.3 Å²	83.3	44%	0.44	39%	0.388	S	S	.	.			trans	-148.4	123.5	-174.2	-164.8	-65.1	0	0	0	111.3	F73 E77 V78 T79	F73-H75 PolarHBondContact O-N 3.42Å; H75-E77 IonicContact CE1-OE2 3.85Å; H75-E77 PolarHBondContact ND1-N 3.41Å; H75-E77 PolarHBondContact O-N 3.17Å; H75-V78 HydrophobicContact CB-CB 4.41Å; H75-V78 HydrophobicContact CB-CG2 4.28Å; H75-V78 PolarHBondContact O-N 2.87Å; H75-T79 WeakPolarHBondContact O-CB 3.34Å; H75-T79 PolarHBondContact O-N 3.06Å; H75-T79 PolarHBondContact O-OG1 3.1Å
76	D	85.4	Confident	85.4	Confident	101 Å²	101	83.5 Å²	83.5	54%	0.54	38%	0.381	S	S	.	.	H	α-helix	trans	-65.5	-41.5	-170.1	-67.9	-22.7	0	0	0	113.4	T79 N80	D76-T79 PolarHBondContact O-N 2.68Å; D76-N80 VanDerWaalsContact O-CB 3.31Å; D76-N80 WeakPolarHBondContact O-CB 3.1Å; D76-N80 VanDerWaalsContact O-CG 3.22Å; D76-N80 PolarHBondContact O-N 3.31Å; D76-N80 PolarHBondContact O-ND2 3.17Å
77	E	87.3	Confident	84.9	Confident	144 Å²	144	82.8 Å²	82.8	67%	0.673	39%	0.385	S	S	*	.	H	α-helix	trans	-63.3	-46.6	179.1	-67.2	-180	163.8	0	0	112.5	H75 N80 E81	H75-E77 IonicContact CE1-OE2 3.85Å; H75-E77 PolarHBondContact ND1-N 3.41Å; H75-E77 PolarHBondContact O-N 3.17Å; E77-N80 PolarHBondContact O-N 3.06Å; E77-E81 PolarHBondContact O-N 3Å
78	V	86.9	Confident	84.3	Confident	65 Å²	65	80.5 Å²	80.5	39%	0.394	38%	0.375	S	S	.	.	H	α-helix	trans	-66.5	-40.7	178.9	-176.5	0	0	0	0	110.9	F73 H75 N80 E81 F82	F73-V78 HydrophobicContact CB-CB 4.37Å; F73-V78 HydrophobicContact CB-CG1 4.19Å; F73-V78 HydrophobicContact CD1-CG1 3.67Å; F73-V78 HydrophobicContact CE1-CG1 4.24Å; F73-V78 HydrophobicContact CG-CG1 3.96Å; H75-V78 HydrophobicContact CB-CB 4.41Å; H75-V78 HydrophobicContact CB-CG2 4.28Å; H75-V78 PolarHBondContact O-N 2.87Å; V78-N80 VanDerWaalsContact C-N 3.33Å; V78-N80 PolarHBondContact O-N 3.07Å; V78-E81 PolarHBondContact O-N 2.89Å; V78-F82 WeakPolarHBondContact O-CB 3.2Å; V78-F82 PolarHBondContact O-N 2.9Å
79	T	88.4	Confident	83.7	Confident	0 Å²	0	80.7 Å²	80.7	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-60.1	-44.6	174.3	-54.5	0	0	0	0	110.9	F66 A69 R70 H75 D76 F82 W83	F66-T79 HydrophobicContact CE1-CG2 4.44Å; F66-T79 HydrophobicContact CE2-CG2 3.98Å; F66-T79 HydrophobicContact CZ-CG2 3.93Å; A69-T79 HydrophobicContact CB-CG2 4.25Å; R70-T79 HydrophobicContact CB-CG2 3.9Å; R70-T79 HydrophobicContact CG-CG2 4.36Å; H75-T79 WeakPolarHBondContact O-CB 3.34Å; H75-T79 PolarHBondContact O-N 3.06Å; H75-T79 PolarHBondContact O-OG1 3.1Å; D76-T79 PolarHBondContact O-N 2.68Å; T79-F82 PolarHBondContact O-N 2.75Å; T79-W83 WeakPolarHBondContact O-CB 3.17Å; T79-W83 PolarHBondContact O-N 3.34Å
80	N	84.9	Confident	83.3	Confident	70 Å²	70	84.8 Å²	84.8	37%	0.374	41%	0.405	S	S	.	.	H	α-helix	trans	-65.3	-39.1	177.8	-78.2	-45.3	0	0	0	112.4	D76 E77 V78 K84	D76-N80 VanDerWaalsContact O-CB 3.31Å; D76-N80 WeakPolarHBondContact O-CB 3.1Å; D76-N80 VanDerWaalsContact O-CG 3.22Å; D76-N80 PolarHBondContact O-N 3.31Å; D76-N80 PolarHBondContact O-ND2 3.17Å; E77-N80 PolarHBondContact O-N 3.06Å; V78-N80 VanDerWaalsContact C-N 3.33Å; V78-N80 PolarHBondContact O-N 3.07Å; N80-K84 WeakPolarHBondContact O-CB 3.4Å; N80-K84 WeakPolarHBondContact O-CG 3.4Å; N80-K84 PolarHBondContact O-N 3.23Å
81	E	85.6	Confident	83	Confident	127 Å²	127	86.6 Å²	86.6	59%	0.593	41%	0.412	S	S	*	.	H	α-helix	trans	-65.3	-42.2	174.9	-73.9	-165	162.4	0	0	112.6	E77 V78	E77-E81 PolarHBondContact O-N 3Å; V78-E81 PolarHBondContact O-N 2.89Å
82	F	86.9	Confident	83	Confident	39 Å²	39	83.7 Å²	83.7	17%	0.171	40%	0.401	C	S	.	.	H	α-helix	trans	-63.1	-50.2	173.5	170.9	-99.9	0	0	0	111.2	L55 C59 A69 F73 V78 T79 K84 R85 Y86	L55-F82 HydrophobicContact CD1-CD2 4.28Å; L55-F82 HydrophobicContact CD1-CE1 4.33Å; L55-F82 HydrophobicContact CD1-CE2 3.65Å; L55-F82 HydrophobicContact CD1-CZ 3.67Å; C59-F82 HydrophobicContact CB-CE1 4.27Å; C59-F82 HydrophobicContact CB-CZ 3.79Å; A69-F82 HydrophobicContact CB-CD1 3.97Å; A69-F82 HydrophobicContact CB-CE1 3.9Å; F73-F82 HydrophobicContact CD2-CB 4.3Å; F73-F82 HydrophobicContact CD2-CD1 4.46Å; F73-F82 HydrophobicContact CD2-CG 4.42Å; F73-F82 HydrophobicContact CE2-CB 3.59Å; F73-F82 AromaticContact CE2-CD1 3.56Å; F73-F82 HydrophobicContact CE2-CD1 3.56Å; F73-F82 AromaticContact CE2-CD2 3.9Å; F73-F82 HydrophobicContact CE2-CD2 3.9Å; F73-F82 HydrophobicContact CE2-CE1 4.19Å; F73-F82 AromaticContact CE2-CG 3.38Å; F73-F82 HydrophobicContact CE2-CG 3.38Å; F73-F82 HydrophobicContact CZ-CB 3.92Å; F73-F82 HydrophobicContact CZ-CD1 4.3Å; F73-F82 AromaticContact CZ-CD2 3.79Å; F73-F82 HydrophobicContact CZ-CD2 3.79Å; F73-F82 HydrophobicContact CZ-CE2 4.41Å; F73-F82 AromaticContact CZ-CG 3.72Å; F73-F82 HydrophobicContact CZ-CG 3.72Å; V78-F82 WeakPolarHBondContact O-CB 3.2Å; V78-F82 PolarHBondContact O-N 2.9Å; T79-F82 PolarHBondContact O-N 2.75Å; F82-K84 PolarHBondContact O-N 3.17Å; F82-R85 PolarHBondContact O-N 2.74Å; F82-Y86 AromaticContact CE1-CD1 3.99Å; F82-Y86 HydrophobicContact CE1-CD1 3.99Å; F82-Y86 HydrophobicContact CE1-CD2 4.08Å; F82-Y86 AromaticContact CE1-CG 3.65Å; F82-Y86 HydrophobicContact CE1-CG 3.65Å; F82-Y86 HydrophobicContact CE2-CD2 4.17Å; F82-Y86 HydrophobicContact CE2-CG 4.39Å; F82-Y86 HydrophobicContact CZ-CD1 4.23Å; F82-Y86 AromaticContact CZ-CD2 3.49Å; F82-Y86 HydrophobicContact CZ-CD2 3.49Å; F82-Y86 VanDerWaalsContact CZ-CD2 3.49Å; F82-Y86 HydrophobicContact CZ-CE2 4.08Å; F82-Y86 AromaticContact CZ-CG 3.56Å; F82-Y86 HydrophobicContact CZ-CG 3.56Å; F82-Y86 WeakPolarHBondContact O-CB 3.23Å; F82-Y86 PolarHBondContact O-N 2.79Å
83	W	85.6	Confident	82.9	Confident	62 Å²	62	87.9 Å²	87.9	24%	0.235	43%	0.426	C	S	.	.	H	α-helix	trans	-63.3	-39.3	-174.8	-167.2	-105.5	0	0	0	112.6	C64 S65 F66 A69 T79 R85 Y86 S87	C64-W83 WeakPolarHBondContact O-CH2 3.37Å; S65-W83 WeakPolarHBondContact O-CZ3 3.29Å; F66-W83 HydrophobicContact CB-CD2 4.19Å; F66-W83 HydrophobicContact CB-CE3 4.33Å; F66-W83 HydrophobicContact CB-CH2 4.07Å; F66-W83 HydrophobicContact CB-CZ2 3.86Å; F66-W83 HydrophobicContact CB-CZ3 4.28Å; F66-W83 HydrophobicContact CD2-CB 3.93Å; F66-W83 AromaticContact CD2-CD1 3.58Å; F66-W83 AromaticContact CD2-CD2 3.52Å; F66-W83 HydrophobicContact CD2-CD2 3.52Å; F66-W83 AromaticContact CD2-CE2 3.76Å; F66-W83 HydrophobicContact CD2-CE3 4.12Å; F66-W83 AromaticContact CD2-CG 3.4Å; F66-W83 HydrophobicContact CD2-CG 3.4Å; F66-W83 VanDerWaalsContact CD2-CG 3.4Å; F66-W83 AromaticContact CD2-NE1 3.76Å; F66-W83 HydrophobicContact CE2-CB 3.91Å; F66-W83 HydrophobicContact CE2-CD2 4.39Å; F66-W83 AromaticContact CE2-CG 3.84Å; F66-W83 HydrophobicContact CE2-CG 3.84Å; F66-W83 HydrophobicContact CG-CD2 4.34Å; A69-W83 HydrophobicContact CB-CE3 4Å; A69-W83 HydrophobicContact CB-CZ3 4.23Å; T79-W83 WeakPolarHBondContact O-CB 3.17Å; T79-W83 PolarHBondContact O-N 3.34Å; W83-R85 PolarHBondContact O-N 3.48Å; W83-R85 VanDerWaalsContact O-N 3.1Å; W83-Y86 AromaticContact CE3-CD1 3.86Å; W83-Y86 HydrophobicContact CE3-CD1 3.86Å; W83-Y86 HydrophobicContact CH2-CD1 4.36Å; W83-Y86 AromaticContact CZ3-CD1 3.63Å; W83-Y86 HydrophobicContact CZ3-CD1 3.63Å; W83-Y86 AromaticContact CZ3-CE1 4Å; W83-Y86 HydrophobicContact CZ3-CE1 4Å; W83-Y86 PolarHBondContact O-N 3.48Å; W83-Y86 VanDerWaalsContact O-N 3.13Å; W83-S87 WeakPolarHBondContact O-CB 3.44Å; W83-S87 PolarHBondContact O-N 2.88Å; W83-S87 PolarHBondContact O-OG 2.79Å
84	K	80.4	Confident	82.8	Confident	152 Å²	152	89.4 Å²	89.4	66%	0.661	45%	0.445	S	S	*	.	H	α-helix	trans	-52.6	-32.6	173.7	-81.3	171.7	-177.2	177.3	0	113.2	N80 F82 I88	N80-K84 WeakPolarHBondContact O-CB 3.4Å; N80-K84 WeakPolarHBondContact O-CG 3.4Å; N80-K84 PolarHBondContact O-N 3.23Å; F82-K84 PolarHBondContact O-N 3.17Å; K84-I88 WeakPolarHBondContact O-CD1 3.17Å; K84-I88 VanDerWaalsContact O-CG1 3.32Å; K84-I88 WeakPolarHBondContact O-CG1 3.45Å
85	R	75.1	Confident	83.1	Confident	190 Å²	190	85.6 Å²	85.6	72%	0.717	44%	0.44	S	S	*	.	H	α-helix	trans	-90.8	-37.6	177.5	-64.2	178.4	179.1	153.6	3.6	112.2	F82 W83	F82-R85 PolarHBondContact O-N 2.74Å; W83-R85 PolarHBondContact O-N 3.48Å; W83-R85 VanDerWaalsContact O-N 3.1Å
86	Y	79.6	Confident	83.3	Confident	57 Å²	57	82 Å²	82	22%	0.224	43%	0.425	C	S	.	.	H	α-helix	trans	-75.2	-35.2	-174.2	-173.9	-105	0	0	0	114	C59 E62 K63 C64 F82 W83 I88	C59-Y86 WeakPolarHBondContact CA-OH 3.31Å; C59-Y86 HydrophobicContact CB-CE2 4.06Å; C59-Y86 WeakPolarHBondContact O-CE2 3.44Å; C59-Y86 VanDerWaalsContact O-CZ 3.26Å; C59-Y86 PolarHBondContact O-OH 3.09Å; E62-Y86 PolarHBondContact O-OH 2.97Å; K63-Y86 VanDerWaalsContact CA-OH 3.23Å; K63-Y86 WeakPolarHBondContact CA-OH 3.43Å; C64-Y86 PolarHBondContact N-OH 2.96Å; C64-Y86 WeakPolarHBondContact SG-CE1 3.4Å; F82-Y86 AromaticContact CE1-CD1 3.99Å; F82-Y86 HydrophobicContact CE1-CD1 3.99Å; F82-Y86 HydrophobicContact CE1-CD2 4.08Å; F82-Y86 AromaticContact CE1-CG 3.65Å; F82-Y86 HydrophobicContact CE1-CG 3.65Å; F82-Y86 HydrophobicContact CE2-CD2 4.17Å; F82-Y86 HydrophobicContact CE2-CG 4.39Å; F82-Y86 HydrophobicContact CZ-CD1 4.23Å; F82-Y86 AromaticContact CZ-CD2 3.49Å; F82-Y86 HydrophobicContact CZ-CD2 3.49Å; F82-Y86 VanDerWaalsContact CZ-CD2 3.49Å; F82-Y86 HydrophobicContact CZ-CE2 4.08Å; F82-Y86 AromaticContact CZ-CG 3.56Å; F82-Y86 HydrophobicContact CZ-CG 3.56Å; F82-Y86 WeakPolarHBondContact O-CB 3.23Å; F82-Y86 PolarHBondContact O-N 2.79Å; W83-Y86 AromaticContact CE3-CD1 3.86Å; W83-Y86 HydrophobicContact CE3-CD1 3.86Å; W83-Y86 HydrophobicContact CH2-CD1 4.36Å; W83-Y86 AromaticContact CZ3-CD1 3.63Å; W83-Y86 HydrophobicContact CZ3-CD1 3.63Å; W83-Y86 AromaticContact CZ3-CE1 4Å; W83-Y86 HydrophobicContact CZ3-CE1 4Å; W83-Y86 PolarHBondContact O-N 3.48Å; W83-Y86 VanDerWaalsContact O-N 3.13Å; Y86-I88 VanDerWaalsContact C-N 3.29Å; Y86-I88 PolarHBondContact O-N 2.86Å
87	S	74.4	Confident	83.7	Confident	56 Å²	56	78 Å²	78	39%	0.392	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-0.2	-175.8	73.6	0	0	0	0	114.2	W83 P89	W83-S87 WeakPolarHBondContact O-CB 3.44Å; W83-S87 PolarHBondContact O-N 2.88Å; W83-S87 PolarHBondContact O-OG 2.79Å; S87-P89 VanDerWaalsContact O-CD 3.23Å; S87-P89 WeakPolarHBondContact O-CD 3.38Å
88	I	71.8	Confident	84	Confident	43 Å²	43	76 Å²	76	22%	0.221	40%	0.395	C	S	.	.	S	Bend	trans	-66.6	116.6	179.3	-58.7	167.9	0	0	0	107.7	K84 Y86 D90 E107	K84-I88 WeakPolarHBondContact O-CD1 3.17Å; K84-I88 VanDerWaalsContact O-CG1 3.32Å; K84-I88 WeakPolarHBondContact O-CG1 3.45Å; Y86-I88 VanDerWaalsContact C-N 3.29Å; Y86-I88 PolarHBondContact O-N 2.86Å; I88-D90 PolarHBondContact O-N 3.09Å; I88-E107 HydrophobicContact CD1-CB 4.35Å; I88-E107 HydrophobicContact CD1-CG 4Å
89	P	74.9	Confident	84.2	Confident	82 Å²	82	76 Å²	76	53%	0.532	39%	0.393	S	S	.	.			trans	-58.6	128.2	176.6	-21.8	33.5	0	0	0	109.7	S87 R91 N105	S87-P89 VanDerWaalsContact O-CD 3.23Å; S87-P89 WeakPolarHBondContact O-CD 3.38Å; P89-R91 PolarHBondContact O-N 3.41Å; P89-N105 PolarHBondContact O-ND2 2.88Å; P89-N105 PolarHBondContact O-OD1 2.91Å
90	D	78.9	Confident	84.3	Confident	87 Å²	87	86.8 Å²	86.8	47%	0.465	43%	0.434	S	S	.	.			trans	-71.1	101.4	171.8	-176.2	2.5	0	0	0	109.1	I88 C92 T93	I88-D90 PolarHBondContact O-N 3.09Å; D90-C92 PolarHBondContact O-N 3.25Å; D90-C92 VanDerWaalsContact OD1-CB 3.28Å; D90-C92 WeakPolarHBondContact OD1-CB 3.47Å; D90-C92 PolarHBondContact OD1-N 2.74Å; D90-T93 HydrophobicContact CB-CG2 3.95Å; D90-T93 PolarHBondContact O-OG1 3.01Å; D90-T93 VanDerWaalsContact O-OG1 3.12Å
91	R	82.2	Confident	84.6	Confident	117 Å²	117	84.1 Å²	84.1	44%	0.442	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-4.6	-179.9	-58	-174.5	-170.5	-105.6	8	112.3	P89 S94 N105 E108 Y110	P89-R91 PolarHBondContact O-N 3.41Å; R91-S94 PolarHBondContact O-OG 2.88Å; R91-N105 PolarHBondContact N-OD1 2.89Å; R91-E108 PolarHBondContact NE-O 2.75Å; R91-E108 PolarHBondContact NH2-O 2.84Å; R91-Y110 HydrophobicContact CB-CD1 4.11Å
92	C	87.6	Confident	85	Confident	26 Å²	26	82.1 Å²	82.1	18%	0.176	42%	0.42	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-11	174.9	-70.6	0	0	0	0	113.5	D90 S94 A95 C103 I104 N105	D90-C92 PolarHBondContact O-N 3.25Å; D90-C92 VanDerWaalsContact OD1-CB 3.28Å; D90-C92 WeakPolarHBondContact OD1-CB 3.47Å; D90-C92 PolarHBondContact OD1-N 2.74Å; C92-S94 PolarHBondContact O-N 2.9Å; C92-A95 PolarHBondContact O-N 3.36Å; C92-C103 WeakPolarHBondContact CA-SG 3.18Å; C92-C103 HydrophobicContact CB-CB 3.73Å; C92-C103 WeakPolarHBondContact CB-SG 3.17Å; C92-C103 WeakPolarHBondContact SG-CB 3.39Å; C92-C103 CovalentContact SG-SG 2.04Å; C92-C103 PolarHBondContact SG-SG 2.98Å; C92-I104 VanDerWaalsContact SG-C 3.54Å; C92-N105 PolarHBondContact SG-N 2.88Å
93	T	85.2	Confident	85.3	Confident	116 Å²	116	82.1 Å²	82.1	71%	0.712	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-25.5	178.9	58.2	0	0	0	0	113.5	D90 A95	D90-T93 HydrophobicContact CB-CG2 3.95Å; D90-T93 PolarHBondContact O-OG1 3.01Å; D90-T93 VanDerWaalsContact O-OG1 3.12Å; T93-A95 PolarHBondContact O-N 2.95Å
94	S	86.3	Confident	85.5	Confident	91 Å²	91	82.6 Å²	82.6	64%	0.636	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	0.7	174.8	57.3	0	0	0	0	113.6	R91 C92	R91-S94 PolarHBondContact O-OG 2.88Å; C92-S94 PolarHBondContact O-N 2.9Å
95	A	89.2	Confident	85.7	Confident	78 Å²	78	77.9 Å²	77.9	65%	0.645	41%	0.412	S	S	*	.			trans	47.7	57.8	-174.1	0	0	0	0	0	112.8	C92 T93 C97	C92-A95 PolarHBondContact O-N 3.36Å; T93-A95 PolarHBondContact O-N 2.95Å; A95-C97 VanDerWaalsContact C-N 3.29Å; A95-C97 PolarHBondContact O-N 2.9Å
96	P	92.1	Very high	85.9	Confident	20 Å²	20	71.9 Å²	71.9	13%	0.13	40%	0.395	C	S	.	.			trans	-68.5	-26.7	-172.2	28.1	-35	0	0	0	113.4	Q98 Y110 N122	P96-Q98 PolarHBondContact O-N 3.08Å; P96-Y110 HydrophobicContact CB-CD2 4.08Å; P96-Y110 HydrophobicContact CB-CE1 4.19Å; P96-Y110 HydrophobicContact CB-CE2 3.61Å; P96-Y110 HydrophobicContact CG-CD1 4.23Å; P96-Y110 HydrophobicContact CG-CD2 3.59Å; P96-Y110 HydrophobicContact CG-CE1 4.3Å; P96-Y110 HydrophobicContact CG-CE2 3.68Å; P96-Y110 HydrophobicContact CG-CG 3.89Å; P96-N122 WeakPolarHBondContact O-CB 3.47Å; P96-N122 PolarHBondContact O-OD1 2.99Å
97	C	93.8	Very high	85.7	Confident	16 Å²	16	76.7 Å²	76.7	11%	0.108	42%	0.419	C	S	.	.			trans	-78.2	114.4	-179.2	-49.2	0	0	0	0	111.7	A95 C103 C112	A95-C97 VanDerWaalsContact C-N 3.29Å; A95-C97 PolarHBondContact O-N 2.9Å; C97-C103 HydrophobicContact CB-CB 4.47Å; C97-C103 WeakPolarHBondContact SG-CA 3.41Å; C97-C103 WeakPolarHBondContact SG-CB 3.24Å; C97-C112 WeakPolarHBondContact CA-SG 3.33Å; C97-C112 HydrophobicContact CB-CB 3.76Å; C97-C112 WeakPolarHBondContact CB-SG 3.39Å; C97-C112 WeakPolarHBondContact SG-CA 3.11Å; C97-C112 WeakPolarHBondContact SG-CB 3.39Å; C97-C112 CovalentContact SG-SG 2.02Å; C97-C112 PolarHBondContact SG-SG 3.44Å
98	Q	93.1	Very high	85.7	Confident	101 Å²	101	82.2 Å²	82.2	47%	0.472	44%	0.439	S	S	.	.			trans	-79.7	175.3	176.6	-55.8	-175.8	26.2	0	0	111.3	P96 R100 G101 N122	P96-Q98 PolarHBondContact O-N 3.08Å; Q98-R100 PolarHBondContact O-N 3.04Å; Q98-G101 PolarHBondContact O-N 2.8Å; Q98-N122 WeakPolarHBondContact CB-O 3.42Å; Q98-N122 PolarHBondContact N-O 3.11Å
99	N	91.1	Very high	86.1	Confident	67 Å²	67	82.9 Å²	82.9	36%	0.358	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.5	36.6	171.2	-63.7	-43.7	0	0	0	115.2	G101 F118 C123	N99-G101 PolarHBondContact O-N 2.69Å; N99-F118 HydrophobicContact CB-CB 4.5Å; N99-F118 HydrophobicContact CB-CD1 3.67Å; N99-F118 HydrophobicContact CB-CD2 3.73Å; N99-F118 HydrophobicContact CB-CE1 3.7Å; N99-F118 HydrophobicContact CB-CE2 3.75Å; N99-F118 HydrophobicContact CB-CG 3.7Å; N99-F118 HydrophobicContact CB-CZ 3.75Å; N99-F118 WeakPolarHBondContact ND2-CD1 3.35Å; N99-F118 WeakPolarHBondContact ND2-CE1 3.48Å; N99-C123 PolarHBondContact ND2-O 2.79Å
100	R	91.6	Very high	86.8	Confident	225 Å²	225	81.3 Å²	81.3	85%	0.849	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.9	25.9	-178.5	-50.5	179.3	179	-175.8	-0.2	113.9	Q98 L115	Q98-R100 PolarHBondContact O-N 3.04Å; R100-L115 HydrophobicContact CB-CD1 4.06Å
101	G	90.8	Very high	87.3	Confident	14 Å²	14	80 Å²	80	14%	0.144	43%	0.426	C	S	.	.	P	Polyproline II helix	trans	-64.1	148.4	168.6	0	0	0	0	0	112	Q98 N99 L113	Q98-G101 PolarHBondContact O-N 2.8Å; N99-G101 PolarHBondContact O-N 2.69Å; G101-L113 CarbonylContact C-O 3.49Å; G101-L113 VanDerWaalsContact CA-O 3.27Å; G101-L113 WeakPolarHBondContact CA-O 3.4Å
102	T	94.3	Very high	87.9	Confident	86 Å²	86	75.2 Å²	75.2	53%	0.528	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	123.4	177.8	-57	0	0	0	0	109.9	L113	T102-L113 PolarHBondContact N-O 3Å; T102-L113 PolarHBondContact O-N 3.01Å
103	C	93	Very high	88.1	Confident	38 Å²	38	78.7 Å²	78.7	26%	0.257	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	132.6	178	-168	0	0	0	0	111.5	C92 C97	C92-C103 WeakPolarHBondContact CA-SG 3.18Å; C92-C103 HydrophobicContact CB-CB 3.73Å; C92-C103 WeakPolarHBondContact CB-SG 3.17Å; C92-C103 WeakPolarHBondContact SG-CB 3.39Å; C92-C103 CovalentContact SG-SG 2.04Å; C92-C103 PolarHBondContact SG-SG 2.98Å; C97-C103 HydrophobicContact CB-CB 4.47Å; C97-C103 WeakPolarHBondContact SG-CA 3.41Å; C97-C103 WeakPolarHBondContact SG-CB 3.24Å
104	I	90.1	Very high	88.5	Confident	73 Å²	73	75.2 Å²	75.2	37%	0.374	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	122.5	174.1	-57.4	178.3	0	0	0	107.9	C92 Y110 T111 L113	C92-I104 VanDerWaalsContact SG-C 3.54Å; I104-Y110 CarbonylContact O-C 3.54Å; I104-Y110 VanDerWaalsContact O-CA 3.31Å; I104-Y110 WeakPolarHBondContact O-CA 3.32Å; I104-T111 PolarHBondContact N-O 3.07Å; I104-T111 PolarHBondContact O-N 3.06Å; I104-L113 HydrophobicContact CD1-CD1 3.5Å; I104-L113 VanDerWaalsContact CD1-CD1 3.5Å; I104-L113 HydrophobicContact CD1-CD2 4.46Å; I104-L113 HydrophobicContact CD1-CG 3.77Å; I104-L113 HydrophobicContact CG1-CD1 4.47Å
105	N	84.8	Confident	88.6	Confident	52 Å²	52	74.2 Å²	74.2	28%	0.278	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	132.9	176.1	-167.5	54.8	0	0	0	110.1	P89 R91 C92	P89-N105 PolarHBondContact O-ND2 2.88Å; P89-N105 PolarHBondContact O-OD1 2.91Å; R91-N105 PolarHBondContact N-OD1 2.89Å; C92-N105 PolarHBondContact SG-N 2.88Å
106	N	79.6	Confident	88.2	Confident	65 Å²	65	75.8 Å²	75.8	35%	0.348	40%	0.398	S	S	.	.			trans	-118.5	171.1	178.6	-57.5	-26.8	0	0	0	110.3	E108 S109 T111	N106-E108 VanDerWaalsContact C-N 3.27Å; N106-E108 PolarHBondContact O-N 3.3Å; N106-S109 CarbonylContact C-O 3.42Å; N106-S109 WeakPolarHBondContact CA-O 3.28Å; N106-S109 WeakPolarHBondContact CB-O 3.08Å; N106-S109 PolarHBondContact N-O 2.89Å; N106-S109 VanDerWaalsContact O-O 3.09Å; N106-T111 PolarHBondContact ND2-OG1 2.91Å
107	E	74.7	Confident	87.7	Confident	157 Å²	157	79 Å²	79	73%	0.734	41%	0.411	S	S	*	.	S	Bend	trans	-57.5	-35.1	-176.1	-61.2	-175.5	168.7	0	0	113.8	I88	I88-E107 HydrophobicContact CD1-CB 4.35Å; I88-E107 HydrophobicContact CD1-CG 4Å
108	E	73.7	Confident	87.4	Confident	172 Å²	172	79.9 Å²	79.9	80%	0.804	41%	0.413	S	S	*	.	S	Bend	trans	-115.5	-18.7	-178.3	-63.6	-173.6	166.2	0	0	114.2	R91 N106	R91-E108 PolarHBondContact NE-O 2.75Å; R91-E108 PolarHBondContact NH2-O 2.84Å; N106-E108 VanDerWaalsContact C-N 3.27Å; N106-E108 PolarHBondContact O-N 3.3Å
109	S	82.1	Confident	87	Confident	57 Å²	57	80 Å²	80	40%	0.399	42%	0.415	S	S	.	.	S	Bend	trans	-154	-171.1	-170.1	-167.1	0	0	0	0	112	N106	N106-S109 CarbonylContact C-O 3.42Å; N106-S109 WeakPolarHBondContact CA-O 3.28Å; N106-S109 WeakPolarHBondContact CB-O 3.08Å; N106-S109 PolarHBondContact N-O 2.89Å; N106-S109 VanDerWaalsContact O-O 3.09Å
110	Y	87.9	Confident	86.6	Confident	49 Å²	49	78.4 Å²	78.4	19%	0.192	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	164.7	165.1	64.8	-85.7	0	0	0	110.4	R91 P96 I104 N122	R91-Y110 HydrophobicContact CB-CD1 4.11Å; P96-Y110 HydrophobicContact CB-CD2 4.08Å; P96-Y110 HydrophobicContact CB-CE1 4.19Å; P96-Y110 HydrophobicContact CB-CE2 3.61Å; P96-Y110 HydrophobicContact CG-CD1 4.23Å; P96-Y110 HydrophobicContact CG-CD2 3.59Å; P96-Y110 HydrophobicContact CG-CE1 4.3Å; P96-Y110 HydrophobicContact CG-CE2 3.68Å; P96-Y110 HydrophobicContact CG-CG 3.89Å; I104-Y110 CarbonylContact O-C 3.54Å; I104-Y110 VanDerWaalsContact O-CA 3.31Å; I104-Y110 WeakPolarHBondContact O-CA 3.32Å; Y110-N122 WeakPolarHBondContact CE2-OD1 3.49Å; Y110-N122 PolarHBondContact OH-OD1 3.42Å
111	T	90.6	Very high	86.4	Confident	60 Å²	60	73.5 Å²	73.5	37%	0.368	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	134.2	171.2	-63.6	0	0	0	0	109.4	I104 N106	I104-T111 PolarHBondContact N-O 3.07Å; I104-T111 PolarHBondContact O-N 3.06Å; N106-T111 PolarHBondContact ND2-OG1 2.91Å
112	C	93.8	Very high	86.5	Confident	17 Å²	17	74.5 Å²	74.5	12%	0.115	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	124.1	174.4	-64.9	0	0	0	0	110.6	C97 L121 C123	C97-C112 WeakPolarHBondContact CA-SG 3.33Å; C97-C112 HydrophobicContact CB-CB 3.76Å; C97-C112 WeakPolarHBondContact CB-SG 3.39Å; C97-C112 WeakPolarHBondContact SG-CA 3.11Å; C97-C112 WeakPolarHBondContact SG-CB 3.39Å; C97-C112 CovalentContact SG-SG 2.02Å; C97-C112 PolarHBondContact SG-SG 3.44Å; C112-L121 WeakPolarHBondContact CB-O 3.42Å; C112-L121 PolarHBondContact SG-O 2.6Å; C112-C123 VanDerWaalsContact CB-SG 3.6Å
113	L	93.1	Very high	86.4	Confident	99 Å²	99	70.5 Å²	70.5	52%	0.518	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	105.3	165.2	-62.2	-177.8	0	0	0	108.6	G101 T102 I104	G101-L113 CarbonylContact C-O 3.49Å; G101-L113 VanDerWaalsContact CA-O 3.27Å; G101-L113 WeakPolarHBondContact CA-O 3.4Å; T102-L113 PolarHBondContact N-O 3Å; T102-L113 PolarHBondContact O-N 3.01Å; I104-L113 HydrophobicContact CD1-CD1 3.5Å; I104-L113 VanDerWaalsContact CD1-CD1 3.5Å; I104-L113 HydrophobicContact CD1-CD2 4.46Å; I104-L113 HydrophobicContact CD1-CG 3.77Å; I104-L113 HydrophobicContact CG1-CD1 4.47Å
114	C	92.3	Very high	86.3	Confident	43 Å²	43	71.6 Å²	71.6	29%	0.291	38%	0.383	S	S	.	.			trans	-79.1	151.5	-178.7	-52	0	0	0	0	111.9	F118 C123	C114-F118 HydrophobicContact CB-CB 4.27Å; C114-F118 WeakPolarHBondContact CB-O 3.09Å; C114-C123 WeakPolarHBondContact CA-SG 3.25Å; C114-C123 HydrophobicContact CB-CB 3.74Å; C114-C123 WeakPolarHBondContact CB-SG 3.38Å; C114-C123 WeakPolarHBondContact SG-CA 3.34Å; C114-C123 WeakPolarHBondContact SG-CB 3.27Å; C114-C123 CovalentContact SG-SG 2.04Å; C114-C123 PolarHBondContact SG-SG 3.12Å
115	L	90	Very high	85.9	Confident	69 Å²	69	73.8 Å²	73.8	36%	0.361	39%	0.39	S	S	.	.			trans	-66.8	156.5	167	-68.1	173.3	0	0	0	109.9	R100 Q117 F118	R100-L115 HydrophobicContact CB-CD1 4.06Å; L115-Q117 PolarHBondContact O-N 2.97Å; L115-F118 HydrophobicContact CB-CD2 4.19Å; L115-F118 PolarHBondContact O-N 3.1Å
116	P	79	Confident	85.7	Confident	112 Å²	112	78.1 Å²	78.1	73%	0.727	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-17.8	-171.3	-28	35.8	0	0	0	116.7	Q127	P116-Q127 PolarHBondContact O-OE1 3.11Å; P116-Q127 VanDerWaalsContact O-OE1 3.05Å
117	Q	81.6	Confident	85.1	Confident	87 Å²	87	79 Å²	79	41%	0.407	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	11.3	178.4	72.6	-81.6	20.5	0	0	113.7	L115 E126 Q127	L115-Q117 PolarHBondContact O-N 2.97Å; Q117-E126 CarbonylContact O-C 3.58Å; Q117-E126 WeakPolarHBondContact O-CA 3.37Å; Q117-Q127 PolarHBondContact O-N 3.01Å
118	F	87.6	Confident	84.5	Confident	34 Å²	34	77.4 Å²	77.4	15%	0.149	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	148.8	178.9	-62.3	-78.6	0	0	0	112.2	N99 C114 L115 C123 F125 E126	N99-F118 HydrophobicContact CB-CB 4.5Å; N99-F118 HydrophobicContact CB-CD1 3.67Å; N99-F118 HydrophobicContact CB-CD2 3.73Å; N99-F118 HydrophobicContact CB-CE1 3.7Å; N99-F118 HydrophobicContact CB-CE2 3.75Å; N99-F118 HydrophobicContact CB-CG 3.7Å; N99-F118 HydrophobicContact CB-CZ 3.75Å; N99-F118 WeakPolarHBondContact ND2-CD1 3.35Å; N99-F118 WeakPolarHBondContact ND2-CE1 3.48Å; C114-F118 HydrophobicContact CB-CB 4.27Å; C114-F118 WeakPolarHBondContact CB-O 3.09Å; L115-F118 HydrophobicContact CB-CD2 4.19Å; L115-F118 PolarHBondContact O-N 3.1Å; F118-C123 HydrophobicContact CB-CB 4.24Å; F118-F125 CarbonylContact C-O 3.54Å; F118-F125 WeakPolarHBondContact CA-O 3.19Å; F118-E126 HydrophobicContact CD1-CB 4.24Å; F118-E126 HydrophobicContact CD1-CG 4.48Å; F118-E126 HydrophobicContact CE1-CB 4.17Å; F118-E126 HydrophobicContact CE1-CG 4.18Å
119	M	84.6	Confident	83.6	Confident	104 Å²	104	73.4 Å²	73.4	51%	0.512	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	176	179.4	69.6	177.9	-66.5	0	0	111.5	C123 E124 F125 Q127	M119-C123 CarbonylContact O-C 3.09Å; M119-C123 WeakPolarHBondContact O-CA 3.39Å; M119-E124 PolarHBondContact O-N 3Å; M119-F125 HydrophobicContact CG-CB 3.88Å; M119-F125 PolarHBondContact N-O 3.02Å; M119-F125 WeakPolarHBondContact O-CB 3.12Å; M119-F125 PolarHBondContact O-N 2.78Å; M119-Q127 HydrophobicContact CG-CB 4.48Å; M119-Q127 HydrophobicContact SD-CG 4.47Å
120	G	83.1	Confident	82.4	Confident	33 Å²	33	78.4 Å²	78.4	34%	0.34	41%	0.408	S	S	.	.	S	Bend	trans	106.8	171.7	-174.3	0	0	0	0	0	112.1	N122 C123 E124	G120-N122 PolarHBondContact O-N 2.59Å; G120-C123 PolarHBondContact O-N 2.86Å; G120-E124 WeakPolarHBondContact CA-OE2 3.38Å
121	L	87.2	Confident	80.9	Confident	123 Å²	123	78.2 Å²	78.2	64%	0.644	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-31.6	-177.8	-176.3	67.6	0	0	0	111.4	C112 E124	C112-L121 WeakPolarHBondContact CB-O 3.42Å; C112-L121 PolarHBondContact SG-O 2.6Å; L121-E124 PolarHBondContact N-OE2 2.83Å
122	N	93.3	Very high	79.7	Confident	35 Å²	35	77.6 Å²	77.6	19%	0.187	41%	0.408	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.9	16	-177.2	-69.3	-38.6	0	0	0	112.5	P96 Q98 Y110 G120 E124	P96-N122 WeakPolarHBondContact O-CB 3.47Å; P96-N122 PolarHBondContact O-OD1 2.99Å; Q98-N122 WeakPolarHBondContact CB-O 3.42Å; Q98-N122 PolarHBondContact N-O 3.11Å; Y110-N122 WeakPolarHBondContact CE2-OD1 3.49Å; Y110-N122 PolarHBondContact OH-OD1 3.42Å; G120-N122 PolarHBondContact O-N 2.59Å; N122-E124 VanDerWaalsContact C-OE2 3.23Å; N122-E124 VanDerWaalsContact CA-OE2 3.24Å; N122-E124 WeakPolarHBondContact CA-OE2 3.35Å; N122-E124 WeakPolarHBondContact CB-OE2 3.4Å; N122-E124 PolarHBondContact N-OE2 3.49Å; N122-E124 PolarHBondContact O-N 2.84Å
123	C	92.3	Very high	79.2	Confident	1 Å²	1	78.4 Å²	78.4	1%	0.007	41%	0.414	C	S	.	.	S	Bend	trans	57.6	30.3	-172.8	-45.9	0	0	0	0	113.5	N99 C112 C114 F118 M119 G120 F125	N99-C123 PolarHBondContact ND2-O 2.79Å; C112-C123 VanDerWaalsContact CB-SG 3.6Å; C114-C123 WeakPolarHBondContact CA-SG 3.25Å; C114-C123 HydrophobicContact CB-CB 3.74Å; C114-C123 WeakPolarHBondContact CB-SG 3.38Å; C114-C123 WeakPolarHBondContact SG-CA 3.34Å; C114-C123 WeakPolarHBondContact SG-CB 3.27Å; C114-C123 CovalentContact SG-SG 2.04Å; C114-C123 PolarHBondContact SG-SG 3.12Å; F118-C123 HydrophobicContact CB-CB 4.24Å; M119-C123 CarbonylContact O-C 3.09Å; M119-C123 WeakPolarHBondContact O-CA 3.39Å; G120-C123 PolarHBondContact O-N 2.86Å; C123-F125 VanDerWaalsContact C-N 3.33Å
124	E	90.8	Very high	78.9	Confident	61 Å²	61	73.9 Å²	73.9	29%	0.285	39%	0.39	S	S	.	.			trans	-78.4	-15.6	-173.4	68.7	-85.5	-154.2	0	0	113.7	M119 G120 L121 N122	M119-E124 PolarHBondContact O-N 3Å; G120-E124 WeakPolarHBondContact CA-OE2 3.38Å; L121-E124 PolarHBondContact N-OE2 2.83Å; N122-E124 VanDerWaalsContact C-OE2 3.23Å; N122-E124 VanDerWaalsContact CA-OE2 3.24Å; N122-E124 WeakPolarHBondContact CA-OE2 3.35Å; N122-E124 WeakPolarHBondContact CB-OE2 3.4Å; N122-E124 PolarHBondContact N-OE2 3.49Å; N122-E124 PolarHBondContact O-N 2.84Å
125	F	82.3	Confident	78.6	Confident	119 Å²	119	78.2 Å²	78.2	52%	0.522	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	135.2	-177.8	-53.9	-59.4	0	0	0	110.8	F118 M119 C123 Q127	F118-F125 CarbonylContact C-O 3.54Å; F118-F125 WeakPolarHBondContact CA-O 3.19Å; M119-F125 HydrophobicContact CG-CB 3.88Å; M119-F125 PolarHBondContact N-O 3.02Å; M119-F125 WeakPolarHBondContact O-CB 3.12Å; M119-F125 PolarHBondContact O-N 2.78Å; C123-F125 VanDerWaalsContact C-N 3.33Å; F125-Q127 PolarHBondContact O-N 3.32Å
126	E	80.5	Confident	78.3	Confident	144 Å²	144	79.2 Å²	79.2	67%	0.673	42%	0.415	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.6	124.2	167.5	-164.1	167.6	-156.4	0	0	108.4	Q117 F118 Q128	Q117-E126 CarbonylContact O-C 3.58Å; Q117-E126 WeakPolarHBondContact O-CA 3.37Å; F118-E126 HydrophobicContact CD1-CB 4.24Å; F118-E126 HydrophobicContact CD1-CG 4.48Å; F118-E126 HydrophobicContact CE1-CB 4.17Å; F118-E126 HydrophobicContact CE1-CG 4.18Å; E126-Q128 PolarHBondContact O-N 3.15Å
127	Q	67.6	Low	78.6	Confident	82 Å²	82	81.5 Å²	81.5	38%	0.383	42%	0.416	S	S	.	.			trans	-69.1	99.7	176.6	-172.3	168.6	-1	0	0	107.3	P116 Q117 M119 F125 T129	P116-Q127 PolarHBondContact O-OE1 3.11Å; P116-Q127 VanDerWaalsContact O-OE1 3.05Å; Q117-Q127 PolarHBondContact O-N 3.01Å; M119-Q127 HydrophobicContact CG-CB 4.48Å; M119-Q127 HydrophobicContact SD-CG 4.47Å; F125-Q127 PolarHBondContact O-N 3.32Å; Q127-T129 PolarHBondContact O-N 3.25Å
128	Q	60.9	Low	79.1	Confident	124 Å²	124	77.4 Å²	77.4	58%	0.579	40%	0.397	S	S	*	.			trans	-56.9	125.1	167.9	-71.9	179.3	5.5	0	0	107.2	E126 E130	E126-Q128 PolarHBondContact O-N 3.15Å; Q128-E130 PolarHBondContact O-N 3.26Å
129	T	56.1	Low	79.1	Confident	88 Å²	88	75.8 Å²	75.8	54%	0.54	39%	0.39	S	S	.	.			trans	-52	133.5	174.8	40.9	0	0	0	0	108.7	Q127 S131 D132	Q127-T129 PolarHBondContact O-N 3.25Å; T129-S131 PolarHBondContact O-N 3.12Å; T129-S131 PolarHBondContact OG1-OG 3.08Å; T129-D132 PolarHBondContact O-N 2.04Å; T129-D132 VanDerWaalsContact O-N 3.08Å
130	E	55.4	Low	79.4	Confident	162 Å²	162	71.9 Å²	71.9	76%	0.757	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-53.4	-9	-176.1	-64.8	-174.3	159.6	0	0	114.5	Q128 D132 L136	Q128-E130 PolarHBondContact O-N 3.26Å; E130-D132 VanDerWaalsContact C-N 3.32Å; E130-D132 PolarHBondContact O-N 3.05Å; E130-L136 HydrophobicContact CB-CD2 4.37Å; E130-L136 VanDerWaalsContact O-CD2 3.31Å; E130-L136 WeakPolarHBondContact O-CD2 3.25Å
131	S	56.4	Low	79.9	Confident	46 Å²	46	70.3 Å²	70.3	32%	0.322	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-78.4	5.3	173.1	58.3	0	0	0	0	116.5	T129 R169	T129-S131 PolarHBondContact O-N 3.12Å; T129-S131 PolarHBondContact OG1-OG 3.08Å; S131-R169 PolarHBondContact O-NH1 3.41Å; S131-R169 VanDerWaalsContact O-NH1 3.12Å
132	D	66.2	Low	80.3	Confident	47 Å²	47	65.6 Å²	65.6	25%	0.251	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-96.4	10.1	-176.7	-67.7	-20.1	0	0	0	113.9	T129 E130 L154 R169	T129-D132 PolarHBondContact O-N 2.04Å; T129-D132 VanDerWaalsContact O-N 3.08Å; E130-D132 VanDerWaalsContact C-N 3.32Å; E130-D132 PolarHBondContact O-N 3.05Å; D132-L154 WeakPolarHBondContact O-CD1 3.39Å; D132-R169 IonicContact OD1-CZ 3.17Å; D132-R169 IonicContact OD1-NH2 2.63Å; D132-R169 PolarHBondContact OD1-NH2 3.3Å
133	S	82.3	Confident	80.5	Confident	34 Å²	34	64 Å²	64	24%	0.238	33%	0.327	C	S	.	.	S	Bend	trans	-107.9	136.5	167.7	-179.6	0	0	0	0	112.2	L135 L136 G139 E147	S133-L135 PolarHBondContact O-N 2.78Å; S133-L135 VanDerWaalsContact O-N 3.14Å; S133-L135 WeakPolarHBondContact OG-CB 3.21Å; S133-L135 PolarHBondContact OG-N 2.99Å; S133-L135 VanDerWaalsContact OG-N 3.09Å; S133-L136 PolarHBondContact O-N 2.93Å; S133-L136 VanDerWaalsContact O-N 3.11Å; S133-G139 VanDerWaalsContact O-CA 3.27Å; S133-G139 WeakPolarHBondContact O-CA 3.39Å; S133-G139 PolarHBondContact O-N 3.22Å; S133-E147 WeakPolarHBondContact CA-OE1 3.48Å; S133-E147 WeakPolarHBondContact CB-OE1 3.11Å; S133-E147 PolarHBondContact OG-OE1 2.78Å
134	C	87.8	Confident	80.7	Confident	3 Å²	3	64.9 Å²	64.9	2%	0.02	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-19.2	168.8	-62.8	0	0	0	0	113	L136 N138 C145 E147 R314	C134-L136 VanDerWaalsContact C-N 3.3Å; C134-N138 WeakPolarHBondContact O-CA 3.2Å; C134-C145 WeakPolarHBondContact CA-SG 3.34Å; C134-C145 HydrophobicContact CB-CB 3.76Å; C134-C145 WeakPolarHBondContact CB-SG 3.14Å; C134-C145 WeakPolarHBondContact SG-CB 3.49Å; C134-C145 PolarHBondContact SG-O 2.87Å; C134-C145 VanDerWaalsContact SG-O 3.4Å; C134-C145 CovalentContact SG-SG 2.02Å; C134-C145 PolarHBondContact SG-SG 2.94Å; C134-E147 HydrophobicContact CB-CG 4.24Å; C134-E147 PolarHBondContact N-OE1 2.79Å; C134-R314 PolarHBondContact O-NE 2.75Å; C134-R314 PolarHBondContact O-NH1 3.02Å; C134-R314 PolarHBondContact O-NH2 3.15Å
135	L	84.8	Confident	80.8	Confident	135 Å²	135	62.1 Å²	62.1	71%	0.707	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-27.2	176.1	-63.1	179.2	0	0	0	112.9	S133	S133-L135 PolarHBondContact O-N 2.78Å; S133-L135 VanDerWaalsContact O-N 3.14Å; S133-L135 WeakPolarHBondContact OG-CB 3.21Å; S133-L135 PolarHBondContact OG-N 2.99Å; S133-L135 VanDerWaalsContact OG-N 3.09Å
136	L	83.9	Confident	81.2	Confident	89 Å²	89	60 Å²	60	47%	0.466	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.7	118.5	-179.8	-169	68.7	0	0	0	109.6	E130 S133 C134 N138 G139	E130-L136 HydrophobicContact CB-CD2 4.37Å; E130-L136 VanDerWaalsContact O-CD2 3.31Å; E130-L136 WeakPolarHBondContact O-CD2 3.25Å; S133-L136 PolarHBondContact O-N 2.93Å; S133-L136 VanDerWaalsContact O-N 3.11Å; C134-L136 VanDerWaalsContact C-N 3.3Å; L136-N138 PolarHBondContact O-N 3.4Å; L136-G139 PolarHBondContact O-N 3.04Å
137	E	86.2	Confident	81.5	Confident	161 Å²	161	56.8 Å²	56.8	75%	0.752	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	50.7	33.8	178.3	-58.3	-169.4	162.9	0	0	114.4	G139 G140	E137-G139 PolarHBondContact O-N 3.29Å; E137-G140 PolarHBondContact O-N 3.45Å
138	N	91.4	Very high	81.8	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	53.7	32.8	-175	-170.4	49.2	0	0	0	112.4	C134 L136 G140 C141 H143 C145 R314 D315 F390	C134-N138 WeakPolarHBondContact O-CA 3.2Å; L136-N138 PolarHBondContact O-N 3.4Å; N138-G140 PolarHBondContact O-N 2.9Å; N138-G140 VanDerWaalsContact O-N 3.15Å; N138-C141 PolarHBondContact ND2-O 2.84Å; N138-C141 WeakPolarHBondContact O-CB 3.25Å; N138-C141 PolarHBondContact O-N 2.96Å; N138-H143 PolarHBondContact ND2-O 3.34Å; N138-C145 VanDerWaalsContact O-CB 3.27Å; N138-C145 WeakPolarHBondContact O-CB 3.43Å; N138-C145 PolarHBondContact O-SG 3.11Å; N138-C145 VanDerWaalsContact O-SG 3.37Å; N138-C145 VanDerWaalsContact OD1-CB 3.25Å; N138-C145 WeakPolarHBondContact OD1-CB 3.5Å; N138-R314 PolarHBondContact OD1-NH2 3.24Å; N138-D315 PolarHBondContact OD1-OD2 2.82Å; N138-F390 HydrophobicContact CB-CZ 4.02Å
139	G	88.4	Confident	81.9	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	62.6	23.5	-179.2	0	0	0	0	0	113.4	S133 L136 E137 C141 R169	S133-G139 VanDerWaalsContact O-CA 3.27Å; S133-G139 WeakPolarHBondContact O-CA 3.39Å; S133-G139 PolarHBondContact O-N 3.22Å; L136-G139 PolarHBondContact O-N 3.04Å; E137-G139 PolarHBondContact O-N 3.29Å; G139-C141 PolarHBondContact O-N 3.05Å; G139-C141 VanDerWaalsContact O-N 3.13Å; G139-R169 PolarHBondContact O-NH1 3.28Å
140	G	90.3	Very high	82.1	Confident	22 Å²	22	57.6 Å²	57.6	23%	0.227	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	70.9	-5.3	-171.7	0	0	0	0	0	115	E137 N138 K391	E137-G140 PolarHBondContact O-N 3.45Å; N138-G140 PolarHBondContact O-N 2.9Å; N138-G140 VanDerWaalsContact O-N 3.15Å; G140-K391 PolarHBondContact O-NZ 3.24Å
141	C	93.9	Very high	82.4	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	30%	0.296	C	S	.	.			trans	-64.7	139.1	-178.9	-55.7	0	0	0	0	111.9	N138 G139 F144 C145 C156 K391	N138-C141 PolarHBondContact ND2-O 2.84Å; N138-C141 WeakPolarHBondContact O-CB 3.25Å; N138-C141 PolarHBondContact O-N 2.96Å; G139-C141 PolarHBondContact O-N 3.05Å; G139-C141 VanDerWaalsContact O-N 3.13Å; C141-F144 WeakPolarHBondContact CB-O 3.41Å; C141-C145 HydrophobicContact CB-CB 3.99Å; C141-C145 WeakPolarHBondContact SG-CB 3.1Å; C141-C156 WeakPolarHBondContact CA-SG 3.45Å; C141-C156 HydrophobicContact CB-CB 3.68Å; C141-C156 WeakPolarHBondContact CB-SG 3.46Å; C141-C156 WeakPolarHBondContact SG-CA 3.39Å; C141-C156 WeakPolarHBondContact SG-CB 3.11Å; C141-C156 CovalentContact SG-SG 2.02Å; C141-C156 PolarHBondContact SG-SG 3.4Å; C141-K391 VanDerWaalsContact C-NZ 3.25Å; C141-K391 WeakPolarHBondContact O-CE 3.03Å; C141-K391 PolarHBondContact O-NZ 3.32Å
142	D	95.5	Very high	82.6	Confident	24 Å²	24	57.1 Å²	57.1	13%	0.128	31%	0.309	C	S	.	.	S	Bend	trans	-68.6	-35.3	178.9	-93.8	4.8	0	0	0	113.8	R169 S170 C171 K391	D142-R169 PolarHBondContact N-O 3.2Å; D142-S170 WeakPolarHBondContact OD2-CA 3.28Å; D142-C171 HydrophobicContact CB-CB 3.92Å; D142-C171 PolarHBondContact OD2-N 3.42Å; D142-C171 VanDerWaalsContact OD2-N 3.15Å; D142-K391 HydrophobicContact CB-CD 4.33Å; D142-K391 WeakPolarHBondContact OD1-CD 3.15Å; D142-K391 WeakPolarHBondContact OD1-CE 3.22Å; D142-K391 IonicContact OD1-NZ 3.31Å; D142-K391 PolarHBondContact OD1-NZ 2.86Å
143	H	96.9	Very high	82.9	Confident	3 Å²	3	64.3 Å²	64.3	1%	0.014	33%	0.333	C	S	.	.	S	Bend	trans	-122	-85.5	179.4	-64.2	156	0	0	0	111.1	N138 S157 A159 Y162 C171 L311 T393 F395	N138-H143 PolarHBondContact ND2-O 3.34Å; H143-S157 WeakPolarHBondContact CB-O 3.43Å; H143-A159 PolarHBondContact ND1-N 2.87Å; H143-Y162 AromaticContact CE1-CD1 3.56Å; H143-Y162 AromaticContact CE1-CD2 3.71Å; H143-Y162 AromaticContact CE1-CE1 3.71Å; H143-Y162 AromaticContact CE1-CE2 3.9Å; H143-Y162 AromaticContact CE1-CG 3.55Å; H143-Y162 AromaticContact CE1-CZ 3.89Å; H143-C171 VanDerWaalsContact CE1-CB 3.46Å; H143-C171 WeakPolarHBondContact CE1-CB 3.46Å; H143-C171 WeakPolarHBondContact ND1-CB 3.41Å; H143-C171 PolarHBondContact ND1-SG 2.78Å; H143-L311 WeakPolarHBondContact O-CD1 3.48Å; H143-T393 VanDerWaalsContact NE2-CB 3.34Å; H143-T393 WeakPolarHBondContact NE2-CB 3.37Å; H143-T393 PolarHBondContact NE2-OG1 3.19Å; H143-F395 HydrophobicContact CB-CZ 4.31Å; H143-F395 AromaticContact CD2-CZ 3.59Å
144	F	96.9	Very high	83	Confident	19 Å²	19	64.9 Å²	64.9	8%	0.083	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	141.6	-171	-44.3	-44.2	0	0	0	110.3	C141 C156 S157 C158 A159 T308 L311 F395	C141-F144 WeakPolarHBondContact CB-O 3.41Å; F144-C156 CarbonylContact O-C 3.49Å; F144-C156 VanDerWaalsContact O-CA 3.26Å; F144-C156 WeakPolarHBondContact O-CA 3.38Å; F144-S157 WeakPolarHBondContact CB-O 3.43Å; F144-S157 WeakPolarHBondContact CB-OG 3.31Å; F144-S157 PolarHBondContact N-O 3.08Å; F144-S157 PolarHBondContact O-N 2.82Å; F144-C158 VanDerWaalsContact CE2-C 3.43Å; F144-C158 WeakPolarHBondContact CE2-O 3.06Å; F144-A159 HydrophobicContact CE2-CB 4.09Å; F144-A159 HydrophobicContact CZ-CB 3.7Å; F144-T308 HydrophobicContact CB-CG2 4.12Å; F144-T308 HydrophobicContact CD1-CG2 3.65Å; F144-T308 HydrophobicContact CD2-CG2 3.98Å; F144-T308 HydrophobicContact CE1-CG2 4.04Å; F144-T308 HydrophobicContact CE2-CG2 4.3Å; F144-T308 HydrophobicContact CG-CG2 3.64Å; F144-T308 HydrophobicContact CZ-CG2 4.33Å; F144-L311 HydrophobicContact CD1-CB 4.41Å; F144-L311 HydrophobicContact CD1-CD2 3.67Å; F144-L311 HydrophobicContact CE1-CD2 3.68Å; F144-F395 AromaticContact CE1-CE1 3.8Å; F144-F395 HydrophobicContact CE1-CE1 3.8Å; F144-F395 HydrophobicContact CE1-CZ 4.33Å; F144-F395 HydrophobicContact CZ-CE1 4.17Å
145	C	93.9	Very high	83.1	Confident	3 Å²	3	67.5 Å²	67.5	2%	0.02	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	121.4	177	-172.2	0	0	0	0	108.3	C134 N138 C141	C134-C145 WeakPolarHBondContact CA-SG 3.34Å; C134-C145 HydrophobicContact CB-CB 3.76Å; C134-C145 WeakPolarHBondContact CB-SG 3.14Å; C134-C145 WeakPolarHBondContact SG-CB 3.49Å; C134-C145 PolarHBondContact SG-O 2.87Å; C134-C145 VanDerWaalsContact SG-O 3.4Å; C134-C145 CovalentContact SG-SG 2.02Å; C134-C145 PolarHBondContact SG-SG 2.94Å; N138-C145 VanDerWaalsContact O-CB 3.27Å; N138-C145 WeakPolarHBondContact O-CB 3.43Å; N138-C145 PolarHBondContact O-SG 3.11Å; N138-C145 VanDerWaalsContact O-SG 3.37Å; N138-C145 VanDerWaalsContact OD1-CB 3.25Å; N138-C145 WeakPolarHBondContact OD1-CB 3.5Å; C141-C145 HydrophobicContact CB-CB 3.99Å; C141-C145 WeakPolarHBondContact SG-CB 3.1Å
146	D	90.4	Very high	83.6	Confident	75 Å²	75	61.7 Å²	61.7	40%	0.401	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	135.7	175.3	-64	-59.5	0	0	0	109.4	A155	D146-A155 PolarHBondContact N-O 2.8Å; D146-A155 PolarHBondContact O-N 3.35Å
147	E	85.7	Confident	84.2	Confident	75 Å²	75	59.6 Å²	59.6	35%	0.35	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	143.9	171.7	-80.8	167.8	-172.3	0	0	109.5	S133 C134 R153	S133-E147 WeakPolarHBondContact CA-OE1 3.48Å; S133-E147 WeakPolarHBondContact CB-OE1 3.11Å; S133-E147 PolarHBondContact OG-OE1 2.78Å; C134-E147 HydrophobicContact CB-CG 4.24Å; C134-E147 PolarHBondContact N-OE1 2.79Å; E147-R153 WeakPolarHBondContact CA-O 3.46Å
148	D	75	Confident	84.7	Confident	56 Å²	56	53.2 Å²	53.2	30%	0.299	29%	0.291	S	S	.	.			trans	-62.2	162	166.5	75.4	18.1	0	0	0	111.5	F150 G151 R152 R153	D148-F150 PolarHBondContact O-N 2.83Å; D148-F150 PolarHBondContact OD1-N 2.87Å; D148-F150 VanDerWaalsContact OD1-N 3.1Å; D148-G151 PolarHBondContact O-N 2.8Å; D148-G151 PolarHBondContact OD1-N 2.82Å; D148-R152 PolarHBondContact OD1-N 3.34Å; D148-R153 HydrophobicContact CB-CB 4.45Å; D148-R153 PolarHBondContact N-O 3.47Å; D148-R153 WeakPolarHBondContact OD2-CB 3.49Å; D148-R153 PolarHBondContact OD2-N 2.86Å
149	A	62.9	Low	84.9	Confident	103 Å²	103	53.5 Å²	53.5	85%	0.851	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-9.6	-175.5	0	0	0	0	0	114.7
150	F	60.2	Low	85.1	Confident	153 Å²	153	58.7 Å²	58.7	67%	0.671	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.7	2.6	179.5	-57.3	-80.4	0	0	0	112.7	D148 R152	D148-F150 PolarHBondContact O-N 2.83Å; D148-F150 PolarHBondContact OD1-N 2.87Å; D148-F150 VanDerWaalsContact OD1-N 3.1Å; F150-R152 HydrophobicContact CB-CG 4.09Å; F150-R152 PolarHBondContact O-N 2.77Å
151	G	60.8	Low	85.1	Confident	40 Å²	40	59 Å²	59	41%	0.412	32%	0.324	S	S	.	.	S	Bend	trans	63.7	22	-177.1	0	0	0	0	0	113.7	D148	D148-G151 PolarHBondContact O-N 2.8Å; D148-G151 PolarHBondContact OD1-N 2.82Å
152	R	62.4	Low	85.2	Confident	158 Å²	158	60 Å²	60	60%	0.596	33%	0.328	S	S	*	.			trans	-99.7	-18.5	-172.1	-73.1	-175.5	-72.2	-179	-7.3	113.7	D148 F150	D148-R152 PolarHBondContact OD1-N 3.34Å; F150-R152 HydrophobicContact CB-CG 4.09Å; F150-R152 PolarHBondContact O-N 2.77Å
153	R	70.6	Confident	85.2	Confident	198 Å²	198	63 Å²	63	75%	0.747	34%	0.342	S	S	*	.			trans	-136.8	121	177.5	-65	-178.5	178.7	179.7	-0.3	109.8	E147 D148	E147-R153 WeakPolarHBondContact CA-O 3.46Å; D148-R153 HydrophobicContact CB-CB 4.45Å; D148-R153 PolarHBondContact N-O 3.47Å; D148-R153 WeakPolarHBondContact OD2-CB 3.49Å; D148-R153 PolarHBondContact OD2-N 2.86Å
154	L	85.9	Confident	85.1	Confident	46 Å²	46	66.4 Å²	66.4	24%	0.241	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	134.1	171	175	159.7	0	0	0	109.1	D132	D132-L154 WeakPolarHBondContact O-CD1 3.39Å
155	A	90.2	Very high	85	Confident	57 Å²	57	68.7 Å²	68.7	47%	0.471	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	123.1	173.4	0	0	0	0	0	109.7	D146	D146-A155 PolarHBondContact N-O 2.8Å; D146-A155 PolarHBondContact O-N 3.35Å
156	C	94.2	Very high	85	Confident	14 Å²	14	73.5 Å²	73.5	10%	0.095	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	143.8	170.4	-58.4	0	0	0	0	110.6	C141 F144 L164 G168	C141-C156 WeakPolarHBondContact CA-SG 3.45Å; C141-C156 HydrophobicContact CB-CB 3.68Å; C141-C156 WeakPolarHBondContact CB-SG 3.46Å; C141-C156 WeakPolarHBondContact SG-CA 3.39Å; C141-C156 WeakPolarHBondContact SG-CB 3.11Å; C141-C156 CovalentContact SG-SG 2.02Å; C141-C156 PolarHBondContact SG-SG 3.4Å; F144-C156 CarbonylContact O-C 3.49Å; F144-C156 VanDerWaalsContact O-CA 3.26Å; F144-C156 WeakPolarHBondContact O-CA 3.38Å; C156-L164 HydrophobicContact CB-CD1 3.69Å; C156-L164 HydrophobicContact CB-CD2 4.47Å; C156-G168 VanDerWaalsContact CB-O 3.28Å; C156-G168 WeakPolarHBondContact CB-O 3.41Å; C156-G168 PolarHBondContact SG-O 3.05Å
157	S	96.1	Very high	85	Confident	45 Å²	45	74 Å²	74	32%	0.315	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	163.2	170	65.8	0	0	0	0	111.2	H143 F144	H143-S157 WeakPolarHBondContact CB-O 3.43Å; F144-S157 WeakPolarHBondContact CB-O 3.43Å; F144-S157 WeakPolarHBondContact CB-OG 3.31Å; F144-S157 PolarHBondContact N-O 3.08Å; F144-S157 PolarHBondContact O-N 2.82Å
158	C	97.2	Very high	85.2	Confident	27 Å²	27	72 Å²	72	18%	0.182	41%	0.414	C	S	.	.			trans	-119	151.7	-169.5	-60.2	0	0	0	0	112.7	F144 E163 L164 C171	F144-C158 VanDerWaalsContact CE2-C 3.43Å; F144-C158 WeakPolarHBondContact CE2-O 3.06Å; C158-E163 VanDerWaalsContact SG-C 3.55Å; C158-L164 PolarHBondContact SG-N 2.01Å; C158-C171 VanDerWaalsContact CA-SG 3.6Å; C158-C171 HydrophobicContact CB-CB 3.9Å; C158-C171 WeakPolarHBondContact CB-SG 3.43Å; C158-C171 WeakPolarHBondContact SG-CB 3.43Å; C158-C171 CovalentContact SG-SG 2.04Å; C158-C171 PolarHBondContact SG-SG 2.87Å
159	A	96.3	Very high	86	Confident	5 Å²	5	72.8 Å²	72.8	4%	0.041	41%	0.413	C	S	.	.			trans	-66.6	164	174.5	0	0	0	0	0	113.1	H143 F144 G161 Y162 C305 F395	H143-A159 PolarHBondContact ND1-N 2.87Å; F144-A159 HydrophobicContact CE2-CB 4.09Å; F144-A159 HydrophobicContact CZ-CB 3.7Å; A159-G161 PolarHBondContact O-N 2.04Å; A159-Y162 HydrophobicContact CB-CD2 4.36Å; A159-Y162 WeakPolarHBondContact O-CB 3.34Å; A159-Y162 PolarHBondContact O-N 3.32Å; A159-C305 HydrophobicContact CB-CB 4.21Å; A159-F395 HydrophobicContact CB-CE1 4.18Å
160	D	91.3	Very high	87.6	Confident	109 Å²	109	69.5 Å²	69.5	58%	0.583	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	127.7	179.4	-71.1	-11.3	0	0	0	112.4	C179	D160-C179 PolarHBondContact O-SG 2.96Å
161	G	91.6	Very high	89.3	Confident	30 Å²	30	62.9 Å²	62.9	31%	0.309	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.5	2.9	-176.5	0	0	0	0	0	114.8	A159 K174	A159-G161 PolarHBondContact O-N 2.04Å; G161-K174 PolarHBondContact O-N 2.67Å
162	Y	96.1	Very high	90.9	Very high	21 Å²	21	64.8 Å²	64.8	8%	0.082	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	158.6	174.8	-65.1	-103	0	0	0	113	H143 A159 C171 I172 T173 A178 C179 T181 T393	H143-Y162 AromaticContact CE1-CD1 3.56Å; H143-Y162 AromaticContact CE1-CD2 3.71Å; H143-Y162 AromaticContact CE1-CE1 3.71Å; H143-Y162 AromaticContact CE1-CE2 3.9Å; H143-Y162 AromaticContact CE1-CG 3.55Å; H143-Y162 AromaticContact CE1-CZ 3.89Å; A159-Y162 HydrophobicContact CB-CD2 4.36Å; A159-Y162 WeakPolarHBondContact O-CB 3.34Å; A159-Y162 PolarHBondContact O-N 3.32Å; Y162-C171 HydrophobicContact CD1-CB 4.08Å; Y162-C171 HydrophobicContact CG-CB 4.48Å; Y162-I172 CarbonylContact C-O 3.55Å; Y162-I172 WeakPolarHBondContact CA-O 3.49Å; Y162-I172 WeakPolarHBondContact CB-O 3.47Å; Y162-T173 HydrophobicContact CD1-CG2 3.78Å; Y162-T173 HydrophobicContact CE1-CG2 3.4Å; Y162-A178 HydrophobicContact CD2-CB 3.92Å; Y162-A178 HydrophobicContact CE2-CB 3.51Å; Y162-C179 WeakPolarHBondContact CE2-O 3.11Å; Y162-C179 PolarHBondContact OH-O 3.21Å; Y162-T181 WeakPolarHBondContact OH-CG2 3.48Å; Y162-T393 HydrophobicContact CE2-CG2 4.3Å; Y162-T393 PolarHBondContact OH-OG1 3.35Å
163	E	95.3	Very high	92.3	Very high	87 Å²	87	60.8 Å²	60.8	41%	0.407	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	150	168.6	-74.2	176.4	163.1	0	0	110.1	C158 C171 I172 K174	C158-E163 VanDerWaalsContact SG-C 3.55Å; E163-C171 CarbonylContact O-C 3.54Å; E163-C171 WeakPolarHBondContact O-CA 3.29Å; E163-I172 HydrophobicContact CB-CG1 4.19Å; E163-I172 PolarHBondContact N-O 2.91Å; E163-I172 WeakPolarHBondContact O-CG1 3.43Å; E163-I172 PolarHBondContact O-N 2.87Å; E163-K174 HydrophobicContact CB-CG 4.43Å; E163-K174 HydrophobicContact CG-CD 3.62Å; E163-K174 HydrophobicContact CG-CG 3.47Å; E163-K174 VanDerWaalsContact CG-CG 3.47Å; E163-K174 WeakPolarHBondContact OE1-CD 3.47Å; E163-K174 WeakPolarHBondContact OE1-CE 3.31Å; E163-K174 IonicContact OE1-NZ 2.86Å; E163-K174 PolarHBondContact OE1-NZ 2.92Å
164	L	95.3	Very high	92.7	Very high	73 Å²	73	57.9 Å²	57.9	38%	0.382	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	129	170.3	-165.5	70.3	0	0	0	108.7	C156 C158 S170	C156-L164 HydrophobicContact CB-CD1 3.69Å; C156-L164 HydrophobicContact CB-CD2 4.47Å; C158-L164 PolarHBondContact SG-N 2.01Å; L164-S170 WeakPolarHBondContact CA-O 3.21Å
165	D	94.5	Very high	92.3	Very high	67 Å²	67	57.6 Å²	57.6	36%	0.358	35%	0.347	S	S	.	.			trans	-72.3	169.7	177.3	-162	7.4	0	0	0	111	D167 G168 S170 I172	D165-D167 PolarHBondContact O-N 3.14Å; D165-D167 VanDerWaalsContact O-N 3.12Å; D165-G168 PolarHBondContact O-N 3.08Å; D165-S170 WeakPolarHBondContact CB-O 3.39Å; D165-S170 PolarHBondContact N-O 2.04Å; D165-I172 HydrophobicContact CB-CG2 4.17Å
166	A	93.2	Very high	91.7	Very high	105 Å²	105	61 Å²	61	87%	0.868	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-18.3	-178.8	0	0	0	0	0	113.8	G168	A166-G168 PolarHBondContact O-N 3.18Å
167	D	90.8	Very high	91.5	Very high	86 Å²	86	62 Å²	62	46%	0.46	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-8.5	174.3	71.8	-4.5	0	0	0	113.4	D165 R169 S170	D165-D167 PolarHBondContact O-N 3.14Å; D165-D167 VanDerWaalsContact O-N 3.12Å; D167-R169 PolarHBondContact O-N 3.11Å; D167-R169 PolarHBondContact OD1-N 3.08Å; D167-S170 WeakPolarHBondContact OD1-CB 3.49Å; D167-S170 PolarHBondContact OD1-N 3.49Å; D167-S170 WeakPolarHBondContact OD2-CB 3.47Å; D167-S170 PolarHBondContact OD2-N 2.75Å; D167-S170 PolarHBondContact OD2-OG 2.63Å
168	G	90.6	Very high	91.4	Very high	31 Å²	31	59.9 Å²	59.9	32%	0.32	35%	0.353	S	S	.	.	S	Bend	trans	70	9.7	-178.9	0	0	0	0	0	114.5	C156 D165 A166	C156-G168 VanDerWaalsContact CB-O 3.28Å; C156-G168 WeakPolarHBondContact CB-O 3.41Å; C156-G168 PolarHBondContact SG-O 3.05Å; D165-G168 PolarHBondContact O-N 3.08Å; A166-G168 PolarHBondContact O-N 3.18Å
169	R	91.4	Very high	91.4	Very high	73 Å²	73	59 Å²	59	28%	0.275	35%	0.347	S	S	.	.	S	Bend	trans	-132.1	-38.8	-177.5	-60.8	-169.7	-172.8	-128.9	4.5	113.5	S131 D132 G139 D142 D167	S131-R169 PolarHBondContact O-NH1 3.41Å; S131-R169 VanDerWaalsContact O-NH1 3.12Å; D132-R169 IonicContact OD1-CZ 3.17Å; D132-R169 IonicContact OD1-NH2 2.63Å; D132-R169 PolarHBondContact OD1-NH2 3.3Å; G139-R169 PolarHBondContact O-NH1 3.28Å; D142-R169 PolarHBondContact N-O 3.2Å; D167-R169 PolarHBondContact O-N 3.11Å; D167-R169 PolarHBondContact OD1-N 3.08Å
170	S	95.3	Very high	91.4	Very high	35 Å²	35	58.8 Å²	58.8	25%	0.245	35%	0.345	C	S	.	.			trans	-80.1	148.9	-176.3	-64.5	0	0	0	0	112	D142 L164 D165 D167	D142-S170 WeakPolarHBondContact OD2-CA 3.28Å; L164-S170 WeakPolarHBondContact CA-O 3.21Å; D165-S170 WeakPolarHBondContact CB-O 3.39Å; D165-S170 PolarHBondContact N-O 2.04Å; D167-S170 WeakPolarHBondContact OD1-CB 3.49Å; D167-S170 PolarHBondContact OD1-N 3.49Å; D167-S170 WeakPolarHBondContact OD2-CB 3.47Å; D167-S170 PolarHBondContact OD2-N 2.75Å; D167-S170 PolarHBondContact OD2-OG 2.63Å
171	C	96.3	Very high	91.6	Very high	14 Å²	14	53.8 Å²	53.8	10%	0.095	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	116.3	177.5	-69.5	0	0	0	0	111.4	D142 H143 C158 Y162 E163	D142-C171 HydrophobicContact CB-CB 3.92Å; D142-C171 PolarHBondContact OD2-N 3.42Å; D142-C171 VanDerWaalsContact OD2-N 3.15Å; H143-C171 VanDerWaalsContact CE1-CB 3.46Å; H143-C171 WeakPolarHBondContact CE1-CB 3.46Å; H143-C171 WeakPolarHBondContact ND1-CB 3.41Å; H143-C171 PolarHBondContact ND1-SG 2.78Å; C158-C171 VanDerWaalsContact CA-SG 3.6Å; C158-C171 HydrophobicContact CB-CB 3.9Å; C158-C171 WeakPolarHBondContact CB-SG 3.43Å; C158-C171 WeakPolarHBondContact SG-CB 3.43Å; C158-C171 CovalentContact SG-SG 2.04Å; C158-C171 PolarHBondContact SG-SG 2.87Å; Y162-C171 HydrophobicContact CD1-CB 4.08Å; Y162-C171 HydrophobicContact CG-CB 4.48Å; E163-C171 CarbonylContact O-C 3.54Å; E163-C171 WeakPolarHBondContact O-CA 3.29Å
172	I	94.4	Very high	91.7	Very high	79 Å²	79	52.9 Å²	52.9	41%	0.405	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	146.6	-179.9	58.8	170.8	0	0	0	111.3	Y162 E163 D165	Y162-I172 CarbonylContact C-O 3.55Å; Y162-I172 WeakPolarHBondContact CA-O 3.49Å; Y162-I172 WeakPolarHBondContact CB-O 3.47Å; E163-I172 HydrophobicContact CB-CG1 4.19Å; E163-I172 PolarHBondContact N-O 2.91Å; E163-I172 WeakPolarHBondContact O-CG1 3.43Å; E163-I172 PolarHBondContact O-N 2.87Å; D165-I172 HydrophobicContact CB-CG2 4.17Å
173	T	91.7	Very high	91.6	Very high	74 Å²	74	52.5 Å²	52.5	45%	0.454	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	129.1	-176.3	53.2	0	0	0	0	111.8	Y162 A178 T181	Y162-T173 HydrophobicContact CD1-CG2 3.78Å; Y162-T173 HydrophobicContact CE1-CG2 3.4Å; T173-A178 HydrophobicContact CG2-CB 3.75Å; T173-T181 HydrophobicContact CG2-CG2 4.4Å
174	K	78.9	Confident	91.2	Very high	138 Å²	138	49.6 Å²	49.6	60%	0.6	30%	0.296	S	S	*	.	S	Bend	trans	-75.1	-32.2	172.7	-60.9	-159.6	-149.2	-137.1	0	113.2	G161 E163	G161-K174 PolarHBondContact O-N 2.67Å; E163-K174 HydrophobicContact CB-CG 4.43Å; E163-K174 HydrophobicContact CG-CD 3.62Å; E163-K174 HydrophobicContact CG-CG 3.47Å; E163-K174 VanDerWaalsContact CG-CG 3.47Å; E163-K174 WeakPolarHBondContact OE1-CD 3.47Å; E163-K174 WeakPolarHBondContact OE1-CE 3.31Å; E163-K174 IonicContact OE1-NZ 2.86Å; E163-K174 PolarHBondContact OE1-NZ 2.92Å
175	A	76.8	Confident	90.7	Very high	40 Å²	40	49.7 Å²	49.7	33%	0.331	30%	0.296	S	S	.	.	S	Bend	trans	-119	155.6	-170.1	0	0	0	0	0	110.8	I177	A175-I177 PolarHBondContact O-N 3.37Å
176	P	79.4	Confident	89.7	Confident	129 Å²	129	51.5 Å²	51.5	84%	0.838	30%	0.302	S	S	*	.	S	Bend	trans	-55.8	-25.9	175.4	-24.8	33.7	0	0	0	113.6
177	I	88.5	Confident	88.2	Confident	33 Å²	33	53.5 Å²	53.5	17%	0.169	29%	0.291	C	S	.	.	S	Bend	trans	-132.7	103.8	177.8	-60.2	175.1	0	0	0	107.8	A175 Y297 V302	A175-I177 PolarHBondContact O-N 3.37Å; I177-Y297 VanDerWaalsContact CD1-C 3.49Å; I177-Y297 HydrophobicContact CG2-CD2 4.49Å; I177-Y297 HydrophobicContact CG2-CG 4.44Å; I177-V302 HydrophobicContact CG2-CB 4.06Å; I177-V302 HydrophobicContact CG2-CG1 3.67Å; I177-V302 HydrophobicContact CG2-CG2 3.63Å
178	A	94.8	Very high	86.7	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.008	29%	0.294	C	S	.	.			trans	-100.4	163.7	170.7	0	0	0	0	0	110.4	Y162 T173 T181 V302	Y162-A178 HydrophobicContact CD2-CB 3.92Å; Y162-A178 HydrophobicContact CE2-CB 3.51Å; T173-A178 HydrophobicContact CG2-CB 3.75Å; A178-T181 HydrophobicContact CB-CG2 4.02Å; A178-T181 WeakPolarHBondContact O-CG2 3.49Å; A178-T181 PolarHBondContact O-N 2.77Å; A178-T181 PolarHBondContact O-OG1 3.29Å; A178-V302 WeakPolarHBondContact O-CG1 3.33Å
179	C	97.2	Very high	84.9	Confident	9 Å²	9	57.6 Å²	57.6	6%	0.061	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	150.2	179.4	71.8	0	0	0	0	111.6	D160 Y162 T181 P303 C305	D160-C179 PolarHBondContact O-SG 2.96Å; Y162-C179 WeakPolarHBondContact CE2-O 3.11Å; Y162-C179 PolarHBondContact OH-O 3.21Å; C179-T181 PolarHBondContact O-N 2.9Å; C179-P303 CarbonylContact C-O 3.56Å; C179-P303 WeakPolarHBondContact CA-O 3.25Å; C179-P303 HydrophobicContact CB-CB 4.43Å; C179-P303 HydrophobicContact CB-CG 4.13Å; C179-C305 HydrophobicContact CB-CB 4.04Å; C179-C305 WeakPolarHBondContact CB-SG 3.46Å; C179-C305 PolarHBondContact O-SG 2.89Å; C179-C305 WeakPolarHBondContact SG-CA 3.33Å; C179-C305 WeakPolarHBondContact SG-CB 3.37Å; C179-C305 CovalentContact SG-SG 2.04Å; C179-C305 PolarHBondContact SG-SG 2.99Å
180	G	96.6	Very high	83	Confident	0 Å²	0	63 Å²	63	0%	0	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.1	8.8	174	0	0	0	0	0	115.2	P303 H394	G180-P303 PolarHBondContact N-O 2.94Å; G180-H394 VanDerWaalsContact CA-O 3.24Å; G180-H394 WeakPolarHBondContact CA-O 3.41Å; G180-H394 WeakPolarHBondContact O-CB 3.44Å; G180-H394 PolarHBondContact O-N 3.01Å; G180-H394 PolarHBondContact O-ND1 2.9Å
181	T	95.1	Very high	81	Confident	5 Å²	5	68.2 Å²	68.2	3%	0.031	36%	0.364	C	S	.	.			trans	-84.4	155.4	173.6	61.9	0	0	0	0	111.3	Y162 T173 A178 C179	Y162-T181 WeakPolarHBondContact OH-CG2 3.48Å; T173-T181 HydrophobicContact CG2-CG2 4.4Å; A178-T181 HydrophobicContact CB-CG2 4.02Å; A178-T181 WeakPolarHBondContact O-CG2 3.49Å; A178-T181 PolarHBondContact O-N 2.77Å; A178-T181 PolarHBondContact O-OG1 3.29Å; C179-T181 PolarHBondContact O-N 2.9Å
182	V	94.6	Very high	78.6	Confident	10 Å²	10	74.1 Å²	74.1	6%	0.061	39%	0.392	C	S	.	.			trans	-124.9	83.6	173.4	-175.5	0	0	0	0	108	V184 L185 G206 E207 W210	V182-V184 VanDerWaalsContact C-N 3.25Å; V182-V184 HydrophobicContact CG1-CG2 3.84Å; V182-V184 PolarHBondContact O-N 2.86Å; V182-L185 HydrophobicContact CB-CD1 4.15Å; V182-L185 HydrophobicContact CB-CG 4.41Å; V182-L185 HydrophobicContact CG1-CB 4.29Å; V182-L185 HydrophobicContact CG1-CD1 3.72Å; V182-L185 HydrophobicContact CG1-CG 3.71Å; V182-L185 PolarHBondContact O-N 2.81Å; V182-L185 VanDerWaalsContact O-N 3.11Å; V182-G206 WeakPolarHBondContact CG1-O 3.19Å; V182-E207 HydrophobicContact CG1-CB 4.43Å; V182-E207 HydrophobicContact CG1-CG 4.38Å; V182-W210 HydrophobicContact CG2-CH2 3.81Å; V182-W210 HydrophobicContact CG2-CZ3 3.79Å
183	P	92.2	Very high	76.4	Confident	13 Å²	13	78.7 Å²	78.7	8%	0.084	41%	0.411	C	S	.	.	H	α-helix	trans	-61	-30.5	-167.7	-27.2	36.6	0	0	0	114.2	L185 Q186 K187 P299 V302	P183-L185 VanDerWaalsContact C-N 3.27Å; P183-L185 PolarHBondContact O-N 2.94Å; P183-Q186 PolarHBondContact O-N 3.49Å; P183-K187 PolarHBondContact O-N 3.23Å; P183-P299 HydrophobicContact CB-CB 4.14Å; P183-V302 HydrophobicContact CG-CG2 4.04Å
184	V	88.6	Confident	74.4	Confident	27 Å²	27	82.1 Å²	82.1	16%	0.164	43%	0.426	C	S	.	.	H	α-helix	trans	-61.4	-34.7	178.1	-61.8	0	0	0	0	112.4	V182 V188 G206 E207 P299 Y300	V182-V184 VanDerWaalsContact C-N 3.25Å; V182-V184 HydrophobicContact CG1-CG2 3.84Å; V182-V184 PolarHBondContact O-N 2.86Å; V184-V188 WeakPolarHBondContact O-CG2 3.21Å; V184-V188 PolarHBondContact O-N 3.31Å; V184-G206 WeakPolarHBondContact CG2-O 3.47Å; V184-E207 HydrophobicContact CG2-CG 4.15Å; V184-P299 HydrophobicContact CG1-CB 4.02Å; V184-Y300 HydrophobicContact CG1-CE1 4.09Å
185	L	84.2	Confident	72.5	Confident	74 Å²	74	82.8 Å²	82.8	39%	0.387	44%	0.435	S	S	.	.	H	α-helix	trans	-75.7	-29.2	179.3	-65.2	-179.7	0	0	0	112.6	V182 P183 K187 V188 T189 E207	V182-L185 HydrophobicContact CB-CD1 4.15Å; V182-L185 HydrophobicContact CB-CG 4.41Å; V182-L185 HydrophobicContact CG1-CB 4.29Å; V182-L185 HydrophobicContact CG1-CD1 3.72Å; V182-L185 HydrophobicContact CG1-CG 3.71Å; V182-L185 PolarHBondContact O-N 2.81Å; V182-L185 VanDerWaalsContact O-N 3.11Å; P183-L185 VanDerWaalsContact C-N 3.27Å; P183-L185 PolarHBondContact O-N 2.94Å; L185-K187 VanDerWaalsContact C-N 3.34Å; L185-V188 PolarHBondContact O-N 3.39Å; L185-T189 PolarHBondContact O-N 2.88Å; L185-T189 PolarHBondContact O-OG1 3.12Å; L185-E207 HydrophobicContact CD1-CG 4.37Å; L185-E207 HydrophobicContact CD2-CG 4.08Å; L185-E207 HydrophobicContact CG-CG 4.21Å
186	Q	73.9	Confident	70.7	Confident	106 Å²	106	91.7 Å²	91.7	50%	0.495	46%	0.46	S	S	.	.	H	α-helix	trans	-71.2	-30.4	177.9	-65	176.7	-6.9	0	0	112.3	P183 T189	P183-Q186 PolarHBondContact O-N 3.49Å; Q186-T189 PolarHBondContact O-OG1 3.12Å
187	K	62.1	Low	68.7	Low	146 Å²	146	91 Å²	91	64%	0.635	45%	0.449	S	S	*	.	H	α-helix	trans	-69.2	-42.5	172.6	-72.1	-173.6	177.5	-176.7	0	111.7	P183 L185 T189 K190 D191	P183-K187 PolarHBondContact O-N 3.23Å; L185-K187 VanDerWaalsContact C-N 3.34Å; K187-T189 VanDerWaalsContact C-N 3.31Å; K187-T189 PolarHBondContact O-N 2.8Å; K187-K190 PolarHBondContact O-N 3.38Å; K187-K190 VanDerWaalsContact O-N 3.1Å; K187-D191 PolarHBondContact O-N 2.87Å
188	V	58	Low	66.2	Low	86 Å²	86	95 Å²	95	52%	0.521	47%	0.474	S	S	.	.	H	α-helix	trans	-62.4	-37.1	179.9	176.6	0	0	0	0	112	V184 L185 K190 D191 M192	V184-V188 WeakPolarHBondContact O-CG2 3.21Å; V184-V188 PolarHBondContact O-N 3.31Å; L185-V188 PolarHBondContact O-N 3.39Å; V188-K190 PolarHBondContact O-N 3.2Å; V188-D191 PolarHBondContact O-N 3.49Å; V188-M192 PolarHBondContact O-N 3.18Å
189	T	52.6	Low	63.6	Low	118 Å²	118	98.8 Å²	98.8	72%	0.724	51%	0.513	S	S	*	.	H	α-helix	trans	-66.1	-17.2	176.7	47.9	0	0	0	0	114.6	L185 Q186 K187	L185-T189 PolarHBondContact O-N 2.88Å; L185-T189 PolarHBondContact O-OG1 3.12Å; Q186-T189 PolarHBondContact O-OG1 3.12Å; K187-T189 VanDerWaalsContact C-N 3.31Å; K187-T189 PolarHBondContact O-N 2.8Å
190	K	51.6	Low	61.6	Low	186 Å²	186	101 Å²	101	81%	0.809	54%	0.538	S	S	*	.	H	α-helix	trans	-88.8	-25	174.7	-80.7	-174.1	173.7	-178.1	0	113.4	K187 V188	K187-K190 PolarHBondContact O-N 3.38Å; K187-K190 VanDerWaalsContact O-N 3.1Å; V188-K190 PolarHBondContact O-N 3.2Å
191	D	54.7	Low	60.6	Low	144 Å²	144	103.6 Å²	103.6	77%	0.77	56%	0.556	S	S	*	*	H	α-helix	trans	-109.9	-22.7	-170.4	-90.2	-32	0	0	0	116.3	K187 V188	K187-D191 PolarHBondContact O-N 2.87Å; V188-D191 PolarHBondContact O-N 3.49Å
192	M	45.2	Very low	60.3	Low	138 Å²	138	107.1 Å²	107.1	68%	0.68	57%	0.572	S	S	*	*			trans	-168.5	124.9	173.1	-136	163.5	53.6	0	0	114.3	V188	V188-M192 PolarHBondContact O-N 3.18Å
193	H	48.7	Very low	60.1	Low	175 Å²	175	106.7 Å²	106.7	81%	0.81	57%	0.569	S	S	*	*	S	Bend	trans	-57.3	134.6	157.1	-119.4	-95.9	0	0	0	108.9
194	L	48	Very low	60.1	Low	146 Å²	146	107.4 Å²	107.4	76%	0.764	57%	0.574	S	S	*	*			trans	88.6	77.1	168.7	-53.9	158.5	0	0	0	118.1
195	L	39.6	Very low	60.4	Low	153 Å²	153	109 Å²	109	80%	0.801	58%	0.579	S	S	*	*			trans	-136	89.9	134.1	-80.2	175	0	0	0	108.9	I197	L195-I197 PolarHBondContact O-N 3.13Å
196	R	39.5	Very low	60.8	Low	226 Å²	226	106 Å²	106	85%	0.853	57%	0.565	S	S	*	*			trans	-68.6	98.5	166.8	-173.9	-177.7	-177.5	157.5	-0.2	106.7	V198	R196-V198 HydrophobicContact CB-CG2 4.47Å; R196-V198 HydrophobicContact CG-CG2 3.81Å; R196-V198 PolarHBondContact O-N 2.7Å
197	I	38.1	Very low	61.8	Low	116 Å²	116	102.3 Å²	102.3	60%	0.595	55%	0.548	S	S	*	.			trans	-69.6	102.8	170.4	-59.8	-166.4	0	0	0	107.4	L195 P204	L195-I197 PolarHBondContact O-N 3.13Å; I197-P204 HydrophobicContact CD1-CG 4.16Å
198	V	34.2	Very low	63.5	Low	116 Å²	116	95.7 Å²	95.7	70%	0.703	52%	0.52	S	S	*	.			trans	-92.3	122.2	176.8	-179.7	0	0	0	0	108.8	R196 G200	R196-V198 HydrophobicContact CB-CG2 4.47Å; R196-V198 HydrophobicContact CG-CG2 3.81Å; R196-V198 PolarHBondContact O-N 2.7Å; V198-G200 PolarHBondContact O-N 3.11Å
199	G	41.8	Very low	65.3	Low	81 Å²	81	91.7 Å²	91.7	84%	0.835	50%	0.496	S	S	*	.	S	Bend	trans	87.7	0.9	146.4	0	0	0	0	0	119.9
200	G	55.4	Low	67.5	Low	56 Å²	56	86.4 Å²	86.4	58%	0.577	46%	0.463	S	S	*	.			trans	-83.3	141.1	174.5	0	0	0	0	0	113.3	V198 E202	V198-G200 PolarHBondContact O-N 3.11Å; G200-E202 VanDerWaalsContact C-N 3.3Å
201	S	74.5	Confident	69.7	Low	54 Å²	54	77.7 Å²	77.7	38%	0.378	43%	0.425	S	S	.	.			trans	-88.6	6.3	165.9	53.7	0	0	0	0	113.5	R341 R342	S201-R341 CarbonylContact O-C 3.47Å; S201-R341 VanDerWaalsContact O-CA 3.23Å; S201-R341 WeakPolarHBondContact O-CA 3.45Å; S201-R341 WeakPolarHBondContact O-CB 3.17Å; S201-R341 PolarHBondContact OG-NE 3.43Å; S201-R341 PolarHBondContact OG-NH2 2.92Å; S201-R342 CarbonylContact C-O 3.58Å; S201-R342 PolarHBondContact O-N 3.04Å; S201-R342 VanDerWaalsContact O-O 3.05Å
202	E	88.2	Confident	71.8	Confident	79 Å²	79	70.9 Å²	70.9	37%	0.369	39%	0.388	S	S	.	.	B	Isolated β-bridge	trans	-75.1	140	167.3	-170.6	177.7	145.2	0	0	109.7	G200 P204 H254 L339	G200-E202 VanDerWaalsContact C-N 3.3Å; E202-P204 WeakPolarHBondContact O-CD 3.36Å; E202-H254 IonicContact OE1-CE1 3.95Å; E202-H254 IonicContact OE1-NE2 3.77Å; E202-L339 HydrophobicContact CG-CB 4.39Å
203	C	91.3	Very high	74.3	Confident	0 Å²	0	65 Å²	65	0%	0	36%	0.36	C	S	.	.			trans	-85.8	114.8	167.7	-173.5	0	0	0	0	107.6	K205 C208 H254 L340 R342	C203-K205 PolarHBondContact O-N 3.1Å; C203-C208 HydrophobicContact CB-CB 4.25Å; C203-C208 WeakPolarHBondContact CB-SG 2.78Å; C203-C208 WeakPolarHBondContact SG-CB 3.24Å; C203-C208 PolarHBondContact SG-N 3.15Å; C203-C208 VanDerWaalsContact SG-N 3.42Å; C203-C208 CovalentContact SG-SG 2.05Å; C203-C208 PolarHBondContact SG-SG 2.74Å; C203-H254 PolarHBondContact O-CE1 2.92Å; C203-H254 PolarHBondContact O-ND1 3.36Å; C203-L340 HydrophobicContact CB-CD2 4.23Å; C203-L340 HydrophobicContact CB-CG 3.96Å; C203-L340 PolarHBondContact N-O 3.38Å; C203-R342 HydrophobicContact CB-CB 3.94Å; C203-R342 HydrophobicContact CB-CG 3.86Å
204	P	92.9	Very high	76.6	Confident	29 Å²	29	56.7 Å²	56.7	19%	0.188	32%	0.321	C	S	.	.			trans	-56.7	144.3	177.1	-24.4	35.8	0	0	0	111.1	I197 E202 G206 E207	I197-P204 HydrophobicContact CD1-CG 4.16Å; E202-P204 WeakPolarHBondContact O-CD 3.36Å; P204-G206 PolarHBondContact O-N 3.42Å; P204-E207 HydrophobicContact CB-CG 4.06Å; P204-E207 WeakPolarHBondContact CB-OE1 3.35Å; P204-E207 HydrophobicContact CG-CG 4.47Å; P204-E207 WeakPolarHBondContact CG-OE1 3.29Å; P204-E207 WeakPolarHBondContact O-CB 3.41Å; P204-E207 PolarHBondContact O-N 3.3Å
205	K	93.3	Very high	78.9	Confident	60 Å²	60	50.6 Å²	50.6	26%	0.261	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	123.4	-175.5	-173.8	173.9	-175.9	168.5	0	111.5	C203 H254 E260 T262 Y300	C203-K205 PolarHBondContact O-N 3.1Å; K205-H254 HydrophobicContact CD-CB 4.47Å; K205-H254 HydrophobicContact CG-CB 4.12Å; K205-E260 WeakPolarHBondContact CD-OE1 3.32Å; K205-E260 WeakPolarHBondContact CE-OE1 3.29Å; K205-E260 IonicContact NZ-OE1 2.74Å; K205-E260 PolarHBondContact NZ-OE1 3.37Å; K205-E260 IonicContact NZ-OE2 3.81Å; K205-T262 VanDerWaalsContact CE-OG1 3.25Å; K205-T262 WeakPolarHBondContact CE-OG1 3.47Å; K205-T262 PolarHBondContact NZ-OG1 3.46Å; K205-Y300 HydrophobicContact CD-CE1 4.3Å; K205-Y300 HydrophobicContact CG-CD1 3.93Å; K205-Y300 HydrophobicContact CG-CE1 3.93Å
206	G	93.4	Very high	81.6	Confident	10 Å²	10	46.2 Å²	46.2	10%	0.103	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	85.6	-1.6	-178.8	0	0	0	0	0	115.5	V182 V184 P204 P209	V182-G206 WeakPolarHBondContact CG1-O 3.19Å; V184-G206 WeakPolarHBondContact CG2-O 3.47Å; P204-G206 PolarHBondContact O-N 3.42Å; G206-P209 WeakPolarHBondContact O-CD 3.01Å
207	E	95.1	Very high	84.2	Confident	30 Å²	30	42 Å²	42	14%	0.14	25%	0.251	C	S	.	.	S	Bend	trans	-85.1	-11.3	174.1	-70.3	-166.4	-145.4	0	0	114.2	V182 V184 L185 P204 R342	V182-E207 HydrophobicContact CG1-CB 4.43Å; V182-E207 HydrophobicContact CG1-CG 4.38Å; V184-E207 HydrophobicContact CG2-CG 4.15Å; L185-E207 HydrophobicContact CD1-CG 4.37Å; L185-E207 HydrophobicContact CD2-CG 4.08Å; L185-E207 HydrophobicContact CG-CG 4.21Å; P204-E207 HydrophobicContact CB-CG 4.06Å; P204-E207 WeakPolarHBondContact CB-OE1 3.35Å; P204-E207 HydrophobicContact CG-CG 4.47Å; P204-E207 WeakPolarHBondContact CG-OE1 3.29Å; P204-E207 WeakPolarHBondContact O-CB 3.41Å; P204-E207 PolarHBondContact O-N 3.3Å; E207-R342 IonicContact OE2-CZ 3.73Å; E207-R342 IonicContact OE2-NH1 3.57Å; E207-R342 PolarHBondContact OE2-NH1 2.76Å; E207-R342 IonicContact OE2-NH2 3.9Å; E207-R342 PolarHBondContact OE2-NH2 3.26Å
208	C	96.5	Very high	86.8	Confident	6 Å²	6	40 Å²	40	4%	0.041	26%	0.259	C	S	.	.	S	Bend	trans	-123.9	52.2	173.8	-58.7	0	0	0	0	111.2	C203 W210 Q211 L340	C203-C208 HydrophobicContact CB-CB 4.25Å; C203-C208 WeakPolarHBondContact CB-SG 2.78Å; C203-C208 WeakPolarHBondContact SG-CB 3.24Å; C203-C208 PolarHBondContact SG-N 3.15Å; C203-C208 VanDerWaalsContact SG-N 3.42Å; C203-C208 CovalentContact SG-SG 2.05Å; C203-C208 PolarHBondContact SG-SG 2.74Å; C208-W210 PolarHBondContact O-N 2.9Å; C208-W210 VanDerWaalsContact O-N 3.14Å; C208-Q211 HydrophobicContact CB-CB 4.45Å; C208-Q211 VanDerWaalsContact O-CB 3.22Å; C208-Q211 WeakPolarHBondContact O-CB 3.05Å; C208-Q211 PolarHBondContact O-N 3.05Å; C208-L340 HydrophobicContact CB-CD2 3.82Å
209	P	97.6	Very high	89.5	Confident	2 Å²	2	42.3 Å²	42.3	1%	0.013	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-11.4	-163.7	32	-38.3	0	0	0	114.8	G206 Y300 A301 V302	G206-P209 WeakPolarHBondContact O-CD 3.01Å; P209-Y300 WeakPolarHBondContact CA-O 3.49Å; P209-A301 VanDerWaalsContact O-CA 3.29Å; P209-A301 WeakPolarHBondContact O-CA 3.12Å; P209-V302 HydrophobicContact CB-CB 3.86Å; P209-V302 HydrophobicContact CB-CG2 3.8Å; P209-V302 HydrophobicContact CG-CB 3.8Å; P209-V302 HydrophobicContact CG-CG2 3.95Å; P209-V302 PolarHBondContact O-N 3.25Å
210	W	98.4	Very high	91.8	Very high	7 Å²	7	40.7 Å²	40.7	3%	0.027	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-9.8	174.1	46.8	72.4	0	0	0	113.2	V182 C208 V225 I226 V302 I304 V387 H394	V182-W210 HydrophobicContact CG2-CH2 3.81Å; V182-W210 HydrophobicContact CG2-CZ3 3.79Å; C208-W210 PolarHBondContact O-N 2.9Å; C208-W210 VanDerWaalsContact O-N 3.14Å; W210-V225 HydrophobicContact CB-CG1 4.17Å; W210-V225 CarbonylContact O-C 3.54Å; W210-V225 WeakPolarHBondContact O-CA 3.48Å; W210-I226 PolarHBondContact O-N 3.29Å; W210-V302 WeakPolarHBondContact CA-O 3.37Å; W210-V302 VanDerWaalsContact CB-O 3.28Å; W210-V302 WeakPolarHBondContact CB-O 3.36Å; W210-V302 PolarHBondContact N-O 3.11Å; W210-I304 HydrophobicContact CB-CB 3.94Å; W210-I304 HydrophobicContact CD2-CD1 3.65Å; W210-I304 HydrophobicContact CE3-CD1 3.74Å; W210-I304 HydrophobicContact CG-CB 4.17Å; W210-I304 HydrophobicContact CG-CD1 4.02Å; W210-I304 HydrophobicContact CG-CG1 4.49Å; W210-I304 HydrophobicContact CZ2-CD1 4.48Å; W210-I304 HydrophobicContact CZ3-CD1 4.19Å; W210-V387 HydrophobicContact CH2-CG1 4.4Å; W210-V387 HydrophobicContact CZ2-CB 4.37Å; W210-V387 HydrophobicContact CZ2-CG1 3.92Å; W210-V387 HydrophobicContact CZ2-CG2 4.15Å; W210-H394 HydrophobicContact CH2-CB 3.67Å; W210-H394 AromaticContact CH2-CD2 3.74Å; W210-H394 AromaticContact CH2-CG 3.52Å; W210-H394 AromaticContact CH2-ND1 3.97Å; W210-H394 HydrophobicContact CZ2-CB 4.41Å; W210-H394 HydrophobicContact CZ3-CB 3.82Å; W210-H394 AromaticContact CZ3-CG 3.96Å
211	Q	98.3	Very high	93.6	Very high	4 Å²	4	41.1 Å²	41.1	2%	0.019	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	135.2	177.8	-176.4	74.5	40.8	0	0	110.1	C208 S325 W327 L340	C208-Q211 HydrophobicContact CB-CB 4.45Å; C208-Q211 VanDerWaalsContact O-CB 3.22Å; C208-Q211 WeakPolarHBondContact O-CB 3.05Å; C208-Q211 PolarHBondContact O-N 3.05Å; Q211-S325 PolarHBondContact OE1-O 2.95Å; Q211-S325 VanDerWaalsContact OE1-O 3.04Å; Q211-S325 PolarHBondContact OE1-OG 3.18Å; Q211-W327 HydrophobicContact CG-CE3 4.37Å; Q211-W327 HydrophobicContact CG-CH2 3.52Å; Q211-W327 HydrophobicContact CG-CZ3 3.39Å; Q211-L340 HydrophobicContact CB-CD2 4.3Å; Q211-L340 HydrophobicContact CG-CD1 3.86Å; Q211-L340 HydrophobicContact CG-CD2 4.25Å
212	V	98.2	Very high	94.5	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	155.1	164.6	-56.5	0	0	0	0	111.7	L214 G223 G224 I226 I232 V249 V250 A251	V212-L214 HydrophobicContact CG2-CD2 4.31Å; V212-G223 CarbonylContact O-C 3.52Å; V212-G223 WeakPolarHBondContact O-CA 3.08Å; V212-G224 VanDerWaalsContact CG2-CA 3.45Å; V212-G224 PolarHBondContact N-O 3.21Å; V212-G224 PolarHBondContact O-N 3.07Å; V212-I226 HydrophobicContact CG1-CD1 4Å; V212-I226 HydrophobicContact CG1-CG1 3.43Å; V212-I226 VanDerWaalsContact CG1-CG1 3.43Å; V212-I232 HydrophobicContact CG1-CD1 4.09Å; V212-I232 HydrophobicContact CG2-CD1 4.37Å; V212-I232 HydrophobicContact CG2-CG2 3.67Å; V212-V249 HydrophobicContact CB-CG1 3.77Å; V212-V249 HydrophobicContact CG1-CG1 3.88Å; V212-V249 HydrophobicContact CG2-CG1 3.94Å; V212-V250 WeakPolarHBondContact CA-O 3.42Å; V212-V250 WeakPolarHBondContact CB-O 3.13Å; V212-A251 HydrophobicContact CG1-CB 3.93Å
213	L	97.6	Very high	94.9	Very high	16 Å²	16	35.1 Å²	35.1	8%	0.084	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	126.1	169.2	-179.9	66.7	0	0	0	109.4	T215 V250 E253 I256 W327	L213-T215 HydrophobicContact CD2-CG2 3.98Å; L213-T215 HydrophobicContact CG-CG2 4Å; L213-V250 HydrophobicContact CB-CB 4.28Å; L213-V250 PolarHBondContact N-O 3.05Å; L213-V250 PolarHBondContact O-N 3.25Å; L213-E253 HydrophobicContact CD2-CG 4.36Å; L213-I256 HydrophobicContact CD2-CG2 4.05Å; L213-W327 HydrophobicContact CB-CE3 4.26Å; L213-W327 HydrophobicContact CB-CH2 4.2Å; L213-W327 HydrophobicContact CB-CZ3 3.83Å; L213-W327 HydrophobicContact CD1-CD2 4.48Å; L213-W327 HydrophobicContact CD1-CE3 3.95Å; L213-W327 HydrophobicContact CD1-CZ3 4.37Å
214	L	97.6	Very high	95.2	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	125.8	169	-56.1	-171.4	0	0	0	109.3	V212 G220 F221 C222 G223 T234 C238 V249 L289	V212-L214 HydrophobicContact CG2-CD2 4.31Å; L214-G220 WeakPolarHBondContact O-CA 3.22Å; L214-F221 HydrophobicContact CB-CD1 4.44Å; L214-F221 HydrophobicContact CB-CE1 3.8Å; L214-F221 HydrophobicContact CB-CZ 4Å; L214-F221 VanDerWaalsContact O-CD1 3.25Å; L214-F221 WeakPolarHBondContact O-CD1 3.43Å; L214-F221 PolarHBondContact O-N 2.92Å; L214-C222 HydrophobicContact CB-CB 4.16Å; L214-C222 WeakPolarHBondContact CB-O 3.28Å; L214-C222 HydrophobicContact CD1-CB 3.95Å; L214-C222 HydrophobicContact CG-CB 4.33Å; L214-C222 PolarHBondContact N-O 3.02Å; L214-G223 WeakPolarHBondContact CD1-O 3.08Å; L214-T234 HydrophobicContact CD1-CG2 4.01Å; L214-T234 WeakPolarHBondContact CD1-OG1 3.5Å; L214-C238 HydrophobicContact CD1-CB 4.49Å; L214-V249 HydrophobicContact CD2-CG2 3.64Å; L214-L289 HydrophobicContact CD1-CD1 4.21Å; L214-L289 HydrophobicContact CD2-CD1 3.73Å
215	T	96.1	Very high	95.5	Very high	17 Å²	17	33.7 Å²	33.7	10%	0.104	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	133	178.5	67.6	0	0	0	0	110.5	L213 K219 L247 K248 V250	L213-T215 HydrophobicContact CD2-CG2 3.98Å; L213-T215 HydrophobicContact CG-CG2 4Å; T215-K219 CarbonylContact C-O 3.55Å; T215-K219 VanDerWaalsContact CA-O 3.27Å; T215-K219 WeakPolarHBondContact CA-O 3.42Å; T215-L247 WeakPolarHBondContact O-CA 3.4Å; T215-K248 PolarHBondContact N-O 3.17Å; T215-K248 PolarHBondContact O-N 3.02Å; T215-K248 WeakPolarHBondContact OG1-CB 3.41Å; T215-K248 PolarHBondContact OG1-O 2.85Å; T215-V250 HydrophobicContact CG2-CG2 3.89Å
216	Y	95.9	Very high	95.7	Very high	61 Å²	61	30.9 Å²	30.9	24%	0.239	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	122.4	175.2	-173.3	-108.8	0	0	0	109.4	G218 K219 T242 F246 L247	Y216-G218 PolarHBondContact O-N 3.32Å; Y216-G218 VanDerWaalsContact O-N 3.17Å; Y216-K219 PolarHBondContact N-O 3.28Å; Y216-K219 PolarHBondContact O-N 3.36Å; Y216-T242 HydrophobicContact CD2-CG2 4.48Å; Y216-F246 WeakPolarHBondContact CA-O 3.31Å; Y216-F246 HydrophobicContact CD2-CB 3.85Å; Y216-F246 HydrophobicContact CE2-CB 3.5Å; Y216-F246 VanDerWaalsContact CE2-CB 3.5Å; Y216-F246 HydrophobicContact CE2-CD2 4.39Å; Y216-F246 HydrophobicContact CE2-CG 4.42Å; Y216-L247 HydrophobicContact CD2-CB 4.48Å
217	K	94.9	Very high	95.9	Very high	137 Å²	137	31.3 Å²	31.3	60%	0.596	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.3	39.1	-174.7	-59.6	-178.5	177.3	-178.2	0	112.6	F246	K217-F246 HydrophobicContact CG-CB 3.77Å; K217-F246 HydrophobicContact CG-CD1 4.18Å; K217-F246 HydrophobicContact CG-CG 3.96Å; K217-F246 PolarHBondContact N-O 3.09Å
218	G	90.9	Very high	96	Very high	74 Å²	74	32.5 Å²	32.5	76%	0.763	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.5	5.1	178.1	0	0	0	0	0	115.8	Y216	Y216-G218 PolarHBondContact O-N 3.32Å; Y216-G218 VanDerWaalsContact O-N 3.17Å
219	K	91.3	Very high	95.9	Very high	165 Å²	165	34.7 Å²	34.7	72%	0.717	19%	0.192	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-112.8	126	176.9	-64.6	-175.2	179.5	-177.9	0	111	T215 Y216	T215-K219 CarbonylContact C-O 3.55Å; T215-K219 VanDerWaalsContact CA-O 3.27Å; T215-K219 WeakPolarHBondContact CA-O 3.42Å; Y216-K219 PolarHBondContact N-O 3.28Å; Y216-K219 PolarHBondContact O-N 3.36Å
220	G	91.6	Very high	95.9	Very high	47 Å²	47	36.7 Å²	36.7	49%	0.485	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	133.1	170.9	0	0	0	0	0	111.2	L214	L214-G220 WeakPolarHBondContact O-CA 3.22Å
221	F	91.2	Very high	95.9	Very high	65 Å²	65	37.8 Å²	37.8	29%	0.285	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	-27.9	-175.2	74.4	-82.6	0	0	0	114.9	L214 C238 L247	L214-F221 HydrophobicContact CB-CD1 4.44Å; L214-F221 HydrophobicContact CB-CE1 3.8Å; L214-F221 HydrophobicContact CB-CZ 4Å; L214-F221 VanDerWaalsContact O-CD1 3.25Å; L214-F221 WeakPolarHBondContact O-CD1 3.43Å; L214-F221 PolarHBondContact O-N 2.92Å; F221-C238 HydrophobicContact CE2-CB 4.02Å; F221-C238 WeakPolarHBondContact CE2-O 3.16Å; F221-L247 HydrophobicContact CE1-CD1 3.71Å; F221-L247 HydrophobicContact CZ-CD1 3.81Å
222	C	94.6	Very high	95.9	Very high	6 Å²	6	37.6 Å²	37.6	4%	0.041	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	163.5	176.7	-83.2	0	0	0	0	110.6	L214 C238 S382	L214-C222 HydrophobicContact CB-CB 4.16Å; L214-C222 WeakPolarHBondContact CB-O 3.28Å; L214-C222 HydrophobicContact CD1-CB 3.95Å; L214-C222 HydrophobicContact CG-CB 4.33Å; L214-C222 PolarHBondContact N-O 3.02Å; C222-C238 HydrophobicContact CB-CB 3.7Å; C222-C238 WeakPolarHBondContact CB-SG 3.38Å; C222-C238 WeakPolarHBondContact SG-CB 3.43Å; C222-C238 CovalentContact SG-SG 2.04Å; C222-C238 PolarHBondContact SG-SG 3.13Å; C222-S382 CarbonylContact C-O 3.52Å; C222-S382 WeakPolarHBondContact CA-O 3.16Å; C222-S382 VanDerWaalsContact CB-O 3.29Å; C222-S382 WeakPolarHBondContact CB-O 3.42Å
223	G	95.8	Very high	96	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.01	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	174.4	166	0	0	0	0	0	112.9	V212 L214 T234 S382 G383	V212-G223 CarbonylContact O-C 3.52Å; V212-G223 WeakPolarHBondContact O-CA 3.08Å; L214-G223 WeakPolarHBondContact CD1-O 3.08Å; G223-T234 PolarHBondContact O-OG1 2.81Å; G223-S382 PolarHBondContact N-O 2.8Å; G223-G383 CarbonylContact O-C 3.59Å
224	G	97.9	Very high	96	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.3	-178.5	170.4	0	0	0	0	0	110.5	V212 L233 G383	V212-G224 VanDerWaalsContact CG2-CA 3.45Å; V212-G224 PolarHBondContact N-O 3.21Å; V212-G224 PolarHBondContact O-N 3.07Å; G224-L233 CarbonylContact C-O 3.55Å; G224-L233 WeakPolarHBondContact CA-O 3.37Å; G224-G383 WeakPolarHBondContact CA-O 3.07Å
225	V	98.7	Very high	96	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	128	-176.3	-158.5	0	0	0	0	110.7	W210 Y227 I232 L233 I304 P385 L396	W210-V225 HydrophobicContact CB-CG1 4.17Å; W210-V225 CarbonylContact O-C 3.54Å; W210-V225 WeakPolarHBondContact O-CA 3.48Å; V225-Y227 PolarHBondContact O-N 3.16Å; V225-I232 CarbonylContact O-C 3.43Å; V225-I232 VanDerWaalsContact O-CA 3.31Å; V225-I232 WeakPolarHBondContact O-CA 3.05Å; V225-L233 HydrophobicContact CB-CB 4.31Å; V225-L233 PolarHBondContact N-O 3.14Å; V225-L233 PolarHBondContact O-N 2.98Å; V225-I304 HydrophobicContact CG1-CB 3.93Å; V225-I304 HydrophobicContact CG1-CG2 3.46Å; V225-I304 VanDerWaalsContact CG1-CG2 3.46Å; V225-P385 HydrophobicContact CG1-CB 4.1Å; V225-P385 HydrophobicContact CG2-CB 3.6Å; V225-P385 HydrophobicContact CG2-CG 4.24Å; V225-L396 HydrophobicContact CG1-CD1 4.26Å; V225-L396 HydrophobicContact CG1-CD2 4.47Å; V225-L396 HydrophobicContact CG2-CD1 4.21Å; V225-L396 HydrophobicContact CG2-CD2 4.5Å
226	I	98.7	Very high	96.1	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	117.8	172.8	-51.5	175.2	0	0	0	108.5	W210 V212 I232 A251 I295 Y297 A301 P303 I304	W210-I226 PolarHBondContact O-N 3.29Å; V212-I226 HydrophobicContact CG1-CD1 4Å; V212-I226 HydrophobicContact CG1-CG1 3.43Å; V212-I226 VanDerWaalsContact CG1-CG1 3.43Å; I226-I232 HydrophobicContact CB-CD1 4.3Å; I226-I232 HydrophobicContact CG1-CD1 4.04Å; I226-A251 HydrophobicContact CD1-CB 4.02Å; I226-I295 HydrophobicContact CD1-CD1 4.12Å; I226-I295 HydrophobicContact CG1-CD1 4.02Å; I226-I295 HydrophobicContact CG2-CD1 4.03Å; I226-Y297 HydrophobicContact CG2-CE1 4.11Å; I226-A301 HydrophobicContact CD1-CB 4.25Å; I226-P303 HydrophobicContact CG2-CB 4.09Å; I226-P303 CarbonylContact O-C 3.6Å; I226-P303 WeakPolarHBondContact O-CA 3.3Å; I226-I304 PolarHBondContact O-N 3.4Å
227	Y	97.5	Very high	96.1	Very high	19 Å²	19	35.7 Å²	35.7	8%	0.075	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	-49.5	173.9	167.4	-132.6	0	0	0	111.6	V225 W231 L233 P303 L306 I425 T429	V225-Y227 PolarHBondContact O-N 3.16Å; Y227-W231 HydrophobicContact CD1-CB 4.35Å; Y227-W231 PolarHBondContact N-O 2.95Å; Y227-L233 HydrophobicContact CG-CD1 4.34Å; Y227-P303 VanDerWaalsContact O-CB 3.29Å; Y227-P303 WeakPolarHBondContact O-CB 3.4Å; Y227-L306 HydrophobicContact CD2-CD1 3.76Å; Y227-L306 HydrophobicContact CD2-CG 3.78Å; Y227-L306 HydrophobicContact CE1-CD1 4.29Å; Y227-L306 HydrophobicContact CE2-CD1 3.33Å; Y227-L306 HydrophobicContact CE2-CG 3.62Å; Y227-L306 HydrophobicContact CG-CD1 4.41Å; Y227-I425 HydrophobicContact CD1-CG2 3.86Å; Y227-I425 HydrophobicContact CE1-CG2 3.42Å; Y227-I425 VanDerWaalsContact CE1-CG2 3.42Å; Y227-T429 HydrophobicContact CD1-CG2 4.27Å; Y227-T429 HydrophobicContact CE1-CG2 4.02Å; Y227-T429 WeakPolarHBondContact CE1-OG1 3.32Å
228	K	95.9	Very high	96.1	Very high	55 Å²	55	29.4 Å²	29.4	24%	0.239	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	170	174.9	-70.2	-177.8	176.1	176.1	0	109.3	T230 W231 Y297 T429	K228-T230 PolarHBondContact O-N 3.36Å; K228-W231 HydrophobicContact CB-CB 4.06Å; K228-W231 HydrophobicContact CB-CG 4.4Å; K228-W231 PolarHBondContact N-O 2.87Å; K228-W231 PolarHBondContact O-N 3.07Å; K228-W231 VanDerWaalsContact O-N 3.08Å; K228-Y297 VanDerWaalsContact C-OH 3.31Å; K228-T429 PolarHBondContact NZ-O 2.95Å
229	P	95.8	Very high	96.4	Very high	52 Å²	52	26 Å²	26	34%	0.338	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-33.7	-174.8	-27	35.1	0	0	0	113.2	P294 I295 Y297	P229-P294 HydrophobicContact CB-CB 3.72Å; P229-P294 CarbonylContact O-C 3.41Å; P229-P294 WeakPolarHBondContact O-CA 3.27Å; P229-I295 PolarHBondContact O-N 3.05Å; P229-Y297 WeakPolarHBondContact CD-OH 3.05Å; P229-Y297 HydrophobicContact CG-CE1 4.43Å; P229-Y297 HydrophobicContact CG-CE2 4.06Å; P229-Y297 WeakPolarHBondContact CG-OH 3.25Å; P229-Y297 VanDerWaalsContact N-OH 3.09Å
230	T	97.7	Very high	96.5	Very high	45 Å²	45	21.8 Å²	21.8	28%	0.276	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.8	9.1	-179.5	57.7	0	0	0	0	114.1	K228 R290 L291 P294	K228-T230 PolarHBondContact O-N 3.36Å; T230-R290 WeakPolarHBondContact O-CA 3.48Å; T230-L291 PolarHBondContact O-N 2.87Å; T230-P294 HydrophobicContact CG2-CB 3.94Å
231	W	98.4	Very high	96.6	Very high	29 Å²	29	26.8 Å²	26.8	11%	0.11	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	124.5	-173	-65.5	104.1	0	0	0	112.4	Y227 K228 I272 L288 L289 R290 R428 T429	Y227-W231 HydrophobicContact CD1-CB 4.35Å; Y227-W231 PolarHBondContact N-O 2.95Å; K228-W231 HydrophobicContact CB-CB 4.06Å; K228-W231 HydrophobicContact CB-CG 4.4Å; K228-W231 PolarHBondContact N-O 2.87Å; K228-W231 PolarHBondContact O-N 3.07Å; K228-W231 VanDerWaalsContact O-N 3.08Å; W231-I272 HydrophobicContact CH2-CD1 4.06Å; W231-I272 HydrophobicContact CZ3-CD1 3.9Å; W231-L288 HydrophobicContact CE3-CB 4.39Å; W231-L288 HydrophobicContact CE3-CD2 4.35Å; W231-L288 HydrophobicContact CZ3-CB 4.37Å; W231-L289 WeakPolarHBondContact CA-O 3.39Å; W231-R290 HydrophobicContact CE3-CB 4.11Å; W231-R290 HydrophobicContact CE3-CG 4.42Å; W231-R290 HydrophobicContact CH2-CB 3.99Å; W231-R290 HydrophobicContact CH2-CG 4.03Å; W231-R290 HydrophobicContact CZ2-CG 4.13Å; W231-R290 HydrophobicContact CZ3-CB 3.72Å; W231-R290 HydrophobicContact CZ3-CG 4.17Å; W231-R428 WeakPolarHBondContact CH2-O 3.36Å; W231-T429 HydrophobicContact CB-CG2 4.27Å; W231-T429 HydrophobicContact CD2-CG2 3.58Å; W231-T429 HydrophobicContact CE3-CG2 3.89Å; W231-T429 HydrophobicContact CG-CG2 3.77Å; W231-T429 HydrophobicContact CZ2-CG2 4.38Å; W231-T429 HydrophobicContact CZ3-CG2 4.4Å
232	I	98.7	Very high	96.7	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	135.1	175.7	-57.1	-57.4	0	0	0	109.6	V212 V225 I226 V249 L288 L289 L291 I295	V212-I232 HydrophobicContact CG1-CD1 4.09Å; V212-I232 HydrophobicContact CG2-CD1 4.37Å; V212-I232 HydrophobicContact CG2-CG2 3.67Å; V225-I232 CarbonylContact O-C 3.43Å; V225-I232 VanDerWaalsContact O-CA 3.31Å; V225-I232 WeakPolarHBondContact O-CA 3.05Å; I226-I232 HydrophobicContact CB-CD1 4.3Å; I226-I232 HydrophobicContact CG1-CD1 4.04Å; I232-V249 HydrophobicContact CD1-CG1 4.21Å; I232-V249 HydrophobicContact CG1-CG1 4.01Å; I232-V249 HydrophobicContact CG1-CG2 4.13Å; I232-L288 CarbonylContact O-C 3.53Å; I232-L288 WeakPolarHBondContact O-CA 3.36Å; I232-L289 HydrophobicContact CB-CB 4.19Å; I232-L289 PolarHBondContact N-O 3.22Å; I232-L289 PolarHBondContact O-N 3.07Å; I232-L291 HydrophobicContact CD1-CD1 4.28Å; I232-L291 HydrophobicContact CG1-CD1 4.06Å; I232-L291 HydrophobicContact CG1-CD2 4.05Å; I232-L291 HydrophobicContact CG1-CG 4.22Å; I232-I295 HydrophobicContact CD1-CD1 3.8Å
233	L	98.8	Very high	96.7	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	142.3	167.2	-70.9	164.8	0	0	0	110	G224 V225 Y227 I286 L288 L306 L396 I399 I425	G224-L233 CarbonylContact C-O 3.55Å; G224-L233 WeakPolarHBondContact CA-O 3.37Å; V225-L233 HydrophobicContact CB-CB 4.31Å; V225-L233 PolarHBondContact N-O 3.14Å; V225-L233 PolarHBondContact O-N 2.98Å; Y227-L233 HydrophobicContact CG-CD1 4.34Å; L233-I286 HydrophobicContact CD2-CD1 4.32Å; L233-L288 HydrophobicContact CD2-CD2 3.43Å; L233-L288 VanDerWaalsContact CD2-CD2 3.43Å; L233-L288 HydrophobicContact CD2-CG 4.05Å; L233-L288 HydrophobicContact CG-CD2 4.06Å; L233-L306 HydrophobicContact CD1-CD2 4.08Å; L233-L396 HydrophobicContact CD1-CD2 3.72Å; L233-I399 HydrophobicContact CB-CD1 4.31Å; L233-I425 HydrophobicContact CD1-CD1 4.23Å; L233-I425 HydrophobicContact CD2-CD1 3.87Å; L233-I425 HydrophobicContact CD2-CG1 3.92Å; L233-I425 HydrophobicContact CD2-CG2 4.35Å
234	T	98.5	Very high	96.6	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	-169.9	173.2	-171.1	0	0	0	0	109.6	L214 G223 L239 I286 G287 L289 G383	L214-T234 HydrophobicContact CD1-CG2 4.01Å; L214-T234 WeakPolarHBondContact CD1-OG1 3.5Å; G223-T234 PolarHBondContact O-OG1 2.81Å; T234-L239 HydrophobicContact CG2-CD1 3.78Å; T234-L239 HydrophobicContact CG2-CD2 3.87Å; T234-L239 HydrophobicContact CG2-CG 3.97Å; T234-I286 WeakPolarHBondContact O-CA 3.5Å; T234-G287 PolarHBondContact N-O 2.95Å; T234-G287 PolarHBondContact O-N 2.94Å; T234-L289 HydrophobicContact CG2-CD1 4.28Å; T234-L289 HydrophobicContact CG2-CG 4.31Å; T234-G383 WeakPolarHBondContact OG1-CA 3.23Å
235	A	98.1	Very high	96.5	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.19	C	C	.	.			trans	-91.1	143	175.5	0	0	0	0	0	111.2	H237 C238 I399	A235-H237 VanDerWaalsContact C-N 3.29Å; A235-H237 WeakPolarHBondContact CB-ND1 3.47Å; A235-H237 PolarHBondContact O-N 2.77Å; A235-C238 WeakPolarHBondContact O-CB 3.44Å; A235-C238 PolarHBondContact O-N 2.91Å; A235-I399 HydrophobicContact CB-CG2 4.27Å
236	S	98	Very high	96.4	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-60.7	-37.4	177	-69.8	0	0	0	0	112.3	C238 L239 E240 Y277 D285 I286	S236-C238 PolarHBondContact O-N 3.29Å; S236-L239 WeakPolarHBondContact O-CA 3.35Å; S236-L239 WeakPolarHBondContact O-CB 3.43Å; S236-L239 PolarHBondContact O-N 2.94Å; S236-E240 PolarHBondContact O-N 2.86Å; S236-E240 VanDerWaalsContact O-N 3.13Å; S236-Y277 VanDerWaalsContact CB-CG 3.46Å; S236-D285 WeakPolarHBondContact CA-OD1 3.34Å; S236-D285 PolarHBondContact N-OD1 2.99Å; S236-I286 VanDerWaalsContact OG-C 3.23Å; S236-I286 PolarHBondContact OG-N 2.83Å; S236-I286 PolarHBondContact OG-O 3.3Å
237	H	95.3	Very high	96.4	Very high	54 Å²	54	41 Å²	41	25%	0.25	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-63.4	-23.8	179.7	79.8	-99.7	0	0	0	113.1	A235 L239 Y277 D285 S382 S401	A235-H237 VanDerWaalsContact C-N 3.29Å; A235-H237 WeakPolarHBondContact CB-ND1 3.47Å; A235-H237 PolarHBondContact O-N 2.77Å; H237-L239 PolarHBondContact O-N 2.96Å; H237-Y277 WeakPolarHBondContact CB-OH 3.24Å; H237-D285 IonicContact CE1-OD2 3.12Å; H237-D285 IonicContact CG-OD1 3.54Å; H237-D285 IonicContact CG-OD2 2.75Å; H237-D285 PolarHBondContact N-OD1 2.02Å; H237-D285 IonicContact ND1-OD1 2.6Å; H237-D285 PolarHBondContact ND1-OD1 3.12Å; H237-D285 IonicContact ND1-OD2 2.72Å; H237-D285 PolarHBondContact ND1-OD2 2.72Å; H237-S382 WeakPolarHBondContact NE2-CB 3.02Å; H237-S382 PolarHBondContact NE2-OG 3Å; H237-S382 VanDerWaalsContact NE2-OG 3.08Å; H237-S401 PolarHBondContact CE1-O 2.02Å
238	C	95.8	Very high	96.4	Very high	5 Å²	5	44.4 Å²	44.4	3%	0.034	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-73.1	-19.3	172.8	-69	0	0	0	0	112.4	L214 F221 C222 A235 S236	L214-C238 HydrophobicContact CD1-CB 4.49Å; F221-C238 HydrophobicContact CE2-CB 4.02Å; F221-C238 WeakPolarHBondContact CE2-O 3.16Å; C222-C238 HydrophobicContact CB-CB 3.7Å; C222-C238 WeakPolarHBondContact CB-SG 3.38Å; C222-C238 WeakPolarHBondContact SG-CB 3.43Å; C222-C238 CovalentContact SG-SG 2.04Å; C222-C238 PolarHBondContact SG-SG 3.13Å; A235-C238 WeakPolarHBondContact O-CB 3.44Å; A235-C238 PolarHBondContact O-N 2.91Å; S236-C238 PolarHBondContact O-N 3.29Å
239	L	96.8	Very high	96.5	Very high	4 Å²	4	41.8 Å²	41.8	2%	0.021	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.5	-18.8	-173	-54.3	179.7	0	0	0	112.1	T234 S236 H237 N241 T242 L247 I271 M273 L289	T234-L239 HydrophobicContact CG2-CD1 3.78Å; T234-L239 HydrophobicContact CG2-CD2 3.87Å; T234-L239 HydrophobicContact CG2-CG 3.97Å; S236-L239 WeakPolarHBondContact O-CA 3.35Å; S236-L239 WeakPolarHBondContact O-CB 3.43Å; S236-L239 PolarHBondContact O-N 2.94Å; H237-L239 PolarHBondContact O-N 2.96Å; L239-N241 PolarHBondContact O-N 2.02Å; L239-T242 WeakPolarHBondContact O-CB 3.28Å; L239-T242 PolarHBondContact O-N 3.37Å; L239-T242 VanDerWaalsContact O-N 3.11Å; L239-T242 PolarHBondContact O-OG1 2.87Å; L239-L247 HydrophobicContact CD2-CD2 4.13Å; L239-I271 HydrophobicContact CB-CG2 3.76Å; L239-I271 HydrophobicContact CD1-CG2 3.9Å; L239-I271 HydrophobicContact CD2-CG2 4.42Å; L239-I271 HydrophobicContact CG-CG2 4.22Å; L239-M273 HydrophobicContact CB-CG 3.85Å; L239-M273 HydrophobicContact CB-SD 3.99Å; L239-M273 HydrophobicContact CD1-CG 4.18Å; L239-L289 HydrophobicContact CD1-CD2 4.01Å; L239-L289 HydrophobicContact CD2-CD1 4.25Å; L239-L289 HydrophobicContact CD2-CD2 3.58Å; L239-L289 HydrophobicContact CD2-CG 4.23Å; L239-L289 HydrophobicContact CG-CD2 4.43Å
240	E	93.8	Very high	96.7	Very high	75 Å²	75	39.7 Å²	39.7	35%	0.35	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	130	179.9	-159.2	-177.9	-129	0	0	111.2	S236 T242 S279	S236-E240 PolarHBondContact O-N 2.86Å; S236-E240 VanDerWaalsContact O-N 3.13Å; E240-T242 PolarHBondContact O-N 2.85Å; E240-T242 VanDerWaalsContact O-N 3.1Å; E240-S279 WeakPolarHBondContact OE1-CB 3.46Å; E240-S279 PolarHBondContact OE1-OG 2.84Å
241	N	91.9	Very high	96.7	Very high	152 Å²	152	37.6 Å²	37.6	81%	0.813	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.8	20.1	-179.2	-53.4	-55.6	0	0	0	115.4	L239	L239-N241 PolarHBondContact O-N 2.02Å
242	T	93.4	Very high	96.6	Very high	32 Å²	32	36.5 Å²	36.5	20%	0.196	18%	0.183	C	C	.	.			trans	-94.8	148.2	173.5	68.8	0	0	0	0	111.6	Y216 L239 E240 I271	Y216-T242 HydrophobicContact CD2-CG2 4.48Å; L239-T242 WeakPolarHBondContact O-CB 3.28Å; L239-T242 PolarHBondContact O-N 3.37Å; L239-T242 VanDerWaalsContact O-N 3.11Å; L239-T242 PolarHBondContact O-OG1 2.87Å; E240-T242 PolarHBondContact O-N 2.85Å; E240-T242 VanDerWaalsContact O-N 3.1Å; T242-I271 WeakPolarHBondContact OG1-CD1 3.36Å
243	N	94.9	Very high	96.5	Very high	65 Å²	65	37.7 Å²	37.7	35%	0.348	19%	0.189	S	C	.	.			trans	-104.4	128.7	171.9	-178.1	-36	0	0	0	109.3	Q245 F246 L247	N243-Q245 PolarHBondContact O-N 3.2Å; N243-Q245 VanDerWaalsContact O-N 3.11Å; N243-Q245 WeakPolarHBondContact OD1-CB 3.33Å; N243-Q245 WeakPolarHBondContact OD1-CG 3.37Å; N243-Q245 PolarHBondContact OD1-N 3.37Å; N243-F246 HydrophobicContact CB-CD2 4.06Å; N243-F246 PolarHBondContact O-N 3.25Å; N243-F246 VanDerWaalsContact O-N 3.08Å; N243-L247 PolarHBondContact O-N 3.06Å
244	P	94.6	Very high	96.4	Very high	40 Å²	40	38.4 Å²	38.4	26%	0.26	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	-49.7	-37.8	179.1	-24.5	29.2	0	0	0	113.6	F246 L247 Q267 V268 I271	P244-F246 PolarHBondContact O-N 2.91Å; P244-F246 VanDerWaalsContact O-N 3.11Å; P244-L247 PolarHBondContact O-N 3.15Å; P244-Q267 PolarHBondContact O-NE2 3.08Å; P244-V268 HydrophobicContact CB-CG1 4.49Å; P244-I271 HydrophobicContact CB-CD1 4.28Å; P244-I271 HydrophobicContact CB-CG1 4.42Å; P244-I271 HydrophobicContact CG-CD1 3.7Å; P244-I271 HydrophobicContact CG-CG1 3.91Å
245	Q	95.2	Very high	96.2	Very high	144 Å²	144	40.1 Å²	40.1	67%	0.673	20%	0.201	S	C	*	.	G	3₁₀ helix	trans	-58.8	-28.2	-177.6	-67.5	-178.2	-7.2	0	0	114.1	N243	N243-Q245 PolarHBondContact O-N 3.2Å; N243-Q245 VanDerWaalsContact O-N 3.11Å; N243-Q245 WeakPolarHBondContact OD1-CB 3.33Å; N243-Q245 WeakPolarHBondContact OD1-CG 3.37Å; N243-Q245 PolarHBondContact OD1-N 3.37Å
246	F	96.9	Very high	96	Very high	91 Å²	91	43.2 Å²	43.2	40%	0.399	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-102.9	-3.2	179.4	-57.6	-60.9	0	0	0	113	Y216 K217 N243 P244	Y216-F246 WeakPolarHBondContact CA-O 3.31Å; Y216-F246 HydrophobicContact CD2-CB 3.85Å; Y216-F246 HydrophobicContact CE2-CB 3.5Å; Y216-F246 VanDerWaalsContact CE2-CB 3.5Å; Y216-F246 HydrophobicContact CE2-CD2 4.39Å; Y216-F246 HydrophobicContact CE2-CG 4.42Å; K217-F246 HydrophobicContact CG-CB 3.77Å; K217-F246 HydrophobicContact CG-CD1 4.18Å; K217-F246 HydrophobicContact CG-CG 3.96Å; K217-F246 PolarHBondContact N-O 3.09Å; N243-F246 HydrophobicContact CB-CD2 4.06Å; N243-F246 PolarHBondContact O-N 3.25Å; N243-F246 VanDerWaalsContact O-N 3.08Å; P244-F246 PolarHBondContact O-N 2.91Å; P244-F246 VanDerWaalsContact O-N 3.11Å
247	L	97.9	Very high	95.7	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	125.6	-178.3	-174.2	63.9	0	0	0	110.1	T215 Y216 F221 L239 N243 P244 Q267 V268 I271 L289	T215-L247 WeakPolarHBondContact O-CA 3.4Å; Y216-L247 HydrophobicContact CD2-CB 4.48Å; F221-L247 HydrophobicContact CE1-CD1 3.71Å; F221-L247 HydrophobicContact CZ-CD1 3.81Å; L239-L247 HydrophobicContact CD2-CD2 4.13Å; N243-L247 PolarHBondContact O-N 3.06Å; P244-L247 PolarHBondContact O-N 3.15Å; L247-Q267 PolarHBondContact O-NE2 3.38Å; L247-V268 HydrophobicContact CB-CB 4.35Å; L247-V268 HydrophobicContact CB-CG2 4.41Å; L247-V268 HydrophobicContact CD2-CB 4.34Å; L247-V268 HydrophobicContact CD2-CG1 4.24Å; L247-V268 HydrophobicContact CD2-CG2 4.11Å; L247-V268 HydrophobicContact CG-CB 4.3Å; L247-V268 HydrophobicContact CG-CG2 3.91Å; L247-V268 PolarHBondContact O-N 3.13Å; L247-I271 HydrophobicContact CD2-CD1 3.75Å; L247-I271 HydrophobicContact CD2-CG1 4.11Å; L247-L289 HydrophobicContact CD2-CD1 4.19Å; L247-L289 HydrophobicContact CD2-CD2 3.93Å
248	K	98.4	Very high	95.7	Very high	89 Å²	89	50.6 Å²	50.6	39%	0.387	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	152.7	175.2	-58.8	-179.6	179.3	-175.7	0	110.7	T215 V265 I266	T215-K248 PolarHBondContact N-O 3.17Å; T215-K248 PolarHBondContact O-N 3.02Å; T215-K248 WeakPolarHBondContact OG1-CB 3.41Å; T215-K248 PolarHBondContact OG1-O 2.85Å; K248-V265 HydrophobicContact CB-CG1 4.34Å; K248-V265 HydrophobicContact CD-CG1 3.85Å; K248-I266 WeakPolarHBondContact CA-O 3.19Å
249	V	98.4	Very high	95.6	Very high	0 Å²	0	57 Å²	57	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	134.1	174	169.7	0	0	0	0	108.3	V212 L214 I232 V265 I266 V268 L289 L291	V212-V249 HydrophobicContact CB-CG1 3.77Å; V212-V249 HydrophobicContact CG1-CG1 3.88Å; V212-V249 HydrophobicContact CG2-CG1 3.94Å; L214-V249 HydrophobicContact CD2-CG2 3.64Å; I232-V249 HydrophobicContact CD1-CG1 4.21Å; I232-V249 HydrophobicContact CG1-CG1 4.01Å; I232-V249 HydrophobicContact CG1-CG2 4.13Å; V249-V265 WeakPolarHBondContact O-CA 3.23Å; V249-I266 PolarHBondContact N-O 2.79Å; V249-I266 PolarHBondContact O-N 2.81Å; V249-V268 HydrophobicContact CG2-CG2 3.89Å; V249-L289 HydrophobicContact CG2-CD1 4.13Å; V249-L291 HydrophobicContact CB-CD2 3.94Å; V249-L291 HydrophobicContact CG1-CD2 4.47Å; V249-L291 HydrophobicContact CG2-CD2 3.74Å
250	V	98.3	Very high	95.4	Very high	9 Å²	9	59.1 Å²	59.1	6%	0.055	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	111.8	171.1	-165.8	0	0	0	0	108.5	V212 L213 T215 E253 E263 Q264 V265	V212-V250 WeakPolarHBondContact CA-O 3.42Å; V212-V250 WeakPolarHBondContact CB-O 3.13Å; L213-V250 HydrophobicContact CB-CB 4.28Å; L213-V250 PolarHBondContact N-O 3.05Å; L213-V250 PolarHBondContact O-N 3.25Å; T215-V250 HydrophobicContact CG2-CG2 3.89Å; V250-E253 HydrophobicContact CB-CB 4.49Å; V250-E253 HydrophobicContact CG1-CB 3.96Å; V250-E263 HydrophobicContact CG1-CB 4.02Å; V250-E263 HydrophobicContact CG1-CG 4.35Å; V250-Q264 WeakPolarHBondContact CA-O 3.42Å; V250-V265 HydrophobicContact CG1-CG2 4.11Å; V250-V265 HydrophobicContact CG2-CG2 4.16Å
251	A	98.3	Very high	95.4	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	149.6	173.9	0	0	0	0	0	110.5	V212 I226 E253 E263 Q264 I295 A301	V212-A251 HydrophobicContact CG1-CB 3.93Å; I226-A251 HydrophobicContact CD1-CB 4.02Å; A251-E253 PolarHBondContact O-N 2.8Å; A251-E263 CarbonylContact O-C 3.57Å; A251-E263 WeakPolarHBondContact O-CA 3.05Å; A251-Q264 HydrophobicContact CB-CB 4.46Å; A251-Q264 PolarHBondContact N-O 3.07Å; A251-Q264 PolarHBondContact O-N 2.9Å; A251-I295 HydrophobicContact CB-CD1 4.09Å; A251-I295 HydrophobicContact CB-CG1 4.36Å; A251-I295 HydrophobicContact CB-CG2 4.31Å; A251-A301 HydrophobicContact CB-CB 4.35Å
252	G	97.2	Very high	95.6	Very high	6 Å²	6	54.5 Å²	54.5	6%	0.062	29%	0.291	C	S	.	.	S	Bend	trans	72.4	15.3	-178.8	0	0	0	0	0	115.1	T262 Y300	G252-T262 WeakPolarHBondContact O-CB 3.19Å; G252-T262 PolarHBondContact O-OG1 2.97Å; G252-Y300 WeakPolarHBondContact CA-O 3.4Å
253	E	96.6	Very high	95.8	Very high	25 Å²	25	54.3 Å²	54.3	12%	0.117	29%	0.288	C	S	.	.			trans	-75	144.4	173.3	-179.8	56.6	-99.7	0	0	111.1	L213 V250 A251 D255 I256 E263 W327	L213-E253 HydrophobicContact CD2-CG 4.36Å; V250-E253 HydrophobicContact CB-CB 4.49Å; V250-E253 HydrophobicContact CG1-CB 3.96Å; A251-E253 PolarHBondContact O-N 2.8Å; E253-D255 PolarHBondContact OE1-N 3.38Å; E253-I256 HydrophobicContact CG-CG2 4.15Å; E253-I256 PolarHBondContact OE1-N 3.43Å; E253-E263 HydrophobicContact CB-CG 4.47Å; E253-W327 HydrophobicContact CB-CH2 4.08Å; E253-W327 HydrophobicContact CB-CZ2 3.92Å; E253-W327 HydrophobicContact CG-CH2 4.13Å; E253-W327 HydrophobicContact CG-CZ2 3.63Å; E253-W327 WeakPolarHBondContact O-CZ2 3.44Å
254	H	95.5	Very high	96	Very high	16 Å²	16	53.1 Å²	53.1	7%	0.074	28%	0.281	C	S	.	.	S	Bend	trans	-141.2	-54.1	174.4	173.4	74.4	0	0	0	111.4	E202 C203 K205 E260 W327 L339 L340	E202-H254 IonicContact OE1-CE1 3.95Å; E202-H254 IonicContact OE1-NE2 3.77Å; C203-H254 PolarHBondContact O-CE1 2.92Å; C203-H254 PolarHBondContact O-ND1 3.36Å; K205-H254 HydrophobicContact CD-CB 4.47Å; K205-H254 HydrophobicContact CG-CB 4.12Å; H254-E260 VanDerWaalsContact CB-OE2 3.29Å; H254-E260 WeakPolarHBondContact CB-OE2 3.46Å; H254-E260 IonicContact CD2-OE2 3.84Å; H254-E260 IonicContact CG-OE2 3.07Å; H254-W327 PolarHBondContact O-NE1 3.26Å; H254-W327 VanDerWaalsContact O-NE1 3.11Å; H254-L339 CarbonylContact O-C 3.56Å; H254-L339 WeakPolarHBondContact O-CA 3.32Å; H254-L340 PolarHBondContact O-N 3.48Å
255	D	94.9	Very high	96.2	Very high	35 Å²	35	55.6 Å²	55.6	19%	0.187	30%	0.295	C	S	.	.	B	Isolated β-bridge	trans	-106.7	104.2	170.9	-171.5	-28.7	0	0	0	112.8	E253 L257 V258 E260 V338 L339	E253-D255 PolarHBondContact OE1-N 3.38Å; D255-L257 PolarHBondContact O-N 2.86Å; D255-L257 WeakPolarHBondContact OD1-CB 3.48Å; D255-L257 PolarHBondContact OD1-N 3.44Å; D255-V258 HydrophobicContact CB-CG2 3.6Å; D255-V258 PolarHBondContact O-N 3.11Å; D255-E260 PolarHBondContact N-OE2 3.08Å; D255-V338 WeakPolarHBondContact OD1-CG1 3.4Å; D255-L339 HydrophobicContact CB-CD2 3.57Å; D255-L339 WeakPolarHBondContact OD2-CD2 3.42Å
256	I	93.3	Very high	96.3	Very high	65 Å²	65	49.2 Å²	49.2	33%	0.333	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-7.7	-174.3	71.5	-177.6	0	0	0	115.1	L213 E253 W327 V338	L213-I256 HydrophobicContact CD2-CG2 4.05Å; E253-I256 HydrophobicContact CG-CG2 4.15Å; E253-I256 PolarHBondContact OE1-N 3.43Å; I256-W327 HydrophobicContact CG2-CD2 4.48Å; I256-W327 HydrophobicContact CG2-CG 4.16Å; I256-V338 HydrophobicContact CG1-CB 4.49Å; I256-V338 HydrophobicContact CG1-CG1 4.32Å; I256-V338 PolarHBondContact N-O 2.77Å
257	L	93.1	Very high	96.4	Very high	132 Å²	132	47.7 Å²	47.7	69%	0.691	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	-14.9	178.8	-64.8	-175.7	0	0	0	113.3	D255 V338	D255-L257 PolarHBondContact O-N 2.86Å; D255-L257 WeakPolarHBondContact OD1-CB 3.48Å; D255-L257 PolarHBondContact OD1-N 3.44Å; L257-V338 HydrophobicContact CB-CG1 4.23Å; L257-V338 HydrophobicContact CD1-CB 4.4Å; L257-V338 HydrophobicContact CD1-CG1 3.74Å; L257-V338 HydrophobicContact CD1-CG2 3.73Å; L257-V338 HydrophobicContact CG-CB 4.48Å; L257-V338 HydrophobicContact CG-CG1 3.66Å; L257-V338 HydrophobicContact CG-CG2 4.04Å
258	V	94.1	Very high	96.4	Very high	77 Å²	77	47.9 Å²	47.9	47%	0.467	26%	0.26	S	S	.	.	S	Bend	trans	-128.2	148.1	-177.3	-64.7	0	0	0	0	110.7	D255 E260	D255-V258 HydrophobicContact CB-CG2 3.6Å; D255-V258 PolarHBondContact O-N 3.11Å; V258-E260 HydrophobicContact CG2-CG 3.73Å
259	N	93.2	Very high	96.4	Very high	139 Å²	139	46.8 Å²	46.8	74%	0.743	26%	0.261	S	S	*	.			trans	-89.5	107.7	170.3	179	14.5	0	0	0	107.9	S261 E263	N259-S261 VanDerWaalsContact C-N 3.31Å; N259-S261 PolarHBondContact OD1-N 2.9Å; N259-E263 PolarHBondContact OD1-OE2 3.32Å
260	E	93.9	Very high	96.3	Very high	49 Å²	49	50.4 Å²	50.4	23%	0.229	28%	0.278	C	S	.	.			trans	-93	11.6	-176.7	-46.8	179.1	61.9	0	0	113.3	K205 H254 D255 V258 T262 E263	K205-E260 WeakPolarHBondContact CD-OE1 3.32Å; K205-E260 WeakPolarHBondContact CE-OE1 3.29Å; K205-E260 IonicContact NZ-OE1 2.74Å; K205-E260 PolarHBondContact NZ-OE1 3.37Å; K205-E260 IonicContact NZ-OE2 3.81Å; H254-E260 VanDerWaalsContact CB-OE2 3.29Å; H254-E260 WeakPolarHBondContact CB-OE2 3.46Å; H254-E260 IonicContact CD2-OE2 3.84Å; H254-E260 IonicContact CG-OE2 3.07Å; D255-E260 PolarHBondContact N-OE2 3.08Å; V258-E260 HydrophobicContact CG2-CG 3.73Å; E260-T262 PolarHBondContact O-N 3.36Å; E260-T262 VanDerWaalsContact O-N 3.16Å; E260-E263 WeakPolarHBondContact CB-OE1 3.41Å; E260-E263 WeakPolarHBondContact CG-OE1 3.38Å; E260-E263 VanDerWaalsContact N-CD 3.29Å; E260-E263 PolarHBondContact N-OE1 3.28Å; E260-E263 VanDerWaalsContact N-OE1 3.09Å; E260-E263 PolarHBondContact N-OE2 3.31Å
261	S	94.3	Very high	96.3	Very high	111 Å²	111	51.9 Å²	51.9	78%	0.776	29%	0.285	S	S	*	.	S	Bend	trans	64.7	5.1	-178.1	71.7	0	0	0	0	115.6	N259 E263	N259-S261 VanDerWaalsContact C-N 3.31Å; N259-S261 PolarHBondContact OD1-N 2.9Å; S261-E263 PolarHBondContact N-OE2 3.25Å
262	T	96	Very high	96.3	Very high	19 Å²	19	52.8 Å²	52.8	12%	0.117	29%	0.29	C	S	.	.			trans	-97	-15.2	175.9	46.9	0	0	0	0	112.5	K205 G252 E260 Y300	K205-T262 VanDerWaalsContact CE-OG1 3.25Å; K205-T262 WeakPolarHBondContact CE-OG1 3.47Å; K205-T262 PolarHBondContact NZ-OG1 3.46Å; G252-T262 WeakPolarHBondContact O-CB 3.19Å; G252-T262 PolarHBondContact O-OG1 2.97Å; E260-T262 PolarHBondContact O-N 3.36Å; E260-T262 VanDerWaalsContact O-N 3.16Å; T262-Y300 HydrophobicContact CG2-CD1 4.46Å; T262-Y300 HydrophobicContact CG2-CD2 3.37Å; T262-Y300 HydrophobicContact CG2-CE2 3.65Å; T262-Y300 HydrophobicContact CG2-CG 3.82Å
263	E	97.6	Very high	96.4	Very high	29 Å²	29	56.1 Å²	56.1	14%	0.136	30%	0.304	C	S	.	.			trans	-74.1	128.7	-173.9	-59.9	72.8	-160.7	0	0	111.2	V250 A251 E253 N259 E260 S261	V250-E263 HydrophobicContact CG1-CB 4.02Å; V250-E263 HydrophobicContact CG1-CG 4.35Å; A251-E263 CarbonylContact O-C 3.57Å; A251-E263 WeakPolarHBondContact O-CA 3.05Å; E253-E263 HydrophobicContact CB-CG 4.47Å; N259-E263 PolarHBondContact OD1-OE2 3.32Å; E260-E263 WeakPolarHBondContact CB-OE1 3.41Å; E260-E263 WeakPolarHBondContact CG-OE1 3.38Å; E260-E263 VanDerWaalsContact N-CD 3.29Å; E260-E263 PolarHBondContact N-OE1 3.28Å; E260-E263 VanDerWaalsContact N-OE1 3.09Å; E260-E263 PolarHBondContact N-OE2 3.31Å; S261-E263 PolarHBondContact N-OE2 3.25Å
264	Q	98.2	Very high	96.5	Very high	40 Å²	40	55.8 Å²	55.8	19%	0.187	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	103.4	173	-67.3	175.8	69.2	0	0	108.8	V250 A251 I266 V296	V250-Q264 WeakPolarHBondContact CA-O 3.42Å; A251-Q264 HydrophobicContact CB-CB 4.46Å; A251-Q264 PolarHBondContact N-O 3.07Å; A251-Q264 PolarHBondContact O-N 2.9Å; Q264-I266 HydrophobicContact CB-CD1 4.33Å; Q264-I266 HydrophobicContact CB-CG1 4.49Å; Q264-V296 PolarHBondContact NE2-O 2.74Å; Q264-V296 PolarHBondContact OE1-O 3.08Å
265	V	98.1	Very high	96.6	Very high	92 Å²	92	59.7 Å²	59.7	56%	0.558	32%	0.321	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.7	113.1	178.1	-175.5	0	0	0	0	109.4	K248 V249 V250	K248-V265 HydrophobicContact CB-CG1 4.34Å; K248-V265 HydrophobicContact CD-CG1 3.85Å; V249-V265 WeakPolarHBondContact O-CA 3.23Å; V250-V265 HydrophobicContact CG1-CG2 4.11Å; V250-V265 HydrophobicContact CG2-CG2 4.16Å
266	I	98.4	Very high	96.7	Very high	10 Å²	10	63.1 Å²	63.1	5%	0.051	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	136.6	-172.4	-55.5	168.6	0	0	0	110.5	K248 V249 Q264 L291 S293 I295	K248-I266 WeakPolarHBondContact CA-O 3.19Å; V249-I266 PolarHBondContact N-O 2.79Å; V249-I266 PolarHBondContact O-N 2.81Å; Q264-I266 HydrophobicContact CB-CD1 4.33Å; Q264-I266 HydrophobicContact CB-CG1 4.49Å; I266-L291 HydrophobicContact CD1-CD1 4.21Å; I266-L291 HydrophobicContact CG2-CB 3.84Å; I266-L291 HydrophobicContact CG2-CD1 4.24Å; I266-L291 HydrophobicContact CG2-CD2 4.32Å; I266-L291 HydrophobicContact CG2-CG 4.36Å; I266-S293 WeakPolarHBondContact CG2-OG 3.27Å; I266-I295 HydrophobicContact CD1-CB 4.24Å; I266-I295 HydrophobicContact CD1-CD1 4.49Å; I266-I295 HydrophobicContact CD1-CG1 3.36Å
267	Q	98.3	Very high	96.9	Very high	59 Å²	59	61.7 Å²	61.7	28%	0.276	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	137.1	178.6	-174.3	55.7	52.8	0	0	111.2	P244 L247 A292	P244-Q267 PolarHBondContact O-NE2 3.08Å; L247-Q267 PolarHBondContact O-NE2 3.38Å; Q267-A292 HydrophobicContact CB-CB 4.02Å; Q267-A292 WeakPolarHBondContact O-CB 3.26Å; Q267-A292 PolarHBondContact O-N 2.89Å
268	V	98.4	Very high	97	Very high	3 Å²	3	58.3 Å²	58.3	2%	0.018	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	132.9	169.5	176.9	0	0	0	0	109.3	P244 L247 V249 E270 I271 L289 L291	P244-V268 HydrophobicContact CB-CG1 4.49Å; L247-V268 HydrophobicContact CB-CB 4.35Å; L247-V268 HydrophobicContact CB-CG2 4.41Å; L247-V268 HydrophobicContact CD2-CB 4.34Å; L247-V268 HydrophobicContact CD2-CG1 4.24Å; L247-V268 HydrophobicContact CD2-CG2 4.11Å; L247-V268 HydrophobicContact CG-CB 4.3Å; L247-V268 HydrophobicContact CG-CG2 3.91Å; L247-V268 PolarHBondContact O-N 3.13Å; V249-V268 HydrophobicContact CG2-CG2 3.89Å; V268-E270 WeakPolarHBondContact CG1-O 3.33Å; V268-I271 HydrophobicContact CG1-CG1 4.05Å; V268-L289 HydrophobicContact CG1-CB 4.23Å; V268-L289 HydrophobicContact CG1-CD2 3.99Å; V268-L289 HydrophobicContact CG2-CB 4.41Å; V268-L289 HydrophobicContact CG2-CD1 4.18Å; V268-L291 HydrophobicContact CG2-CD2 4.3Å
269	V	97.8	Very high	97	Very high	66 Å²	66	57.4 Å²	57.4	40%	0.4	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	-23.4	176.5	-64.5	0	0	0	0	113.1	R290 A292	V269-R290 HydrophobicContact CG2-CB 4.05Å; V269-R290 HydrophobicContact CG2-CG 4.09Å; V269-R290 VanDerWaalsContact CG2-O 3.31Å; V269-R290 WeakPolarHBondContact CG2-O 3.13Å; V269-R290 PolarHBondContact N-O 2.75Å; V269-A292 HydrophobicContact CG1-CB 3.55Å
270	E	97.7	Very high	96.9	Very high	76 Å²	76	56 Å²	56	36%	0.355	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	138.1	-176.6	-163.8	176.7	172.3	0	0	110.6	V268 I272 L289 R290	V268-E270 WeakPolarHBondContact CG1-O 3.33Å; E270-I272 HydrophobicContact CG-CD1 4.44Å; E270-I272 HydrophobicContact CG-CG1 4.05Å; E270-L289 WeakPolarHBondContact O-CA 3.49Å; E270-R290 HydrophobicContact CB-CB 3.77Å; E270-R290 PolarHBondContact N-O 2.97Å; E270-R290 PolarHBondContact O-N 3.34Å; E270-R290 IonicContact OE2-CZ 3.74Å; E270-R290 IonicContact OE2-NE 2.69Å; E270-R290 PolarHBondContact OE2-NE 2.83Å; E270-R290 IonicContact OE2-NH2 3.91Å; E270-R290 PolarHBondContact OE2-NH2 3.32Å
271	I	98.3	Very high	96.8	Very high	40 Å²	40	57.1 Å²	57.1	21%	0.205	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	122.9	177.3	-64.9	176.4	0	0	0	106.7	L239 T242 P244 L247 V268 M273 L289	L239-I271 HydrophobicContact CB-CG2 3.76Å; L239-I271 HydrophobicContact CD1-CG2 3.9Å; L239-I271 HydrophobicContact CD2-CG2 4.42Å; L239-I271 HydrophobicContact CG-CG2 4.22Å; T242-I271 WeakPolarHBondContact OG1-CD1 3.36Å; P244-I271 HydrophobicContact CB-CD1 4.28Å; P244-I271 HydrophobicContact CB-CG1 4.42Å; P244-I271 HydrophobicContact CG-CD1 3.7Å; P244-I271 HydrophobicContact CG-CG1 3.91Å; L247-I271 HydrophobicContact CD2-CD1 3.75Å; L247-I271 HydrophobicContact CD2-CG1 4.11Å; V268-I271 HydrophobicContact CG1-CG1 4.05Å; I271-M273 HydrophobicContact CG2-CG 4.4Å; I271-L289 HydrophobicContact CB-CD2 4.24Å; I271-L289 HydrophobicContact CG1-CD2 3.72Å; I271-L289 HydrophobicContact CG2-CD2 4.31Å
272	I	98.1	Very high	96.8	Very high	20 Å²	20	53.2 Å²	53.2	10%	0.103	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	96.6	179.6	-50.8	176.4	0	0	0	107.7	W231 E270 G287 L288 W424	W231-I272 HydrophobicContact CH2-CD1 4.06Å; W231-I272 HydrophobicContact CZ3-CD1 3.9Å; E270-I272 HydrophobicContact CG-CD1 4.44Å; E270-I272 HydrophobicContact CG-CG1 4.05Å; I272-G287 CarbonylContact O-C 3.36Å; I272-G287 VanDerWaalsContact O-CA 3.31Å; I272-G287 WeakPolarHBondContact O-CA 3.03Å; I272-L288 HydrophobicContact CB-CB 4.16Å; I272-L288 PolarHBondContact N-O 3.28Å; I272-L288 PolarHBondContact O-N 3.44Å; I272-W424 HydrophobicContact CG2-CZ2 4.06Å
273	M	98.3	Very high	96.9	Very high	75 Å²	75	53.5 Å²	53.5	37%	0.369	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	147.1	169.5	-63.5	-174.5	-62.1	0	0	109.5	L239 I271 E275	L239-M273 HydrophobicContact CB-CG 3.85Å; L239-M273 HydrophobicContact CB-SD 3.99Å; L239-M273 HydrophobicContact CD1-CG 4.18Å; I271-M273 HydrophobicContact CG2-CG 4.4Å; M273-E275 PolarHBondContact O-N 3.27Å
274	H	98.3	Very high	96.9	Very high	18 Å²	18	53 Å²	53	8%	0.083	29%	0.294	C	S	.	.			trans	-58.9	134	172.6	-167.9	-77.4	0	0	0	110.7	N276 Y277 N284 I286 Y421 W424	H274-N276 PolarHBondContact ND1-N 3.4Å; H274-N276 PolarHBondContact O-N 2.8Å; H274-Y277 WeakPolarHBondContact O-CB 3.28Å; H274-Y277 PolarHBondContact O-N 3.3Å; H274-N284 HydrophobicContact CB-CB 4.37Å; H274-I286 HydrophobicContact CB-CG2 3.84Å; H274-I286 VanDerWaalsContact CB-O 3.25Å; H274-I286 WeakPolarHBondContact CB-O 3.44Å; H274-I286 PolarHBondContact N-O 3.02Å; H274-I286 VanDerWaalsContact N-O 3.08Å; H274-Y421 AromaticContact CD2-CD1 3.54Å; H274-Y421 AromaticContact CD2-CE1 3.59Å; H274-Y421 AromaticContact NE2-CD1 3.55Å; H274-Y421 AromaticContact NE2-CE1 3.46Å; H274-Y421 WeakPolarHBondContact NE2-CE1 3.42Å; H274-W424 HydrophobicContact CB-CZ2 4.12Å; H274-W424 AromaticContact CD2-CD1 3.77Å; H274-W424 AromaticContact CD2-CD2 3.7Å; H274-W424 AromaticContact CD2-CE2 3.64Å; H274-W424 AromaticContact CD2-CG 3.82Å; H274-W424 AromaticContact CD2-NE1 3.65Å; H274-W424 AromaticContact NE2-CD1 3.9Å
275	E	97.4	Very high	96.9	Very high	99 Å²	99	51.1 Å²	51.1	46%	0.463	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-31.1	-168.1	-57.5	77.8	-175.4	0	0	111.9	M273 Y277 W424 R428	M273-E275 PolarHBondContact O-N 3.27Å; E275-Y277 VanDerWaalsContact C-N 3.34Å; E275-W424 PolarHBondContact OE1-NE1 2.97Å; E275-W424 PolarHBondContact OE2-NE1 3.39Å; E275-R428 IonicContact OE1-CZ 3.05Å; E275-R428 VanDerWaalsContact OE1-CZ 3.31Å; E275-R428 IonicContact OE1-NE 2.77Å; E275-R428 PolarHBondContact OE1-NE 3.03Å; E275-R428 IonicContact OE1-NH2 3.45Å; E275-R428 PolarHBondContact OE1-NH2 3.43Å
276	N	97.6	Very high	96.9	Very high	106 Å²	106	46.8 Å²	46.8	57%	0.567	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	16.8	176.7	-59.3	-37.3	0	0	0	113.6	H274 V278 N284	H274-N276 PolarHBondContact ND1-N 3.4Å; H274-N276 PolarHBondContact O-N 2.8Å; N276-V278 PolarHBondContact O-N 2.77Å; N276-N284 PolarHBondContact O-ND2 2.86Å
277	Y	97.8	Very high	96.9	Very high	36 Å²	36	46.3 Å²	46.3	14%	0.141	26%	0.256	C	S	.	.			trans	-62.7	130.1	175.6	174.5	-115.9	0	0	0	111	S236 H237 H274 E275 V282 D283 D285	S236-Y277 VanDerWaalsContact CB-CG 3.46Å; H237-Y277 WeakPolarHBondContact CB-OH 3.24Å; H274-Y277 WeakPolarHBondContact O-CB 3.28Å; H274-Y277 PolarHBondContact O-N 3.3Å; E275-Y277 VanDerWaalsContact C-N 3.34Å; Y277-V282 HydrophobicContact CE2-CG1 4.34Å; Y277-D283 WeakPolarHBondContact CA-O 3.47Å; Y277-D283 VanDerWaalsContact CD2-O 3.31Å; Y277-D283 WeakPolarHBondContact CD2-O 3.34Å; Y277-D285 HydrophobicContact CD2-CB 4.14Å; Y277-D285 HydrophobicContact CE2-CB 3.84Å
278	V	96.1	Very high	96.9	Very high	60 Å²	60	43.5 Å²	43.5	36%	0.364	24%	0.243	S	C	.	.	B	Isolated β-bridge	trans	-120.9	107.6	179.9	-178.7	0	0	0	0	109.5	N276 S280 T281 V282 D283	N276-V278 PolarHBondContact O-N 2.77Å; V278-S280 VanDerWaalsContact C-N 3.3Å; V278-S280 WeakPolarHBondContact CG1-OG 3.46Å; V278-S280 PolarHBondContact O-N 3.35Å; V278-T281 WeakPolarHBondContact CB-OG1 3.38Å; V278-T281 HydrophobicContact CG1-CG2 4.42Å; V278-T281 WeakPolarHBondContact CG1-OG1 3.47Å; V278-T281 PolarHBondContact O-N 2.92Å; V278-V282 WeakPolarHBondContact O-CA 3.45Å; V278-V282 PolarHBondContact O-N 3.43Å; V278-D283 PolarHBondContact N-O 2.54Å; V278-D283 PolarHBondContact O-N 3.33Å
279	S	93.8	Very high	96.9	Very high	59 Å²	59	43.3 Å²	43.3	41%	0.413	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-35.6	-176.1	-171.5	0	0	0	0	113.5	E240	E240-S279 WeakPolarHBondContact OE1-CB 3.46Å; E240-S279 PolarHBondContact OE1-OG 2.84Å
280	S	91.6	Very high	96.9	Very high	110 Å²	110	45.1 Å²	45.1	77%	0.769	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72	-33.2	-177.8	59.8	0	0	0	0	114.6	V278	V278-S280 VanDerWaalsContact C-N 3.3Å; V278-S280 WeakPolarHBondContact CG1-OG 3.46Å; V278-S280 PolarHBondContact O-N 3.35Å
281	T	91.8	Very high	97	Very high	72 Å²	72	41.8 Å²	41.8	44%	0.442	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104	-11	178.7	59.7	0	0	0	0	112.6	V278 D283	V278-T281 WeakPolarHBondContact CB-OG1 3.38Å; V278-T281 HydrophobicContact CG1-CG2 4.42Å; V278-T281 WeakPolarHBondContact CG1-OG1 3.47Å; V278-T281 PolarHBondContact O-N 2.92Å; T281-D283 PolarHBondContact O-N 3.01Å; T281-D283 WeakPolarHBondContact OG1-CB 3.46Å; T281-D283 PolarHBondContact OG1-N 2.88Å
282	V	93.8	Very high	97	Very high	28 Å²	28	42.8 Å²	42.8	17%	0.17	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.8	27.3	-172	-157.8	0	0	0	0	111.6	Y277 V278 D285 M365 W402	Y277-V282 HydrophobicContact CE2-CG1 4.34Å; V278-V282 WeakPolarHBondContact O-CA 3.45Å; V278-V282 PolarHBondContact O-N 3.43Å; V282-D285 HydrophobicContact CG1-CB 3.77Å; V282-D285 WeakPolarHBondContact CG1-OD2 3.26Å; V282-D285 WeakPolarHBondContact O-CB 3.06Å; V282-M365 VanDerWaalsContact C-CE 3.46Å; V282-M365 WeakPolarHBondContact O-CE 3.32Å; V282-W402 HydrophobicContact CB-CG 4.21Å; V282-W402 HydrophobicContact CG1-CB 4.41Å; V282-W402 HydrophobicContact CG1-CG 4.2Å; V282-W402 HydrophobicContact CG2-CG 4.29Å
283	D	96.9	Very high	97	Very high	26 Å²	26	44.5 Å²	44.5	14%	0.139	25%	0.254	C	S	.	.	B	Isolated β-bridge	trans	-77.6	146.5	175.4	-164.5	35.2	0	0	0	111.5	Y277 V278 T281 D285 T362 N364 M365	Y277-D283 WeakPolarHBondContact CA-O 3.47Å; Y277-D283 VanDerWaalsContact CD2-O 3.31Å; Y277-D283 WeakPolarHBondContact CD2-O 3.34Å; V278-D283 PolarHBondContact N-O 2.54Å; V278-D283 PolarHBondContact O-N 3.33Å; T281-D283 PolarHBondContact O-N 3.01Å; T281-D283 WeakPolarHBondContact OG1-CB 3.46Å; T281-D283 PolarHBondContact OG1-N 2.88Å; D283-D285 VanDerWaalsContact C-N 3.27Å; D283-D285 PolarHBondContact O-N 2.86Å; D283-T362 HydrophobicContact CB-CG2 3.98Å; D283-T362 WeakPolarHBondContact OD1-CB 3.45Å; D283-T362 WeakPolarHBondContact OD1-CG2 3.35Å; D283-T362 PolarHBondContact OD1-OG1 3.33Å; D283-N364 WeakPolarHBondContact OD1-CB 3.44Å; D283-N364 PolarHBondContact OD1-ND2 3.33Å; D283-N364 VanDerWaalsContact OD1-ND2 3.11Å; D283-N364 PolarHBondContact OD2-ND2 2.04Å; D283-M365 HydrophobicContact CB-CE 3.85Å
284	N	97.8	Very high	97	Very high	18 Å²	18	44.7 Å²	44.7	10%	0.096	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.9	40.3	-171.6	-47	-70	0	0	0	114	H274 N276 I286 N364 Y421	H274-N284 HydrophobicContact CB-CB 4.37Å; N276-N284 PolarHBondContact O-ND2 2.86Å; N284-I286 PolarHBondContact O-N 3.16Å; N284-N364 PolarHBondContact OD1-ND2 3.21Å; N284-Y421 VanDerWaalsContact CA-OH 3.26Å; N284-Y421 WeakPolarHBondContact CA-OH 3.43Å; N284-Y421 HydrophobicContact CB-CE1 4.27Å; N284-Y421 PolarHBondContact OD1-OH 2.84Å
285	D	98	Very high	96.9	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.005	26%	0.258	C	S	.	.			trans	-78.5	72.3	178.7	-171.2	31.3	0	0	0	112	S236 H237 Y277 V282 D283 S401 T416	S236-D285 WeakPolarHBondContact CA-OD1 3.34Å; S236-D285 PolarHBondContact N-OD1 2.99Å; H237-D285 IonicContact CE1-OD2 3.12Å; H237-D285 IonicContact CG-OD1 3.54Å; H237-D285 IonicContact CG-OD2 2.75Å; H237-D285 PolarHBondContact N-OD1 2.02Å; H237-D285 IonicContact ND1-OD1 2.6Å; H237-D285 PolarHBondContact ND1-OD1 3.12Å; H237-D285 IonicContact ND1-OD2 2.72Å; H237-D285 PolarHBondContact ND1-OD2 2.72Å; Y277-D285 HydrophobicContact CD2-CB 4.14Å; Y277-D285 HydrophobicContact CE2-CB 3.84Å; V282-D285 HydrophobicContact CG1-CB 3.77Å; V282-D285 WeakPolarHBondContact CG1-OD2 3.26Å; V282-D285 WeakPolarHBondContact O-CB 3.06Å; D283-D285 VanDerWaalsContact C-N 3.27Å; D283-D285 PolarHBondContact O-N 2.86Å; D285-S401 WeakPolarHBondContact CB-OG 3.4Å; D285-S401 WeakPolarHBondContact OD2-CB 3.04Å; D285-S401 PolarHBondContact OD2-OG 2.86Å; D285-T416 PolarHBondContact O-OG1 2.91Å
286	I	98.6	Very high	96.9	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	27%	0.266	C	S	.	.			trans	-144.3	133.2	176.8	-174.5	168	0	0	0	110	L233 T234 S236 H274 N284 I399 T416 Y421 W424 I425	L233-I286 HydrophobicContact CD2-CD1 4.32Å; T234-I286 WeakPolarHBondContact O-CA 3.5Å; S236-I286 VanDerWaalsContact OG-C 3.23Å; S236-I286 PolarHBondContact OG-N 2.83Å; S236-I286 PolarHBondContact OG-O 3.3Å; H274-I286 HydrophobicContact CB-CG2 3.84Å; H274-I286 VanDerWaalsContact CB-O 3.25Å; H274-I286 WeakPolarHBondContact CB-O 3.44Å; H274-I286 PolarHBondContact N-O 3.02Å; H274-I286 VanDerWaalsContact N-O 3.08Å; N284-I286 PolarHBondContact O-N 3.16Å; I286-I399 HydrophobicContact CB-CD1 4.48Å; I286-I399 HydrophobicContact CD1-CD1 3.74Å; I286-I399 HydrophobicContact CG1-CD1 3.7Å; I286-T416 HydrophobicContact CB-CG2 4.14Å; I286-Y421 HydrophobicContact CD1-CD2 4.18Å; I286-Y421 HydrophobicContact CD1-CG 4.04Å; I286-Y421 HydrophobicContact CG2-CD1 3.67Å; I286-Y421 HydrophobicContact CG2-CD2 4.16Å; I286-Y421 HydrophobicContact CG2-CE1 3.81Å; I286-Y421 HydrophobicContact CG2-CE2 4.3Å; I286-Y421 HydrophobicContact CG2-CG 3.86Å; I286-W424 HydrophobicContact CD1-CZ3 4.42Å; I286-W424 HydrophobicContact CG1-CZ3 4.15Å; I286-W424 HydrophobicContact CG2-CZ3 4.36Å; I286-I425 HydrophobicContact CD1-CD1 4.07Å; I286-I425 HydrophobicContact CD1-CG1 4.39Å
287	G	98.3	Very high	96.8	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	157.1	178.9	0	0	0	0	0	112.2	T234 I272	T234-G287 PolarHBondContact N-O 2.95Å; T234-G287 PolarHBondContact O-N 2.94Å; I272-G287 CarbonylContact O-C 3.36Å; I272-G287 VanDerWaalsContact O-CA 3.31Å; I272-G287 WeakPolarHBondContact O-CA 3.03Å
288	L	98.6	Very high	96.7	Very high	0 Å²	0	42 Å²	42	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	141.5	173.4	-79.3	165.1	0	0	0	109.8	W231 I232 L233 I272 W424 R428 T429	W231-L288 HydrophobicContact CE3-CB 4.39Å; W231-L288 HydrophobicContact CE3-CD2 4.35Å; W231-L288 HydrophobicContact CZ3-CB 4.37Å; I232-L288 CarbonylContact O-C 3.53Å; I232-L288 WeakPolarHBondContact O-CA 3.36Å; L233-L288 HydrophobicContact CD2-CD2 3.43Å; L233-L288 VanDerWaalsContact CD2-CD2 3.43Å; L233-L288 HydrophobicContact CD2-CG 4.05Å; L233-L288 HydrophobicContact CG-CD2 4.06Å; I272-L288 HydrophobicContact CB-CB 4.16Å; I272-L288 PolarHBondContact N-O 3.28Å; I272-L288 PolarHBondContact O-N 3.44Å; L288-W424 HydrophobicContact CB-CH2 4.26Å; L288-W424 HydrophobicContact CD1-CE3 4.23Å; L288-W424 HydrophobicContact CD1-CH2 3.73Å; L288-W424 HydrophobicContact CD1-CZ2 4.46Å; L288-W424 HydrophobicContact CD1-CZ3 3.6Å; L288-W424 HydrophobicContact CG-CH2 3.84Å; L288-W424 HydrophobicContact CG-CZ3 3.75Å; L288-R428 HydrophobicContact CD1-CB 3.59Å; L288-R428 HydrophobicContact CD1-CG 4.32Å; L288-T429 HydrophobicContact CD1-CG2 3.92Å; L288-T429 HydrophobicContact CD2-CG2 3.99Å
289	L	98.7	Very high	96.7	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	129.9	169.7	-57.6	175.8	0	0	0	109.2	L214 W231 I232 T234 L239 L247 V249 V268 E270 I271	L214-L289 HydrophobicContact CD1-CD1 4.21Å; L214-L289 HydrophobicContact CD2-CD1 3.73Å; W231-L289 WeakPolarHBondContact CA-O 3.39Å; I232-L289 HydrophobicContact CB-CB 4.19Å; I232-L289 PolarHBondContact N-O 3.22Å; I232-L289 PolarHBondContact O-N 3.07Å; T234-L289 HydrophobicContact CG2-CD1 4.28Å; T234-L289 HydrophobicContact CG2-CG 4.31Å; L239-L289 HydrophobicContact CD1-CD2 4.01Å; L239-L289 HydrophobicContact CD2-CD1 4.25Å; L239-L289 HydrophobicContact CD2-CD2 3.58Å; L239-L289 HydrophobicContact CD2-CG 4.23Å; L239-L289 HydrophobicContact CG-CD2 4.43Å; L247-L289 HydrophobicContact CD2-CD1 4.19Å; L247-L289 HydrophobicContact CD2-CD2 3.93Å; V249-L289 HydrophobicContact CG2-CD1 4.13Å; V268-L289 HydrophobicContact CG1-CB 4.23Å; V268-L289 HydrophobicContact CG1-CD2 3.99Å; V268-L289 HydrophobicContact CG2-CB 4.41Å; V268-L289 HydrophobicContact CG2-CD1 4.18Å; E270-L289 WeakPolarHBondContact O-CA 3.49Å; I271-L289 HydrophobicContact CB-CD2 4.24Å; I271-L289 HydrophobicContact CG1-CD2 3.72Å; I271-L289 HydrophobicContact CG2-CD2 4.31Å
290	R	98.3	Very high	96.9	Very high	104 Å²	104	42.2 Å²	42.2	39%	0.392	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	130	168.5	-163.8	168.2	62.8	106.7	-3.1	109.7	T230 W231 V269 E270	T230-R290 WeakPolarHBondContact O-CA 3.48Å; W231-R290 HydrophobicContact CE3-CB 4.11Å; W231-R290 HydrophobicContact CE3-CG 4.42Å; W231-R290 HydrophobicContact CH2-CB 3.99Å; W231-R290 HydrophobicContact CH2-CG 4.03Å; W231-R290 HydrophobicContact CZ2-CG 4.13Å; W231-R290 HydrophobicContact CZ3-CB 3.72Å; W231-R290 HydrophobicContact CZ3-CG 4.17Å; V269-R290 HydrophobicContact CG2-CB 4.05Å; V269-R290 HydrophobicContact CG2-CG 4.09Å; V269-R290 VanDerWaalsContact CG2-O 3.31Å; V269-R290 WeakPolarHBondContact CG2-O 3.13Å; V269-R290 PolarHBondContact N-O 2.75Å; E270-R290 HydrophobicContact CB-CB 3.77Å; E270-R290 PolarHBondContact N-O 2.97Å; E270-R290 PolarHBondContact O-N 3.34Å; E270-R290 IonicContact OE2-CZ 3.74Å; E270-R290 IonicContact OE2-NE 2.69Å; E270-R290 PolarHBondContact OE2-NE 2.83Å; E270-R290 IonicContact OE2-NH2 3.91Å; E270-R290 PolarHBondContact OE2-NH2 3.32Å
291	L	98.5	Very high	97.1	Very high	5 Å²	5	37 Å²	37	3%	0.026	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	148.9	-179.6	-56.9	-175.9	0	0	0	111.9	T230 I232 V249 I266 V268 S293 I295	T230-L291 PolarHBondContact O-N 2.87Å; I232-L291 HydrophobicContact CD1-CD1 4.28Å; I232-L291 HydrophobicContact CG1-CD1 4.06Å; I232-L291 HydrophobicContact CG1-CD2 4.05Å; I232-L291 HydrophobicContact CG1-CG 4.22Å; V249-L291 HydrophobicContact CB-CD2 3.94Å; V249-L291 HydrophobicContact CG1-CD2 4.47Å; V249-L291 HydrophobicContact CG2-CD2 3.74Å; I266-L291 HydrophobicContact CD1-CD1 4.21Å; I266-L291 HydrophobicContact CG2-CB 3.84Å; I266-L291 HydrophobicContact CG2-CD1 4.24Å; I266-L291 HydrophobicContact CG2-CD2 4.32Å; I266-L291 HydrophobicContact CG2-CG 4.36Å; V268-L291 HydrophobicContact CG2-CD2 4.3Å; L291-S293 VanDerWaalsContact C-N 3.29Å; L291-S293 WeakPolarHBondContact CB-O 3.44Å; L291-S293 PolarHBondContact O-N 2.9Å; L291-I295 HydrophobicContact CD1-CD1 3.67Å; L291-I295 HydrophobicContact CD1-CG1 3.74Å
292	A	98	Very high	97.4	Very high	61 Å²	61	33.5 Å²	33.5	50%	0.504	19%	0.187	S	C	.	.	S	Bend	trans	-65.1	-33.6	176	0	0	0	0	0	112.9	Q267 V269	Q267-A292 HydrophobicContact CB-CB 4.02Å; Q267-A292 WeakPolarHBondContact O-CB 3.26Å; Q267-A292 PolarHBondContact O-N 2.89Å; V269-A292 HydrophobicContact CG1-CB 3.55Å
293	S	98.1	Very high	97.6	Very high	57 Å²	57	32.6 Å²	32.6	40%	0.399	18%	0.182	S	C	.	.	S	Bend	trans	-137.9	150.9	180	59.2	0	0	0	0	109.7	I266 L291	I266-S293 WeakPolarHBondContact CG2-OG 3.27Å; L291-S293 VanDerWaalsContact C-N 3.29Å; L291-S293 WeakPolarHBondContact CB-O 3.44Å; L291-S293 PolarHBondContact O-N 2.9Å
294	P	98.1	Very high	97.7	Very high	78 Å²	78	31.4 Å²	31.4	51%	0.506	18%	0.175	S	C	.	.			trans	-66.5	142.6	176.9	28.4	-34.2	0	0	0	111.1	P229 T230 V296	P229-P294 HydrophobicContact CB-CB 3.72Å; P229-P294 CarbonylContact O-C 3.41Å; P229-P294 WeakPolarHBondContact O-CA 3.27Å; T230-P294 HydrophobicContact CG2-CB 3.94Å; P294-V296 PolarHBondContact O-N 3.23Å
295	I	98.1	Very high	97.7	Very high	6 Å²	6	30.6 Å²	30.6	3%	0.031	17%	0.171	C	C	.	.			trans	-63.9	129.4	164.4	-67.5	164.3	0	0	0	108	I226 P229 I232 A251 I266 L291 Y297 A301	I226-I295 HydrophobicContact CD1-CD1 4.12Å; I226-I295 HydrophobicContact CG1-CD1 4.02Å; I226-I295 HydrophobicContact CG2-CD1 4.03Å; P229-I295 PolarHBondContact O-N 3.05Å; I232-I295 HydrophobicContact CD1-CD1 3.8Å; A251-I295 HydrophobicContact CB-CD1 4.09Å; A251-I295 HydrophobicContact CB-CG1 4.36Å; A251-I295 HydrophobicContact CB-CG2 4.31Å; I266-I295 HydrophobicContact CD1-CB 4.24Å; I266-I295 HydrophobicContact CD1-CD1 4.49Å; I266-I295 HydrophobicContact CD1-CG1 3.36Å; L291-I295 HydrophobicContact CD1-CD1 3.67Å; L291-I295 HydrophobicContact CD1-CG1 3.74Å; I295-Y297 HydrophobicContact CG2-CD1 4.14Å; I295-Y297 HydrophobicContact CG2-CE1 4.42Å; I295-Y297 PolarHBondContact O-N 3.34Å; I295-A301 HydrophobicContact CG2-CB 4.01Å
296	V	97.1	Very high	97.7	Very high	103 Å²	103	31.6 Å²	31.6	62%	0.624	18%	0.176	S	C	*	.			trans	-79.8	112.9	169.8	-177.4	0	0	0	0	107.6	Q264 P294 S298	Q264-V296 PolarHBondContact NE2-O 2.74Å; Q264-V296 PolarHBondContact OE1-O 3.08Å; P294-V296 PolarHBondContact O-N 3.23Å; V296-S298 PolarHBondContact O-N 3.47Å
297	Y	95.8	Very high	97.7	Very high	68 Å²	68	31.9 Å²	31.9	27%	0.267	18%	0.178	S	C	.	.			trans	-63.9	136.2	179.6	-66	-24.3	0	0	0	111.7	I177 I226 K228 P229 I295 A301 P303	I177-Y297 VanDerWaalsContact CD1-C 3.49Å; I177-Y297 HydrophobicContact CG2-CD2 4.49Å; I177-Y297 HydrophobicContact CG2-CG 4.44Å; I226-Y297 HydrophobicContact CG2-CE1 4.11Å; K228-Y297 VanDerWaalsContact C-OH 3.31Å; P229-Y297 WeakPolarHBondContact CD-OH 3.05Å; P229-Y297 HydrophobicContact CG-CE1 4.43Å; P229-Y297 HydrophobicContact CG-CE2 4.06Å; P229-Y297 WeakPolarHBondContact CG-OH 3.25Å; P229-Y297 VanDerWaalsContact N-OH 3.09Å; I295-Y297 HydrophobicContact CG2-CD1 4.14Å; I295-Y297 HydrophobicContact CG2-CE1 4.42Å; I295-Y297 PolarHBondContact O-N 3.34Å; Y297-A301 VanDerWaalsContact CA-O 3.29Å; Y297-A301 WeakPolarHBondContact CA-O 3.44Å; Y297-P303 HydrophobicContact CE1-CB 4.43Å; Y297-P303 HydrophobicContact CE1-CG 4.11Å; Y297-P303 HydrophobicContact CE2-CG 3.79Å; Y297-P303 WeakPolarHBondContact OH-CG 3.49Å
298	S	95.6	Very high	97.6	Very high	26 Å²	26	33.7 Å²	33.7	18%	0.182	19%	0.189	C	C	.	.	B	Isolated β-bridge	trans	-145.4	170.9	-179.5	81	0	0	0	0	109.3	V296 Y300 A301 V302	V296-S298 PolarHBondContact O-N 3.47Å; S298-Y300 PolarHBondContact O-N 3.09Å; S298-Y300 PolarHBondContact OG-N 3.14Å; S298-Y300 VanDerWaalsContact OG-N 3.16Å; S298-A301 PolarHBondContact N-O 2.69Å; S298-A301 CarbonylContact O-C 3.34Å; S298-A301 PolarHBondContact O-N 3.03Å; S298-A301 VanDerWaalsContact O-O 3.1Å; S298-A301 PolarHBondContact OG-N 2.66Å; S298-V302 WeakPolarHBondContact O-CG2 3.24Å
299	P	95.5	Very high	97.4	Very high	41 Å²	41	39.8 Å²	39.8	27%	0.266	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55	-14.2	172	-27.9	37.3	0	0	0	115.1	P183 V184	P183-P299 HydrophobicContact CB-CB 4.14Å; V184-P299 HydrophobicContact CG1-CB 4.02Å
300	Y	96.8	Very high	97.2	Very high	82 Å²	82	42.3 Å²	42.3	32%	0.322	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.9	-8.9	-178.9	-48.9	-75.6	0	0	0	113.2	V184 K205 P209 G252 T262 S298	V184-Y300 HydrophobicContact CG1-CE1 4.09Å; K205-Y300 HydrophobicContact CD-CE1 4.3Å; K205-Y300 HydrophobicContact CG-CD1 3.93Å; K205-Y300 HydrophobicContact CG-CE1 3.93Å; P209-Y300 WeakPolarHBondContact CA-O 3.49Å; G252-Y300 WeakPolarHBondContact CA-O 3.4Å; T262-Y300 HydrophobicContact CG2-CD1 4.46Å; T262-Y300 HydrophobicContact CG2-CD2 3.37Å; T262-Y300 HydrophobicContact CG2-CE2 3.65Å; T262-Y300 HydrophobicContact CG2-CG 3.82Å; S298-Y300 PolarHBondContact O-N 3.09Å; S298-Y300 PolarHBondContact OG-N 3.14Å; S298-Y300 VanDerWaalsContact OG-N 3.16Å
301	A	97.8	Very high	97.1	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.21	C	C	.	.	B	Isolated β-bridge	trans	-137	96.6	-180	0	0	0	0	0	109.6	P209 I226 A251 I295 Y297 S298	P209-A301 VanDerWaalsContact O-CA 3.29Å; P209-A301 WeakPolarHBondContact O-CA 3.12Å; I226-A301 HydrophobicContact CD1-CB 4.25Å; A251-A301 HydrophobicContact CB-CB 4.35Å; I295-A301 HydrophobicContact CG2-CB 4.01Å; Y297-A301 VanDerWaalsContact CA-O 3.29Å; Y297-A301 WeakPolarHBondContact CA-O 3.44Å; S298-A301 PolarHBondContact N-O 2.69Å; S298-A301 CarbonylContact O-C 3.34Å; S298-A301 PolarHBondContact O-N 3.03Å; S298-A301 VanDerWaalsContact O-O 3.1Å; S298-A301 PolarHBondContact OG-N 2.66Å
302	V	97.3	Very high	97	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.209	C	C	.	.			trans	-132	137.6	-173.3	177.8	0	0	0	0	108.9	I177 A178 P183 P209 W210 S298	I177-V302 HydrophobicContact CG2-CB 4.06Å; I177-V302 HydrophobicContact CG2-CG1 3.67Å; I177-V302 HydrophobicContact CG2-CG2 3.63Å; A178-V302 WeakPolarHBondContact O-CG1 3.33Å; P183-V302 HydrophobicContact CG-CG2 4.04Å; P209-V302 HydrophobicContact CB-CB 3.86Å; P209-V302 HydrophobicContact CB-CG2 3.8Å; P209-V302 HydrophobicContact CG-CB 3.8Å; P209-V302 HydrophobicContact CG-CG2 3.95Å; P209-V302 PolarHBondContact O-N 3.25Å; W210-V302 WeakPolarHBondContact CA-O 3.37Å; W210-V302 VanDerWaalsContact CB-O 3.28Å; W210-V302 WeakPolarHBondContact CB-O 3.36Å; W210-V302 PolarHBondContact N-O 3.11Å; S298-V302 WeakPolarHBondContact O-CG2 3.24Å
303	P	97.9	Very high	96.7	Very high	8 Å²	8	36.8 Å²	36.8	5%	0.052	20%	0.197	C	C	.	.	P	Polyproline II helix	trans	-68.6	149	177	28.3	-32.1	0	0	0	111.5	C179 G180 I226 Y227 Y297	C179-P303 CarbonylContact C-O 3.56Å; C179-P303 WeakPolarHBondContact CA-O 3.25Å; C179-P303 HydrophobicContact CB-CB 4.43Å; C179-P303 HydrophobicContact CB-CG 4.13Å; G180-P303 PolarHBondContact N-O 2.94Å; I226-P303 HydrophobicContact CG2-CB 4.09Å; I226-P303 CarbonylContact O-C 3.6Å; I226-P303 WeakPolarHBondContact O-CA 3.3Å; Y227-P303 VanDerWaalsContact O-CB 3.29Å; Y227-P303 WeakPolarHBondContact O-CB 3.4Å; Y297-P303 HydrophobicContact CE1-CB 4.43Å; Y297-P303 HydrophobicContact CE1-CG 4.11Å; Y297-P303 HydrophobicContact CE2-CG 3.79Å; Y297-P303 WeakPolarHBondContact OH-CG 3.49Å
304	I	98.5	Very high	96.4	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.005	19%	0.19	C	C	.	.	P	Polyproline II helix	trans	-81.4	147.4	168.9	-163.7	61.4	0	0	0	110.3	W210 V225 I226 V387 H394 L396	W210-I304 HydrophobicContact CB-CB 3.94Å; W210-I304 HydrophobicContact CD2-CD1 3.65Å; W210-I304 HydrophobicContact CE3-CD1 3.74Å; W210-I304 HydrophobicContact CG-CB 4.17Å; W210-I304 HydrophobicContact CG-CD1 4.02Å; W210-I304 HydrophobicContact CG-CG1 4.49Å; W210-I304 HydrophobicContact CZ2-CD1 4.48Å; W210-I304 HydrophobicContact CZ3-CD1 4.19Å; V225-I304 HydrophobicContact CG1-CB 3.93Å; V225-I304 HydrophobicContact CG1-CG2 3.46Å; V225-I304 VanDerWaalsContact CG1-CG2 3.46Å; I226-I304 PolarHBondContact O-N 3.4Å; I304-V387 HydrophobicContact CD1-CG1 3.86Å; I304-V387 HydrophobicContact CD1-CG2 4.08Å; I304-H394 HydrophobicContact CD1-CB 3.84Å; I304-H394 VanDerWaalsContact CD1-O 3.28Å; I304-H394 WeakPolarHBondContact CD1-O 3.39Å; I304-L396 HydrophobicContact CG1-CB 3.82Å; I304-L396 HydrophobicContact CG2-CB 3.88Å; I304-L396 HydrophobicContact CG2-CD2 4.26Å
305	C	98.3	Very high	96.2	Very high	2 Å²	2	34.5 Å²	34.5	1%	0.014	17%	0.171	C	C	.	.	B	Isolated β-bridge	trans	-76.9	141.6	169.3	-60.8	0	0	0	0	110.8	A159 C179 T393 H394 F395 L396	A159-C305 HydrophobicContact CB-CB 4.21Å; C179-C305 HydrophobicContact CB-CB 4.04Å; C179-C305 WeakPolarHBondContact CB-SG 3.46Å; C179-C305 PolarHBondContact O-SG 2.89Å; C179-C305 WeakPolarHBondContact SG-CA 3.33Å; C179-C305 WeakPolarHBondContact SG-CB 3.37Å; C179-C305 CovalentContact SG-SG 2.04Å; C179-C305 PolarHBondContact SG-SG 2.99Å; C305-T393 HydrophobicContact CB-CG2 4.35Å; C305-T393 WeakPolarHBondContact SG-CG2 3.38Å; C305-H394 WeakPolarHBondContact CB-O 3.46Å; C305-H394 PolarHBondContact N-O 3.43Å; C305-F395 HydrophobicContact CB-CD1 3.47Å; C305-F395 VanDerWaalsContact CB-CD1 3.47Å; C305-F395 HydrophobicContact CB-CE1 3.54Å; C305-F395 HydrophobicContact CB-CG 4.22Å; C305-F395 HydrophobicContact CB-CZ 4.34Å; C305-F395 WeakPolarHBondContact O-CA 3.31Å; C305-L396 PolarHBondContact O-N 2.89Å
306	L	98.3	Very high	96.1	Very high	22 Å²	22	34.2 Å²	34.2	12%	0.115	17%	0.169	C	C	.	.	P	Polyproline II helix	trans	-90.4	136.2	163.9	-64.1	-174.1	0	0	0	109.6	Y227 L233 L396 V418 L422 I425	Y227-L306 HydrophobicContact CD2-CD1 3.76Å; Y227-L306 HydrophobicContact CD2-CG 3.78Å; Y227-L306 HydrophobicContact CE1-CD1 4.29Å; Y227-L306 HydrophobicContact CE2-CD1 3.33Å; Y227-L306 HydrophobicContact CE2-CG 3.62Å; Y227-L306 HydrophobicContact CG-CD1 4.41Å; L233-L306 HydrophobicContact CD1-CD2 4.08Å; L306-L396 HydrophobicContact CD2-CB 4.01Å; L306-L396 HydrophobicContact CD2-CD2 3.99Å; L306-V418 HydrophobicContact CD2-CG1 4.02Å; L306-L422 HydrophobicContact CB-CD2 4.09Å; L306-L422 HydrophobicContact CD1-CD2 4.35Å; L306-I425 HydrophobicContact CD1-CB 4.46Å; L306-I425 HydrophobicContact CD1-CD1 4.11Å; L306-I425 HydrophobicContact CD1-CG2 3.82Å
307	P	97.7	Very high	96	Very high	6 Å²	6	31.9 Å²	31.9	4%	0.039	15%	0.149	C	C	.	.	P	Polyproline II helix	trans	-79.2	161.9	176	34	-35.8	0	0	0	111.2	L311 A312 L316 F395 L396 L422	P307-L311 HydrophobicContact CB-CB 4.47Å; P307-L311 HydrophobicContact CB-CD2 4.01Å; P307-L311 HydrophobicContact CB-CG 4.36Å; P307-A312 HydrophobicContact CB-CB 4.01Å; P307-A312 HydrophobicContact CG-CB 3.76Å; P307-L316 HydrophobicContact CB-CD1 3.75Å; P307-L316 HydrophobicContact CG-CD1 4.08Å; P307-F395 HydrophobicContact CB-CB 4.41Å; P307-F395 HydrophobicContact CB-CD1 4.06Å; P307-F395 HydrophobicContact CB-CG 4.49Å; P307-L396 VanDerWaalsContact CD-O 3.28Å; P307-L396 WeakPolarHBondContact CD-O 3.41Å; P307-L422 WeakPolarHBondContact O-CD1 3.4Å; P307-L422 WeakPolarHBondContact O-CD2 3.31Å
308	T	96.7	Very high	95.8	Very high	37 Å²	37	32.2 Å²	32.2	23%	0.227	17%	0.166	C	C	.	.	P	Polyproline II helix	trans	-74.1	160.6	158.1	60.5	0	0	0	0	109.9	F144 L311 A312	F144-T308 HydrophobicContact CB-CG2 4.12Å; F144-T308 HydrophobicContact CD1-CG2 3.65Å; F144-T308 HydrophobicContact CD2-CG2 3.98Å; F144-T308 HydrophobicContact CE1-CG2 4.04Å; F144-T308 HydrophobicContact CE2-CG2 4.3Å; F144-T308 HydrophobicContact CG-CG2 3.64Å; F144-T308 HydrophobicContact CZ-CG2 4.33Å; T308-L311 PolarHBondContact O-N 3.27Å; T308-L311 WeakPolarHBondContact OG1-CB 3.48Å; T308-L311 PolarHBondContact OG1-N 2.91Å; T308-A312 WeakPolarHBondContact O-CB 3.46Å; T308-A312 PolarHBondContact O-N 3.26Å
309	R	94.9	Very high	95.8	Very high	128 Å²	128	33 Å²	33	48%	0.483	17%	0.17	S	C	.	.	H	α-helix	trans	-59.4	-46.1	178.6	-176	178.7	-175.4	136.4	13.4	112.8	A312 E313 L422	R309-A312 PolarHBondContact O-N 3.45Å; R309-E313 HydrophobicContact CG-CG 4.24Å; R309-E313 WeakPolarHBondContact CG-OE2 3.34Å; R309-E313 IonicContact CZ-OE1 3.51Å; R309-E313 IonicContact CZ-OE2 3.35Å; R309-E313 IonicContact NE-OE1 3.29Å; R309-E313 IonicContact NE-OE2 3.78Å; R309-E313 PolarHBondContact NE-OE2 3.23Å; R309-E313 IonicContact NH2-OE1 2.74Å; R309-E313 PolarHBondContact NH2-OE1 2.62Å; R309-E313 IonicContact NH2-OE2 3.76Å; R309-E313 PolarHBondContact NH2-OE2 3.22Å; R309-E313 PolarHBondContact O-N 2.86Å; R309-L422 HydrophobicContact CB-CD1 4.41Å
310	P	93.6	Very high	95.6	Very high	54 Å²	54	37.6 Å²	37.6	35%	0.351	19%	0.192	S	C	.	.	H	α-helix	trans	-58	-49.4	175.3	-25.4	35.9	0	0	0	112.3	A312 E313 R314	P310-A312 VanDerWaalsContact C-N 3.3Å; P310-A312 PolarHBondContact O-N 3.35Å; P310-E313 PolarHBondContact O-N 3.2Å; P310-R314 WeakPolarHBondContact O-CB 3.47Å; P310-R314 PolarHBondContact O-N 2.96Å
311	L	95.6	Very high	95.4	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.195	C	C	.	.	I	π-helix	trans	-57	-45.5	178.2	178.2	66.9	0	0	0	111.3	H143 F144 P307 T308 D315 L316 F390 F395	H143-L311 WeakPolarHBondContact O-CD1 3.48Å; F144-L311 HydrophobicContact CD1-CB 4.41Å; F144-L311 HydrophobicContact CD1-CD2 3.67Å; F144-L311 HydrophobicContact CE1-CD2 3.68Å; P307-L311 HydrophobicContact CB-CB 4.47Å; P307-L311 HydrophobicContact CB-CD2 4.01Å; P307-L311 HydrophobicContact CB-CG 4.36Å; T308-L311 PolarHBondContact O-N 3.27Å; T308-L311 WeakPolarHBondContact OG1-CB 3.48Å; T308-L311 PolarHBondContact OG1-N 2.91Å; L311-D315 HydrophobicContact CD1-CB 3.88Å; L311-D315 PolarHBondContact O-N 3.11Å; L311-D315 VanDerWaalsContact O-N 3.08Å; L311-L316 HydrophobicContact CD1-CD2 4.42Å; L311-L316 HydrophobicContact CG-CD1 4.49Å; L311-L316 HydrophobicContact CG-CD2 4.33Å; L311-L316 HydrophobicContact CG-CG 4.1Å; L311-L316 WeakPolarHBondContact O-CG 3.37Å; L311-L316 PolarHBondContact O-N 2.64Å; L311-F390 HydrophobicContact CD1-CD1 3.98Å; L311-F390 HydrophobicContact CD1-CE1 3.79Å; L311-F390 HydrophobicContact CD1-CG 4.47Å; L311-F390 HydrophobicContact CD1-CZ 4.13Å; L311-F395 HydrophobicContact CD2-CD1 4.23Å; L311-F395 HydrophobicContact CD2-CD2 4.5Å; L311-F395 HydrophobicContact CD2-CE1 3.99Å; L311-F395 HydrophobicContact CD2-CE2 4.26Å; L311-F395 HydrophobicContact CD2-CG 4.48Å; L311-F395 HydrophobicContact CD2-CZ 4Å
312	A	96.6	Very high	95.3	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.195	C	C	.	.	I	π-helix	trans	-64.1	-48.5	-178.7	0	0	0	0	0	113	P307 T308 R309 P310 W317	P307-A312 HydrophobicContact CB-CB 4.01Å; P307-A312 HydrophobicContact CG-CB 3.76Å; T308-A312 WeakPolarHBondContact O-CB 3.46Å; T308-A312 PolarHBondContact O-N 3.26Å; R309-A312 PolarHBondContact O-N 3.45Å; P310-A312 VanDerWaalsContact C-N 3.3Å; P310-A312 PolarHBondContact O-N 3.35Å; A312-W317 VanDerWaalsContact O-CG 3.23Å; A312-W317 PolarHBondContact O-N 3.2Å
313	E	92.7	Very high	95.1	Very high	53 Å²	53	38.7 Å²	38.7	25%	0.248	20%	0.204	C	C	.	.	I	π-helix	trans	-86.6	-21.8	-170.2	-61.3	-169.5	144.3	0	0	113.3	R309 P310 W317 R417 S419	R309-E313 HydrophobicContact CG-CG 4.24Å; R309-E313 WeakPolarHBondContact CG-OE2 3.34Å; R309-E313 IonicContact CZ-OE1 3.51Å; R309-E313 IonicContact CZ-OE2 3.35Å; R309-E313 IonicContact NE-OE1 3.29Å; R309-E313 IonicContact NE-OE2 3.78Å; R309-E313 PolarHBondContact NE-OE2 3.23Å; R309-E313 IonicContact NH2-OE1 2.74Å; R309-E313 PolarHBondContact NH2-OE1 2.62Å; R309-E313 IonicContact NH2-OE2 3.76Å; R309-E313 PolarHBondContact NH2-OE2 3.22Å; R309-E313 PolarHBondContact O-N 2.86Å; P310-E313 PolarHBondContact O-N 3.2Å; E313-W317 HydrophobicContact CB-CE3 4.44Å; E313-W317 VanDerWaalsContact O-CE3 3.23Å; E313-R417 IonicContact OE1-NH1 3.29Å; E313-R417 PolarHBondContact OE1-NH1 3.1Å; E313-R417 VanDerWaalsContact OE1-NH1 3.15Å; E313-S419 PolarHBondContact OE1-OG 3.18Å
314	R	90.8	Very high	94.9	Very high	68 Å²	68	38.5 Å²	38.5	26%	0.257	20%	0.203	S	C	.	.	I	π-helix	trans	-96.7	-61.2	177	-176.7	-176.5	59.4	-139.4	-4.4	111.7	C134 N138 P310	C134-R314 PolarHBondContact O-NE 2.75Å; C134-R314 PolarHBondContact O-NH1 3.02Å; C134-R314 PolarHBondContact O-NH2 3.15Å; N138-R314 PolarHBondContact OD1-NH2 3.24Å; P310-R314 WeakPolarHBondContact O-CB 3.47Å; P310-R314 PolarHBondContact O-N 2.96Å
315	D	94.6	Very high	94.7	Very high	19 Å²	19	38.6 Å²	38.6	10%	0.102	20%	0.204	C	C	.	.	I	π-helix	trans	-92.4	-49.1	-165	-50.4	-68.5	0	0	0	112.1	N138 L311 W317 A318 V319 F390	N138-D315 PolarHBondContact OD1-OD2 2.82Å; L311-D315 HydrophobicContact CD1-CB 3.88Å; L311-D315 PolarHBondContact O-N 3.11Å; L311-D315 VanDerWaalsContact O-N 3.08Å; D315-W317 VanDerWaalsContact C-N 3.26Å; D315-W317 PolarHBondContact O-N 2.97Å; D315-A318 WeakPolarHBondContact O-CB 3.41Å; D315-A318 PolarHBondContact O-N 2.62Å; D315-A318 VanDerWaalsContact O-N 3.13Å; D315-V319 PolarHBondContact O-N 3Å; D315-F390 HydrophobicContact CB-CD2 4.49Å; D315-F390 HydrophobicContact CB-CE2 3.78Å; D315-F390 HydrophobicContact CB-CZ 4.04Å
316	L	96.1	Very high	94.4	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-64.1	-35.1	179.7	-58.4	-171	0	0	0	111.6	P307 L311 A318 V319 H322 T388 F390 F395 L397	P307-L316 HydrophobicContact CB-CD1 3.75Å; P307-L316 HydrophobicContact CG-CD1 4.08Å; L311-L316 HydrophobicContact CD1-CD2 4.42Å; L311-L316 HydrophobicContact CG-CD1 4.49Å; L311-L316 HydrophobicContact CG-CD2 4.33Å; L311-L316 HydrophobicContact CG-CG 4.1Å; L311-L316 WeakPolarHBondContact O-CG 3.37Å; L311-L316 PolarHBondContact O-N 2.64Å; L316-A318 PolarHBondContact O-N 3.44Å; L316-V319 WeakPolarHBondContact O-CB 3Å; L316-V319 PolarHBondContact O-N 3.39Å; L316-H322 PolarHBondContact O-CE1 3Å; L316-H322 VanDerWaalsContact O-CE1 3.31Å; L316-T388 HydrophobicContact CB-CG2 4.17Å; L316-T388 HydrophobicContact CD2-CG2 3.99Å; L316-F390 HydrophobicContact CD2-CB 3.47Å; L316-F390 VanDerWaalsContact CD2-CB 3.47Å; L316-F390 HydrophobicContact CD2-CD2 3.99Å; L316-F390 HydrophobicContact CD2-CG 3.82Å; L316-F395 HydrophobicContact CD1-CB 3.62Å; L316-F395 HydrophobicContact CD1-CG 4.25Å; L316-F395 HydrophobicContact CD2-CD2 4.39Å; L316-L397 HydrophobicContact CB-CD1 4.21Å; L316-L397 HydrophobicContact CD1-CD1 4.49Å
317	W	94.4	Very high	94	Very high	54 Å²	54	38 Å²	38	21%	0.205	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-68.1	-20.6	176.8	-89.3	19.1	0	0	0	115.7	A312 E313 D315 R347	A312-W317 VanDerWaalsContact O-CG 3.23Å; A312-W317 PolarHBondContact O-N 3.2Å; E313-W317 HydrophobicContact CB-CE3 4.44Å; E313-W317 VanDerWaalsContact O-CE3 3.23Å; D315-W317 VanDerWaalsContact C-N 3.26Å; D315-W317 PolarHBondContact O-N 2.97Å; W317-R347 PolarHBondContact O-NE 3.3Å
318	A	92.8	Very high	93.1	Very high	75 Å²	75	38 Å²	38	62%	0.62	20%	0.201	S	C	*	.	G	3₁₀ helix	trans	-86.7	-12.2	175.9	0	0	0	0	0	112.2	D315 L316 D320	D315-A318 WeakPolarHBondContact O-CB 3.41Å; D315-A318 PolarHBondContact O-N 2.62Å; D315-A318 VanDerWaalsContact O-N 3.13Å; L316-A318 PolarHBondContact O-N 3.44Å; A318-D320 PolarHBondContact O-N 3.26Å
319	V	94.5	Very high	91.8	Very high	43 Å²	43	40.6 Å²	40.6	26%	0.261	21%	0.207	S	C	.	.			trans	-68.3	129.6	174.1	179.2	0	0	0	0	110	D315 L316 L321 H322 T388	D315-V319 PolarHBondContact O-N 3Å; L316-V319 WeakPolarHBondContact O-CB 3Å; L316-V319 PolarHBondContact O-N 3.39Å; V319-L321 PolarHBondContact O-N 3.45Å; V319-H322 PolarHBondContact O-CE1 2.76Å; V319-H322 VanDerWaalsContact O-CE1 3.3Å; V319-H322 PolarHBondContact O-NE2 3.34Å; V319-T388 HydrophobicContact CB-CG2 3.74Å; V319-T388 HydrophobicContact CG1-CG2 3.9Å; V319-T388 HydrophobicContact CG2-CG2 3.7Å
320	D	92	Very high	90.1	Very high	137 Å²	137	41.4 Å²	41.4	73%	0.733	21%	0.21	S	C	*	.	S	Bend	trans	-61	-39.9	-173.7	-67.1	-30.4	0	0	0	113.9	A318 P346	A318-D320 PolarHBondContact O-N 3.26Å; D320-P346 WeakPolarHBondContact O-CA 3.38Å
321	L	92.7	Very high	88.4	Confident	73 Å²	73	39.7 Å²	39.7	38%	0.382	20%	0.203	S	C	.	.			trans	-135.8	132.3	-171.1	-64.5	176.9	0	0	0	112	V319 K344 P346	V319-L321 PolarHBondContact O-N 3.45Å; L321-K344 HydrophobicContact CB-CB 4.31Å; L321-K344 HydrophobicContact CD1-CB 4.32Å; L321-K344 HydrophobicContact CD1-CD 4.25Å; L321-P346 HydrophobicContact CD2-CB 4.23Å
322	H	94.6	Very high	86.6	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	153.1	176.2	-44.9	-70.5	0	0	0	109.8	L316 V319 K344 V345 L386 V387 T388	L316-H322 PolarHBondContact O-CE1 3Å; L316-H322 VanDerWaalsContact O-CE1 3.31Å; V319-H322 PolarHBondContact O-CE1 2.76Å; V319-H322 VanDerWaalsContact O-CE1 3.3Å; V319-H322 PolarHBondContact O-NE2 3.34Å; H322-K344 CarbonylContact O-C 3.59Å; H322-K344 WeakPolarHBondContact O-CA 3.06Å; H322-V345 PolarHBondContact CD2-O 2.95Å; H322-V345 PolarHBondContact N-O 2.75Å; H322-V345 PolarHBondContact O-N 3.26Å; H322-L386 HydrophobicContact CB-CD1 3.8Å; H322-L386 HydrophobicContact CB-CD2 4.27Å; H322-L386 HydrophobicContact CB-CG 3.92Å; H322-V387 CarbonylContact C-O 3.52Å; H322-V387 WeakPolarHBondContact CA-O 3.42Å; H322-T388 PolarHBondContact ND1-OG1 3.25Å
323	T	94.4	Very high	85	Confident	33 Å²	33	49.9 Å²	49.9	20%	0.202	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	127.1	-179.1	-56.6	0	0	0	0	110.6	R342 T343 L386 V387	T323-R342 HydrophobicContact CG2-CB 4Å; T323-T343 CarbonylContact C-O 3.41Å; T323-T343 WeakPolarHBondContact CA-O 3.31Å; T323-L386 WeakPolarHBondContact O-CA 3.07Å; T323-V387 PolarHBondContact N-O 2.9Å; T323-V387 PolarHBondContact O-N 3.02Å
324	V	92.9	Very high	83.5	Confident	4 Å²	4	48.3 Å²	48.3	2%	0.024	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	140.7	168.7	-175.4	0	0	0	0	108.3	R342 T343 V345 P385 L386 V400 Y415	V324-R342 CarbonylContact O-C 3.54Å; V324-R342 WeakPolarHBondContact O-CA 3.18Å; V324-R342 WeakPolarHBondContact O-CB 3.19Å; V324-T343 HydrophobicContact CB-CG2 4.15Å; V324-T343 PolarHBondContact N-O 3.46Å; V324-T343 PolarHBondContact O-N 2.98Å; V324-V345 HydrophobicContact CG2-CG2 3.66Å; V324-P385 WeakPolarHBondContact CA-O 3.44Å; V324-L386 HydrophobicContact CG2-CB 4.4Å; V324-L386 HydrophobicContact CG2-CD1 3.34Å; V324-L386 HydrophobicContact CG2-CG 4.38Å; V324-V400 HydrophobicContact CG1-CG2 3.76Å; V324-Y415 HydrophobicContact CG2-CE1 3.91Å; V324-Y415 WeakPolarHBondContact CG2-OH 3.41Å
325	S	93.5	Very high	82.5	Confident	3 Å²	3	49.7 Å²	49.7	2%	0.021	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	152.1	175.7	54.5	0	0	0	0	112.8	Q211 R341 P385	Q211-S325 PolarHBondContact OE1-O 2.95Å; Q211-S325 VanDerWaalsContact OE1-O 3.04Å; Q211-S325 PolarHBondContact OE1-OG 3.18Å; S325-R341 WeakPolarHBondContact CA-O 3.41Å; S325-R341 WeakPolarHBondContact CB-O 3.28Å; S325-P385 WeakPolarHBondContact OG-CG 3.32Å
326	G	92.7	Very high	81.7	Confident	3 Å²	3	52.5 Å²	52.5	3%	0.031	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	165	-178.4	176.9	0	0	0	0	0	114.2	R341 D381	G326-R341 PolarHBondContact N-O 2.94Å; G326-R341 PolarHBondContact O-N 3.48Å; G326-D381 WeakPolarHBondContact CA-OD1 3.43Å
327	W	90.9	Very high	81.2	Confident	9 Å²	9	52.5 Å²	52.5	3%	0.034	29%	0.289	C	S	.	.			trans	-107.8	17.6	179.6	-64.3	-92.7	0	0	0	112.5	Q211 L213 E253 H254 I256 S337 L340 D381	Q211-W327 HydrophobicContact CG-CE3 4.37Å; Q211-W327 HydrophobicContact CG-CH2 3.52Å; Q211-W327 HydrophobicContact CG-CZ3 3.39Å; L213-W327 HydrophobicContact CB-CE3 4.26Å; L213-W327 HydrophobicContact CB-CH2 4.2Å; L213-W327 HydrophobicContact CB-CZ3 3.83Å; L213-W327 HydrophobicContact CD1-CD2 4.48Å; L213-W327 HydrophobicContact CD1-CE3 3.95Å; L213-W327 HydrophobicContact CD1-CZ3 4.37Å; E253-W327 HydrophobicContact CB-CH2 4.08Å; E253-W327 HydrophobicContact CB-CZ2 3.92Å; E253-W327 HydrophobicContact CG-CH2 4.13Å; E253-W327 HydrophobicContact CG-CZ2 3.63Å; E253-W327 WeakPolarHBondContact O-CZ2 3.44Å; H254-W327 PolarHBondContact O-NE1 3.26Å; H254-W327 VanDerWaalsContact O-NE1 3.11Å; I256-W327 HydrophobicContact CG2-CD2 4.48Å; I256-W327 HydrophobicContact CG2-CG 4.16Å; W327-S337 PolarHBondContact O-N 3.03Å; W327-S337 VanDerWaalsContact O-N 3.1Å; W327-L340 HydrophobicContact CD2-CD1 3.88Å; W327-L340 HydrophobicContact CE3-CD1 4.04Å; W327-L340 HydrophobicContact CH2-CD1 3.92Å; W327-L340 HydrophobicContact CH2-CD2 4.4Å; W327-L340 HydrophobicContact CZ2-CB 3.84Å; W327-L340 HydrophobicContact CZ2-CD1 3.74Å; W327-L340 HydrophobicContact CZ2-CD2 4.14Å; W327-L340 HydrophobicContact CZ2-CG 4.1Å; W327-L340 HydrophobicContact CZ3-CD1 4.07Å; W327-D381 PolarHBondContact N-OD1 3.28Å
328	G	78.7	Confident	80.9	Confident	5 Å²	5	52 Å²	52	5%	0.052	29%	0.292	C	S	.	.			trans	-57.6	166.2	-178.3	0	0	0	0	0	113.9	S337 K379 D381	G328-S337 PolarHBondContact O-N 2.99Å; G328-K379 CarbonylContact C-O 3.58Å; G328-K379 WeakPolarHBondContact CA-O 3.36Å; G328-D381 VanDerWaalsContact CA-OD1 3.25Å; G328-D381 WeakPolarHBondContact CA-OD1 3.25Å; G328-D381 PolarHBondContact N-OD1 3.22Å
329	R	69.6	Low	80.9	Confident	91 Å²	91	50.4 Å²	50.4	34%	0.343	27%	0.273	S	S	.	.	B	Isolated β-bridge	trans	-62.2	145	-176.9	-56.1	172.8	178.4	-168.4	-7.9	111.2	G331 E332 G334 P335 T336 C378 K379	R329-G331 VanDerWaalsContact CB-O 3.25Å; R329-G331 WeakPolarHBondContact CB-O 3.43Å; R329-G331 PolarHBondContact O-N 3.13Å; R329-G331 VanDerWaalsContact O-N 3.07Å; R329-E332 PolarHBondContact NH1-O 3.07Å; R329-G334 WeakPolarHBondContact CB-O 3.47Å; R329-G334 WeakPolarHBondContact CD-O 3.48Å; R329-G334 WeakPolarHBondContact CG-O 3.36Å; R329-P335 WeakPolarHBondContact CA-O 3.37Å; R329-T336 HydrophobicContact CG-CG2 3.97Å; R329-C378 HydrophobicContact CB-CB 4.33Å; R329-C378 VanDerWaalsContact CB-SG 3.6Å; R329-C378 WeakPolarHBondContact O-CB 3.44Å; R329-K379 HydrophobicContact CG-CB 4.46Å; R329-K379 PolarHBondContact N-O 3.12Å
330	R	59.3	Low	80.9	Confident	145 Å²	145	48.7 Å²	48.7	55%	0.547	26%	0.262	S	S	.	.	S	Bend	trans	-75.8	9.6	178	-57.1	-177.3	-172.9	-176.3	2	114.1	P335 S337	R330-P335 PolarHBondContact N-O 3.24Å; R330-S337 PolarHBondContact NH2-OG 2.94Å; R330-S337 VanDerWaalsContact NH2-OG 3.09Å
331	G	56.4	Low	80.8	Confident	19 Å²	19	45.6 Å²	45.6	20%	0.196	24%	0.24	C	C	.	.	S	Bend	trans	167.2	162.8	-176.1	0	0	0	0	0	109.3	R329 N333 G334	R329-G331 VanDerWaalsContact CB-O 3.25Å; R329-G331 WeakPolarHBondContact CB-O 3.43Å; R329-G331 PolarHBondContact O-N 3.13Å; R329-G331 VanDerWaalsContact O-N 3.07Å; G331-N333 PolarHBondContact O-N 3.48Å; G331-N333 VanDerWaalsContact O-N 3.11Å; G331-G334 PolarHBondContact O-N 3.12Å
332	E	58.4	Low	80.7	Confident	60 Å²	60	45.4 Å²	45.4	28%	0.28	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.7	-40.3	-173.2	-171.8	169.7	-173.4	0	0	114.2	R329 C406 R408	R329-E332 PolarHBondContact NH1-O 3.07Å; E332-C406 HydrophobicContact CB-CB 4.29Å; E332-R408 VanDerWaalsContact CD-NE 3.26Å; E332-R408 IonicContact OE1-CZ 3.35Å; E332-R408 IonicContact OE1-NE 3.15Å; E332-R408 PolarHBondContact OE1-NE 3.31Å; E332-R408 IonicContact OE1-NH2 2.86Å; E332-R408 PolarHBondContact OE1-NH2 2.95Å; E332-R408 WeakPolarHBondContact OE2-CG 3.33Å; E332-R408 IonicContact OE2-CZ 2.62Å; E332-R408 IonicContact OE2-NE 3.56Å; E332-R408 PolarHBondContact OE2-NE 3.43Å; E332-R408 IonicContact OE2-NH2 3.27Å; E332-R408 PolarHBondContact OE2-NH2 2.94Å
333	N	62.1	Low	80.4	Confident	153 Å²	153	46.9 Å²	46.9	82%	0.818	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-112.1	12.9	175	-62.6	-37.9	0	0	0	113.1	G331	G331-N333 PolarHBondContact O-N 3.48Å; G331-N333 VanDerWaalsContact O-N 3.11Å
334	G	61.3	Low	80.2	Confident	21 Å²	21	51.3 Å²	51.3	22%	0.216	26%	0.26	C	S	.	.	S	Bend	trans	-79.6	163.7	-178.6	0	0	0	0	0	112.9	R329 G331	R329-G334 WeakPolarHBondContact CB-O 3.47Å; R329-G334 WeakPolarHBondContact CD-O 3.48Å; R329-G334 WeakPolarHBondContact CG-O 3.36Å; G331-G334 PolarHBondContact O-N 3.12Å
335	P	69.6	Low	80	Confident	96 Å²	96	51.1 Å²	51.1	62%	0.623	26%	0.259	S	S	*	.	P	Polyproline II helix	trans	-64.8	152	171.3	29.1	-34.3	0	0	0	110.8	R329 R330	R329-P335 WeakPolarHBondContact CA-O 3.37Å; R330-P335 PolarHBondContact N-O 3.24Å
336	T	78.1	Confident	79.9	Confident	78 Å²	78	52.3 Å²	52.3	48%	0.479	27%	0.267	S	S	.	.	B	Isolated β-bridge	trans	-60.6	148.1	165.4	45.8	0	0	0	0	109.9	R329	R329-T336 HydrophobicContact CG-CG2 3.97Å
337	S	85.4	Confident	80	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-74.8	132.5	175.9	-167	0	0	0	0	110.2	W327 G328 R330 L339 R341	W327-S337 PolarHBondContact O-N 3.03Å; W327-S337 VanDerWaalsContact O-N 3.1Å; G328-S337 PolarHBondContact O-N 2.99Å; R330-S337 PolarHBondContact NH2-OG 2.94Å; R330-S337 VanDerWaalsContact NH2-OG 3.09Å; S337-L339 VanDerWaalsContact CB-O 3.31Å; S337-L339 WeakPolarHBondContact CB-O 3.31Å; S337-L339 PolarHBondContact OG-O 2.81Å; S337-R341 WeakPolarHBondContact OG-CD 3.46Å; S337-R341 WeakPolarHBondContact OG-CG 3.45Å
338	V	89.9	Confident	80	Confident	43 Å²	43	56.3 Å²	56.3	26%	0.261	28%	0.282	S	S	.	.	S	Bend	trans	-67.7	-49.4	170.2	167.4	0	0	0	0	110.9	D255 I256 L257	D255-V338 WeakPolarHBondContact OD1-CG1 3.4Å; I256-V338 HydrophobicContact CG1-CB 4.49Å; I256-V338 HydrophobicContact CG1-CG1 4.32Å; I256-V338 PolarHBondContact N-O 2.77Å; L257-V338 HydrophobicContact CB-CG1 4.23Å; L257-V338 HydrophobicContact CD1-CB 4.4Å; L257-V338 HydrophobicContact CD1-CG1 3.74Å; L257-V338 HydrophobicContact CD1-CG2 3.73Å; L257-V338 HydrophobicContact CG-CB 4.48Å; L257-V338 HydrophobicContact CG-CG1 3.66Å; L257-V338 HydrophobicContact CG-CG2 4.04Å
339	L	92.2	Very high	80.6	Confident	43 Å²	43	64.9 Å²	64.9	23%	0.225	31%	0.313	C	S	.	.	B	Isolated β-bridge	trans	-85.7	145.6	177.2	-63	170.7	0	0	0	111.4	E202 H254 D255 S337 R341	E202-L339 HydrophobicContact CG-CB 4.39Å; H254-L339 CarbonylContact O-C 3.56Å; H254-L339 WeakPolarHBondContact O-CA 3.32Å; D255-L339 HydrophobicContact CB-CD2 3.57Å; D255-L339 WeakPolarHBondContact OD2-CD2 3.42Å; S337-L339 VanDerWaalsContact CB-O 3.31Å; S337-L339 WeakPolarHBondContact CB-O 3.31Å; S337-L339 PolarHBondContact OG-O 2.81Å; L339-R341 WeakPolarHBondContact O-CG 3.08Å; L339-R341 PolarHBondContact O-N 3.27Å
340	L	93.4	Very high	81.6	Confident	7 Å²	7	64.6 Å²	64.6	4%	0.037	31%	0.314	C	S	.	.			trans	-60.2	129.5	172.6	-178.6	58.2	0	0	0	110	C203 C208 Q211 H254 W327	C203-L340 HydrophobicContact CB-CD2 4.23Å; C203-L340 HydrophobicContact CB-CG 3.96Å; C203-L340 PolarHBondContact N-O 3.38Å; C208-L340 HydrophobicContact CB-CD2 3.82Å; Q211-L340 HydrophobicContact CB-CD2 4.3Å; Q211-L340 HydrophobicContact CG-CD1 3.86Å; Q211-L340 HydrophobicContact CG-CD2 4.25Å; H254-L340 PolarHBondContact O-N 3.48Å; W327-L340 HydrophobicContact CD2-CD1 3.88Å; W327-L340 HydrophobicContact CE3-CD1 4.04Å; W327-L340 HydrophobicContact CH2-CD1 3.92Å; W327-L340 HydrophobicContact CH2-CD2 4.4Å; W327-L340 HydrophobicContact CZ2-CB 3.84Å; W327-L340 HydrophobicContact CZ2-CD1 3.74Å; W327-L340 HydrophobicContact CZ2-CD2 4.14Å; W327-L340 HydrophobicContact CZ2-CG 4.1Å; W327-L340 HydrophobicContact CZ3-CD1 4.07Å
341	R	90.8	Very high	83	Confident	72 Å²	72	64 Å²	64	27%	0.272	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	158.6	179.7	-60.7	-162.6	90.4	86.5	-2.4	110.9	S201 S325 G326 S337 L339	S201-R341 CarbonylContact O-C 3.47Å; S201-R341 VanDerWaalsContact O-CA 3.23Å; S201-R341 WeakPolarHBondContact O-CA 3.45Å; S201-R341 WeakPolarHBondContact O-CB 3.17Å; S201-R341 PolarHBondContact OG-NE 3.43Å; S201-R341 PolarHBondContact OG-NH2 2.92Å; S325-R341 WeakPolarHBondContact CA-O 3.41Å; S325-R341 WeakPolarHBondContact CB-O 3.28Å; G326-R341 PolarHBondContact N-O 2.94Å; G326-R341 PolarHBondContact O-N 3.48Å; S337-R341 WeakPolarHBondContact OG-CD 3.46Å; S337-R341 WeakPolarHBondContact OG-CG 3.45Å; L339-R341 WeakPolarHBondContact O-CG 3.08Å; L339-R341 PolarHBondContact O-N 3.27Å
342	R	90.9	Very high	84.7	Confident	68 Å²	68	65.3 Å²	65.3	26%	0.257	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	153.5	167.1	67.3	178.3	177.2	-171.5	-2.5	111.8	S201 C203 E207 T323 V324	S201-R342 CarbonylContact C-O 3.58Å; S201-R342 PolarHBondContact O-N 3.04Å; S201-R342 VanDerWaalsContact O-O 3.05Å; C203-R342 HydrophobicContact CB-CB 3.94Å; C203-R342 HydrophobicContact CB-CG 3.86Å; E207-R342 IonicContact OE2-CZ 3.73Å; E207-R342 IonicContact OE2-NH1 3.57Å; E207-R342 PolarHBondContact OE2-NH1 2.76Å; E207-R342 IonicContact OE2-NH2 3.9Å; E207-R342 PolarHBondContact OE2-NH2 3.26Å; T323-R342 HydrophobicContact CG2-CB 4Å; V324-R342 CarbonylContact O-C 3.54Å; V324-R342 WeakPolarHBondContact O-CA 3.18Å; V324-R342 WeakPolarHBondContact O-CB 3.19Å
343	T	87.4	Confident	86.2	Confident	31 Å²	31	62.4 Å²	62.4	19%	0.19	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	154.7	170.4	-174.2	0	0	0	0	110.6	T323 V324 V345 T375	T323-T343 CarbonylContact C-O 3.41Å; T323-T343 WeakPolarHBondContact CA-O 3.31Å; V324-T343 HydrophobicContact CB-CG2 4.15Å; V324-T343 PolarHBondContact N-O 3.46Å; V324-T343 PolarHBondContact O-N 2.98Å; T343-V345 HydrophobicContact CG2-CG1 4.01Å; T343-T375 WeakPolarHBondContact OG1-CG2 3.27Å
344	K	89.8	Confident	87.5	Confident	126 Å²	126	59.3 Å²	59.3	55%	0.548	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	131.5	172.1	-70.2	-172.4	179.8	-175.6	0	109.3	L321 H322 Y370	L321-K344 HydrophobicContact CB-CB 4.31Å; L321-K344 HydrophobicContact CD1-CB 4.32Å; L321-K344 HydrophobicContact CD1-CD 4.25Å; H322-K344 CarbonylContact O-C 3.59Å; H322-K344 WeakPolarHBondContact O-CA 3.06Å; K344-Y370 WeakPolarHBondContact O-CE2 3.11Å
345	V	89.5	Confident	88.9	Confident	1 Å²	1	64.4 Å²	64.4	1%	0.006	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	138.9	-176.5	-66.9	0	0	0	0	111	H322 V324 T343 A368 L386	H322-V345 PolarHBondContact CD2-O 2.95Å; H322-V345 PolarHBondContact N-O 2.75Å; H322-V345 PolarHBondContact O-N 3.26Å; V324-V345 HydrophobicContact CG2-CG2 3.66Å; T343-V345 HydrophobicContact CG2-CG1 4.01Å; V345-A368 HydrophobicContact CB-CB 4.38Å; V345-A368 HydrophobicContact CG2-CB 3.88Å; V345-L386 HydrophobicContact CG2-CD1 3.51Å
346	P	92.6	Very high	89.7	Confident	28 Å²	28	64.3 Å²	64.3	18%	0.182	30%	0.297	C	S	.	.			trans	-79.9	148.6	172.6	32.8	-34.5	0	0	0	110.4	D320 L321 I348 A368 G369 Y370	D320-P346 WeakPolarHBondContact O-CA 3.38Å; L321-P346 HydrophobicContact CD2-CB 4.23Å; P346-I348 HydrophobicContact CG-CD1 4.27Å; P346-A368 CarbonylContact O-C 3.41Å; P346-A368 WeakPolarHBondContact O-CA 3.23Å; P346-A368 WeakPolarHBondContact O-CB 3.27Å; P346-G369 PolarHBondContact O-N 2.75Å; P346-Y370 VanDerWaalsContact CD-CZ 3.48Å; P346-Y370 HydrophobicContact CG-CD1 4.24Å; P346-Y370 HydrophobicContact CG-CE1 3.88Å
347	R	93.2	Very high	90	Very high	71 Å²	71	60.9 Å²	60.9	27%	0.268	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	136	167	-174.8	-172.8	69.8	87.4	-3.4	110	W317 F366	W317-R347 PolarHBondContact O-NE 3.3Å; R347-F366 HydrophobicContact CG-CD2 4.07Å
348	I	91.6	Very high	89.9	Confident	24 Å²	24	63.4 Å²	63.4	12%	0.123	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	137.3	179	-55.1	-59.7	0	0	0	110.2	P346 T352 C353 C367 Y412	P346-I348 HydrophobicContact CG-CD1 4.27Å; I348-T352 HydrophobicContact CG2-CG2 4.04Å; I348-C353 HydrophobicContact CG2-CB 4.07Å; I348-C367 HydrophobicContact CB-CB 4.09Å; I348-C367 PolarHBondContact N-O 3.38Å; I348-Y412 HydrophobicContact CD1-CD1 4.4Å; I348-Y412 HydrophobicContact CD1-CE1 3.79Å; I348-Y412 HydrophobicContact CG1-CD1 3.72Å; I348-Y412 HydrophobicContact CG1-CE1 3.57Å; I348-Y412 HydrophobicContact CG1-CE2 4.39Å; I348-Y412 HydrophobicContact CG1-CG 4.18Å; I348-Y412 HydrophobicContact CG2-CD2 4.21Å; I348-Y412 HydrophobicContact CG2-CE1 4.45Å; I348-Y412 HydrophobicContact CG2-CE2 3.81Å
349	R	91.7	Very high	89.7	Confident	185 Å²	185	61.6 Å²	61.6	70%	0.698	29%	0.291	S	S	*	.			trans	-61.1	139.3	174.9	-70	-176.3	179.4	163.5	0.2	109.8	Q351 T352 C353	R349-Q351 PolarHBondContact O-N 2.87Å; R349-T352 PolarHBondContact O-N 3.1Å; R349-T352 VanDerWaalsContact O-N 3.13Å; R349-C353 PolarHBondContact O-N 2.84Å
350	K	89.9	Confident	89.5	Confident	85 Å²	85	67.1 Å²	67.1	37%	0.37	32%	0.32	S	S	.	.	H	α-helix	trans	-54.4	-40.3	-176.5	-177.8	169.4	178.7	164.3	0	112.6	K354 L361 T362	K350-K354 HydrophobicContact CG-CD 4.48Å; K350-K354 WeakPolarHBondContact O-CG 3.26Å; K350-K354 PolarHBondContact O-N 2.97Å; K350-K354 VanDerWaalsContact O-N 3.07Å; K350-L361 VanDerWaalsContact CE-O 3.23Å; K350-L361 WeakPolarHBondContact CE-O 3.41Å; K350-L361 HydrophobicContact CG-CD1 4.23Å; K350-L361 PolarHBondContact NZ-O 2.82Å; K350-T362 PolarHBondContact NZ-O 3.31Å
351	Q	89.9	Confident	89.4	Confident	134 Å²	134	67.2 Å²	67.2	63%	0.626	32%	0.321	S	S	*	.	H	α-helix	trans	-62.9	-53.1	177.6	-179.1	169.3	5.3	0	0	111.5	R349 C353 K354 E355	R349-Q351 PolarHBondContact O-N 2.87Å; Q351-C353 VanDerWaalsContact C-N 3.3Å; Q351-C353 PolarHBondContact O-N 3.35Å; Q351-K354 PolarHBondContact O-N 3.11Å; Q351-K354 VanDerWaalsContact O-N 3.12Å; Q351-E355 HydrophobicContact CG-CG 4.4Å; Q351-E355 WeakPolarHBondContact CG-OE1 3.36Å; Q351-E355 PolarHBondContact NE2-OE1 3.29Å; Q351-E355 WeakPolarHBondContact O-CG 3.41Å; Q351-E355 PolarHBondContact O-N 2.04Å
352	T	90.7	Very high	89.6	Confident	45 Å²	45	65.8 Å²	65.8	28%	0.276	32%	0.32	S	S	.	.	H	α-helix	trans	-55.9	-43.4	176.7	-50	0	0	0	0	112.1	I348 R349 K354 E355 Q356	I348-T352 HydrophobicContact CG2-CG2 4.04Å; R349-T352 PolarHBondContact O-N 3.1Å; R349-T352 VanDerWaalsContact O-N 3.13Å; T352-K354 PolarHBondContact O-N 2.78Å; T352-E355 PolarHBondContact O-N 2.9Å; T352-Q356 HydrophobicContact CG2-CG 4.27Å; T352-Q356 WeakPolarHBondContact O-CB 3.13Å; T352-Q356 WeakPolarHBondContact O-CG 3.49Å; T352-Q356 PolarHBondContact O-N 2.84Å
353	C	89.8	Confident	89.8	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-64.1	-41.8	178.5	-171.6	0	0	0	0	112.6	I348 R349 Q351 S357 L361 C367 Y412	I348-C353 HydrophobicContact CG2-CB 4.07Å; R349-C353 PolarHBondContact O-N 2.84Å; Q351-C353 VanDerWaalsContact C-N 3.3Å; Q351-C353 PolarHBondContact O-N 3.35Å; C353-S357 WeakPolarHBondContact O-CB 3.38Å; C353-S357 PolarHBondContact O-N 3.42Å; C353-L361 HydrophobicContact CB-CD1 3.96Å; C353-C367 HydrophobicContact CB-CB 3.58Å; C353-C367 WeakPolarHBondContact CB-SG 3.36Å; C353-C367 WeakPolarHBondContact SG-CB 3.41Å; C353-C367 CovalentContact SG-SG 2.02Å; C353-C367 PolarHBondContact SG-SG 2.74Å; C353-Y412 HydrophobicContact CB-CD2 4.21Å
354	K	90.8	Very high	90.2	Very high	87 Å²	87	69.4 Å²	69.4	38%	0.378	34%	0.335	S	S	.	.	H	α-helix	trans	-63.7	-46.9	176.6	-74.8	-179	172	-167	0	111.8	K350 Q351 T352 G358 L361	K350-K354 HydrophobicContact CG-CD 4.48Å; K350-K354 WeakPolarHBondContact O-CG 3.26Å; K350-K354 PolarHBondContact O-N 2.97Å; K350-K354 VanDerWaalsContact O-N 3.07Å; Q351-K354 PolarHBondContact O-N 3.11Å; Q351-K354 VanDerWaalsContact O-N 3.12Å; T352-K354 PolarHBondContact O-N 2.78Å; K354-G358 VanDerWaalsContact O-CA 3.23Å; K354-G358 WeakPolarHBondContact O-CA 3.21Å; K354-G358 PolarHBondContact O-N 3.01Å; K354-L361 HydrophobicContact CG-CD1 4.32Å
355	E	89.9	Confident	90.5	Very high	128 Å²	128	63.6 Å²	63.6	60%	0.598	31%	0.31	S	S	*	.	H	α-helix	trans	-66.5	-44.8	-176.9	-72.2	168.1	-178.8	0	0	111.8	Q351 T352	Q351-E355 HydrophobicContact CG-CG 4.4Å; Q351-E355 WeakPolarHBondContact CG-OE1 3.36Å; Q351-E355 PolarHBondContact NE2-OE1 3.29Å; Q351-E355 WeakPolarHBondContact O-CG 3.41Å; Q351-E355 PolarHBondContact O-N 2.04Å; T352-E355 PolarHBondContact O-N 2.9Å
356	Q	86.6	Confident	90.8	Very high	94 Å²	94	63.9 Å²	63.9	44%	0.439	31%	0.311	S	S	.	.	H	α-helix	trans	-84.5	-37.5	-173.2	-64.7	-174.4	-9.9	0	0	113.3	T352 L371 Y412	T352-Q356 HydrophobicContact CG2-CG 4.27Å; T352-Q356 WeakPolarHBondContact O-CB 3.13Å; T352-Q356 WeakPolarHBondContact O-CG 3.49Å; T352-Q356 PolarHBondContact O-N 2.84Å; Q356-L371 HydrophobicContact CB-CD1 3.93Å; Q356-Y412 HydrophobicContact CB-CE2 4.29Å; Q356-Y412 PolarHBondContact OE1-OH 2.04Å
357	S	83.1	Confident	90.8	Very high	7 Å²	7	62.6 Å²	62.6	5%	0.049	30%	0.303	C	S	.	.	H	α-helix	trans	-98.5	-7.4	-178.2	-54.1	0	0	0	0	113.6	C353 V359 K404 G410 N411 Y412	C353-S357 WeakPolarHBondContact O-CB 3.38Å; C353-S357 PolarHBondContact O-N 3.42Å; S357-V359 PolarHBondContact O-N 2.85Å; S357-K404 PolarHBondContact O-NZ 3.42Å; S357-G410 PolarHBondContact OG-O 2.81Å; S357-N411 WeakPolarHBondContact OG-CA 3.49Å; S357-Y412 VanDerWaalsContact OG-CD2 3.32Å; S357-Y412 WeakPolarHBondContact OG-CD2 3.34Å; S357-Y412 PolarHBondContact OG-N 3.41Å
358	G	85.1	Confident	90.7	Very high	52 Å²	52	59.2 Å²	59.2	54%	0.536	29%	0.29	S	S	.	.			trans	57.7	35.3	-179.8	0	0	0	0	0	113	K354 K404	K354-G358 VanDerWaalsContact O-CA 3.23Å; K354-G358 WeakPolarHBondContact O-CA 3.21Å; K354-G358 PolarHBondContact O-N 3.01Å; G358-K404 PolarHBondContact O-NZ 2.93Å
359	V	85.6	Confident	90.5	Very high	6 Å²	6	58.1 Å²	58.1	4%	0.036	29%	0.285	C	S	.	.			trans	-101.8	149.6	-179.2	-69.8	0	0	0	0	110.9	S357 L361 W402 K404	S357-V359 PolarHBondContact O-N 2.85Å; V359-L361 HydrophobicContact CG2-CD1 4.34Å; V359-L361 HydrophobicContact CG2-CD2 4.12Å; V359-L361 HydrophobicContact CG2-CG 4.03Å; V359-W402 HydrophobicContact CB-CH2 3.95Å; V359-W402 HydrophobicContact CG1-CH2 3.76Å; V359-W402 HydrophobicContact CG1-CZ3 4.01Å; V359-K404 HydrophobicContact CG1-CD 3.89Å; V359-K404 HydrophobicContact CG1-CG 4.16Å
360	L	87.8	Confident	90	Very high	158 Å²	158	53.4 Å²	53.4	83%	0.827	27%	0.268	S	S	*	.			trans	-94.5	121.3	170.3	-64.7	177.8	0	0	0	109.2
361	L	91.3	Very high	89.4	Confident	10 Å²	10	52.2 Å²	52.2	5%	0.052	27%	0.265	C	S	.	.			trans	-115.4	125.5	-179	-61.2	171.7	0	0	0	110.9	K350 C353 K354 V359 M365 C367 I414	K350-L361 VanDerWaalsContact CE-O 3.23Å; K350-L361 WeakPolarHBondContact CE-O 3.41Å; K350-L361 HydrophobicContact CG-CD1 4.23Å; K350-L361 PolarHBondContact NZ-O 2.82Å; C353-L361 HydrophobicContact CB-CD1 3.96Å; K354-L361 HydrophobicContact CG-CD1 4.32Å; V359-L361 HydrophobicContact CG2-CD1 4.34Å; V359-L361 HydrophobicContact CG2-CD2 4.12Å; V359-L361 HydrophobicContact CG2-CG 4.03Å; L361-M365 HydrophobicContact CD2-CB 4.21Å; L361-M365 HydrophobicContact CD2-SD 4.32Å; L361-C367 WeakPolarHBondContact CD1-SG 3.41Å; L361-I414 HydrophobicContact CD2-CG1 3.9Å; L361-I414 HydrophobicContact CD2-CG2 3.92Å
362	T	94.1	Very high	88.4	Confident	41 Å²	41	49.5 Å²	49.5	25%	0.252	26%	0.255	S	S	.	.			trans	-73.5	-177.6	171.3	74.3	0	0	0	0	110.7	D283 K350 N364 M365	D283-T362 HydrophobicContact CB-CG2 3.98Å; D283-T362 WeakPolarHBondContact OD1-CB 3.45Å; D283-T362 WeakPolarHBondContact OD1-CG2 3.35Å; D283-T362 PolarHBondContact OD1-OG1 3.33Å; K350-T362 PolarHBondContact NZ-O 3.31Å; T362-N364 PolarHBondContact OG1-N 3.17Å; T362-M365 HydrophobicContact CG2-CE 4.12Å; T362-M365 HydrophobicContact CG2-SD 4.48Å
363	K	94.9	Very high	87	Confident	160 Å²	160	47.8 Å²	47.8	70%	0.696	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-15.3	173.6	66	-179.1	-177.9	178.1	0	112.8	R417 N420	K363-R417 PolarHBondContact O-NE 3.05Å; K363-N420 PolarHBondContact O-ND2 3.45Å; K363-N420 VanDerWaalsContact O-ND2 3.11Å
364	N	97	Very high	85.5	Confident	15 Å²	15	57.9 Å²	57.9	8%	0.08	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	0	-176	-60.7	-34.1	0	0	0	113.8	D283 N284 T362 R417 N420 Y421	D283-N364 WeakPolarHBondContact OD1-CB 3.44Å; D283-N364 PolarHBondContact OD1-ND2 3.33Å; D283-N364 VanDerWaalsContact OD1-ND2 3.11Å; D283-N364 PolarHBondContact OD2-ND2 2.04Å; N284-N364 PolarHBondContact OD1-ND2 3.21Å; T362-N364 PolarHBondContact OG1-N 3.17Å; N364-R417 VanDerWaalsContact O-CB 3.27Å; N364-R417 WeakPolarHBondContact O-CB 3.48Å; N364-R417 PolarHBondContact O-N 3.13Å; N364-N420 PolarHBondContact OD1-ND2 3.14Å; N364-Y421 HydrophobicContact CB-CE2 4.3Å; N364-Y421 WeakPolarHBondContact CB-OH 3.05Å; N364-Y421 PolarHBondContact ND2-OH 3.04Å
365	M	95.9	Very high	84	Confident	4 Å²	4	56 Å²	56	2%	0.02	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	158.6	-176.9	-58.6	171.4	-172.3	0	0	110.7	V282 D283 L361 T362 I414 Y415	V282-M365 VanDerWaalsContact C-CE 3.46Å; V282-M365 WeakPolarHBondContact O-CE 3.32Å; D283-M365 HydrophobicContact CB-CE 3.85Å; L361-M365 HydrophobicContact CD2-CB 4.21Å; L361-M365 HydrophobicContact CD2-SD 4.32Å; T362-M365 HydrophobicContact CG2-CE 4.12Å; T362-M365 HydrophobicContact CG2-SD 4.48Å; M365-I414 HydrophobicContact CB-CG2 3.95Å; M365-I414 HydrophobicContact CG-CG2 4.21Å; M365-I414 HydrophobicContact SD-CG2 4.09Å; M365-Y415 VanDerWaalsContact CA-O 3.31Å; M365-Y415 WeakPolarHBondContact CA-O 3.37Å
366	F	95.3	Very high	82.4	Confident	7 Å²	7	51.2 Å²	51.2	3%	0.031	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	164.6	165.5	68.4	-78.8	0	0	0	110.4	R347 L386 L397 Y415 R417	R347-F366 HydrophobicContact CG-CD2 4.07Å; F366-L386 HydrophobicContact CE2-CD2 3.52Å; F366-L386 HydrophobicContact CZ-CD2 3.36Å; F366-L397 HydrophobicContact CZ-CD2 4.49Å; F366-L397 HydrophobicContact CZ-CG 4.13Å; F366-Y415 HydrophobicContact CZ-CG 4.46Å; F366-Y415 PolarHBondContact N-O 3.17Å; F366-Y415 PolarHBondContact O-N 3.26Å; F366-R417 HydrophobicContact CD1-CB 3.91Å; F366-R417 HydrophobicContact CD1-CG 4.43Å; F366-R417 HydrophobicContact CE1-CB 4.25Å
367	C	92.5	Very high	81	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.007	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	147	-180	-56.5	0	0	0	0	111.1	I348 C353 L361 Y412 G413	I348-C367 HydrophobicContact CB-CB 4.09Å; I348-C367 PolarHBondContact N-O 3.38Å; C353-C367 HydrophobicContact CB-CB 3.58Å; C353-C367 WeakPolarHBondContact CB-SG 3.36Å; C353-C367 WeakPolarHBondContact SG-CB 3.41Å; C353-C367 CovalentContact SG-SG 2.02Å; C353-C367 PolarHBondContact SG-SG 2.74Å; L361-C367 WeakPolarHBondContact CD1-SG 3.41Å; C367-Y412 HydrophobicContact CB-CG 4.49Å; C367-G413 VanDerWaalsContact CA-O 3.28Å; C367-G413 WeakPolarHBondContact CA-O 3.05Å
368	A	91.2	Very high	79.9	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	151.2	168.6	0	0	0	0	0	110	V345 P346 L386 G413 Y415	V345-A368 HydrophobicContact CB-CB 4.38Å; V345-A368 HydrophobicContact CG2-CB 3.88Å; P346-A368 CarbonylContact O-C 3.41Å; P346-A368 WeakPolarHBondContact O-CA 3.23Å; P346-A368 WeakPolarHBondContact O-CB 3.27Å; A368-L386 HydrophobicContact CB-CD1 4.26Å; A368-G413 PolarHBondContact N-O 2.02Å; A368-G413 VanDerWaalsContact N-O 3.07Å; A368-G413 PolarHBondContact O-N 3.41Å; A368-Y415 HydrophobicContact CB-CD2 4.02Å; A368-Y415 HydrophobicContact CB-CE2 3.71Å
369	G	87.3	Confident	78.5	Confident	1 Å²	1	51.3 Å²	51.3	1%	0.01	25%	0.245	C	C	.	.	S	Bend	trans	126.5	-170.9	178.7	0	0	0	0	0	113.5	P346 Y412	P346-G369 PolarHBondContact O-N 2.75Å; G369-Y412 WeakPolarHBondContact O-CD1 3.35Å; G369-Y412 WeakPolarHBondContact O-CE1 3.48Å
370	Y	82.5	Confident	77.1	Confident	86 Å²	86	51.8 Å²	51.8	34%	0.337	25%	0.251	S	S	.	.			trans	-112.5	141.9	-178.1	-59	-82.1	0	0	0	110.5	K344 P346 D372	K344-Y370 WeakPolarHBondContact O-CE2 3.11Å; P346-Y370 VanDerWaalsContact CD-CZ 3.48Å; P346-Y370 HydrophobicContact CG-CD1 4.24Å; P346-Y370 HydrophobicContact CG-CE1 3.88Å; Y370-D372 VanDerWaalsContact CB-OD1 3.24Å; Y370-D372 WeakPolarHBondContact CB-OD1 3.01Å; Y370-D372 PolarHBondContact O-N 3.22Å
371	L	76.7	Confident	76.6	Confident	61 Å²	61	45.1 Å²	45.1	32%	0.319	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-19.8	-178.8	-162.8	74.2	0	0	0	112.5	Q356 G373 P409 G410 Y412	Q356-L371 HydrophobicContact CB-CD1 3.93Å; L371-G373 PolarHBondContact O-N 3.27Å; L371-G373 VanDerWaalsContact O-N 3.14Å; L371-P409 CarbonylContact O-C 3.51Å; L371-P409 WeakPolarHBondContact O-CA 3.39Å; L371-G410 VanDerWaalsContact CD1-C 3.41Å; L371-G410 WeakPolarHBondContact CD1-O 3.35Å; L371-G410 PolarHBondContact O-N 3.27Å; L371-Y412 HydrophobicContact CB-CE1 4.09Å; L371-Y412 HydrophobicContact CD1-CD2 4.29Å; L371-Y412 HydrophobicContact CD1-CE1 4.28Å; L371-Y412 HydrophobicContact CD1-CE2 3.71Å
372	D	68.8	Low	76.5	Confident	76 Å²	76	45.6 Å²	45.6	41%	0.406	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-7.9	-176.9	70.2	-10.5	0	0	0	113.6	Y370 R374	Y370-D372 VanDerWaalsContact CB-OD1 3.24Å; Y370-D372 WeakPolarHBondContact CB-OD1 3.01Å; Y370-D372 PolarHBondContact O-N 3.22Å; D372-R374 HydrophobicContact CB-CG 4.38Å; D372-R374 PolarHBondContact O-N 3.47Å; D372-R374 PolarHBondContact OD1-N 3.48Å; D372-R374 VanDerWaalsContact OD1-N 3.08Å; D372-R374 WeakPolarHBondContact OD2-CD 3.36Å
373	G	61.4	Low	76.5	Confident	10 Å²	10	43.7 Å²	43.7	10%	0.103	21%	0.209	C	C	.	.	S	Bend	trans	65.2	13.7	179.8	0	0	0	0	0	113.2	L371 A407	L371-G373 PolarHBondContact O-N 3.27Å; L371-G373 VanDerWaalsContact O-N 3.14Å; G373-A407 CarbonylContact C-O 3.56Å; G373-A407 WeakPolarHBondContact CA-O 3.5Å; G373-A407 CarbonylContact O-C 3.58Å; G373-A407 WeakPolarHBondContact O-CA 2.7Å; G373-A407 VanDerWaalsContact O-CB 3.22Å; G373-A407 WeakPolarHBondContact O-CB 3.48Å
374	R	58.5	Low	76.5	Confident	211 Å²	211	36 Å²	36	80%	0.796	18%	0.175	S	C	*	.	S	Bend	trans	-84.2	-23.5	179.7	-65.6	-175.4	-179.7	-170	0.6	112.7	D372	D372-R374 HydrophobicContact CB-CG 4.38Å; D372-R374 PolarHBondContact O-N 3.47Å; D372-R374 PolarHBondContact OD1-N 3.48Å; D372-R374 VanDerWaalsContact OD1-N 3.08Å; D372-R374 WeakPolarHBondContact OD2-CD 3.36Å
375	T	58.4	Low	76.5	Confident	49 Å²	49	35.3 Å²	35.3	30%	0.301	17%	0.172	S	C	.	.	S	Bend	trans	-141.6	102.7	-175.2	-9.4	0	0	0	0	109.5	T343	T343-T375 WeakPolarHBondContact OG1-CG2 3.27Å
376	D	57	Low	76.6	Confident	27 Å²	27	35.1 Å²	35.1	14%	0.144	17%	0.171	C	C	.	.			trans	-147.3	153.7	-178.1	-168.3	18.3	0	0	0	110.5	A407	D376-A407 HydrophobicContact CB-CB 3.99Å; D376-A407 PolarHBondContact OD2-N 2.83Å
377	S	56.2	Low	76.7	Confident	13 Å²	13	34.9 Å²	34.9	9%	0.091	17%	0.17	C	C	.	.			trans	-73.9	136.8	169.4	52.1	0	0	0	0	109.5	Y415	S377-Y415 PolarHBondContact OG-OH 2.81Å
378	C	60.6	Low	77	Confident	7 Å²	7	34.9 Å²	34.9	5%	0.047	17%	0.169	C	C	.	.			trans	-122.2	176.4	-177.8	-170.1	0	0	0	0	113.1	R329 G380 D381 C406	R329-C378 HydrophobicContact CB-CB 4.33Å; R329-C378 VanDerWaalsContact CB-SG 3.6Å; R329-C378 WeakPolarHBondContact O-CB 3.44Å; C378-G380 PolarHBondContact O-N 3.48Å; C378-D381 PolarHBondContact N-OD2 3.23Å; C378-D381 VanDerWaalsContact O-CB 3.32Å; C378-D381 WeakPolarHBondContact O-CB 3.46Å; C378-D381 PolarHBondContact O-N 3.39Å; C378-C406 WeakPolarHBondContact CA-SG 3.14Å; C378-C406 HydrophobicContact CB-CB 3.43Å; C378-C406 VanDerWaalsContact CB-CB 3.43Å; C378-C406 WeakPolarHBondContact CB-SG 3.06Å; C378-C406 WeakPolarHBondContact SG-CB 3.34Å; C378-C406 CovalentContact SG-SG 2.01Å; C378-C406 PolarHBondContact SG-SG 2.87Å
379	K	54.9	Low	77.3	Confident	135 Å²	135	40.8 Å²	40.8	59%	0.587	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-45.2	125	169.4	-69.7	-169.3	175.2	-173.3	0	110.3	G328 R329 C406	G328-K379 CarbonylContact C-O 3.58Å; G328-K379 WeakPolarHBondContact CA-O 3.36Å; R329-K379 HydrophobicContact CG-CB 4.46Å; R329-K379 PolarHBondContact N-O 3.12Å; K379-C406 PolarHBondContact N-SG 3.35Å
380	G	57.1	Low	77.7	Confident	16 Å²	16	42 Å²	42	17%	0.165	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	101.2	-17	-173.8	0	0	0	0	0	114.4	C378	C378-G380 PolarHBondContact O-N 3.48Å
381	D	76.9	Confident	78.2	Confident	17 Å²	17	42 Å²	42	9%	0.091	20%	0.202	C	C	.	.			trans	-87.6	-15.2	166.5	-59.6	-43.6	0	0	0	112.2	G326 W327 G328 C378 G383 G384 V400	G326-D381 WeakPolarHBondContact CA-OD1 3.43Å; W327-D381 PolarHBondContact N-OD1 3.28Å; G328-D381 VanDerWaalsContact CA-OD1 3.25Å; G328-D381 WeakPolarHBondContact CA-OD1 3.25Å; G328-D381 PolarHBondContact N-OD1 3.22Å; C378-D381 PolarHBondContact N-OD2 3.23Å; C378-D381 VanDerWaalsContact O-CB 3.32Å; C378-D381 WeakPolarHBondContact O-CB 3.46Å; C378-D381 PolarHBondContact O-N 3.39Å; D381-G383 PolarHBondContact O-N 2.96Å; D381-G384 WeakPolarHBondContact O-CA 3.37Å; D381-G384 PolarHBondContact O-N 3.35Å; D381-V400 HydrophobicContact CB-CG1 4.16Å; D381-V400 WeakPolarHBondContact O-CB 2.91Å
382	S	88.8	Confident	78.9	Confident	21 Å²	21	47.3 Å²	47.3	15%	0.147	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-44.6	130.9	176.6	-74.7	0	0	0	0	112.4	C222 G223 H237 G384	C222-S382 CarbonylContact C-O 3.52Å; C222-S382 WeakPolarHBondContact CA-O 3.16Å; C222-S382 VanDerWaalsContact CB-O 3.29Å; C222-S382 WeakPolarHBondContact CB-O 3.42Å; G223-S382 PolarHBondContact N-O 2.8Å; H237-S382 WeakPolarHBondContact NE2-CB 3.02Å; H237-S382 PolarHBondContact NE2-OG 3Å; H237-S382 VanDerWaalsContact NE2-OG 3.08Å; S382-G384 PolarHBondContact O-N 3.08Å
383	G	94.4	Very high	80.2	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.7	-9.2	-175.3	0	0	0	0	0	114.7	G223 G224 T234 D381 V400	G223-G383 CarbonylContact O-C 3.59Å; G224-G383 WeakPolarHBondContact CA-O 3.07Å; T234-G383 WeakPolarHBondContact OG1-CA 3.23Å; D381-G383 PolarHBondContact O-N 2.96Å; G383-V400 PolarHBondContact N-O 2.83Å
384	G	95.4	Very high	81.9	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	21%	0.206	C	C	.	.			trans	-71	169.1	174.7	0	0	0	0	0	113.6	D381 S382 I399 V400	D381-G384 WeakPolarHBondContact O-CA 3.37Å; D381-G384 PolarHBondContact O-N 3.35Å; S382-G384 PolarHBondContact O-N 3.08Å; G384-I399 WeakPolarHBondContact O-CA 3.28Å; G384-V400 WeakPolarHBondContact O-CG2 3.02Å; G384-V400 PolarHBondContact O-N 2.78Å
385	P	97.6	Very high	83.9	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	144.3	-173.1	35	-34.3	0	0	0	112.9	V225 V324 S325 V387 L396	V225-P385 HydrophobicContact CG1-CB 4.1Å; V225-P385 HydrophobicContact CG2-CB 3.6Å; V225-P385 HydrophobicContact CG2-CG 4.24Å; V324-P385 WeakPolarHBondContact CA-O 3.44Å; S325-P385 WeakPolarHBondContact OG-CG 3.32Å; P385-V387 HydrophobicContact CB-CG2 3.71Å; P385-V387 HydrophobicContact CG-CG2 4.28Å; P385-L396 HydrophobicContact CB-CD1 3.63Å
386	L	97.1	Very high	85.8	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	112.6	153.8	177.9	101.6	0	0	0	108	H322 T323 V324 V345 F366 A368 L397 G398 Y415	H322-L386 HydrophobicContact CB-CD1 3.8Å; H322-L386 HydrophobicContact CB-CD2 4.27Å; H322-L386 HydrophobicContact CB-CG 3.92Å; T323-L386 WeakPolarHBondContact O-CA 3.07Å; V324-L386 HydrophobicContact CG2-CB 4.4Å; V324-L386 HydrophobicContact CG2-CD1 3.34Å; V324-L386 HydrophobicContact CG2-CG 4.38Å; V345-L386 HydrophobicContact CG2-CD1 3.51Å; F366-L386 HydrophobicContact CE2-CD2 3.52Å; F366-L386 HydrophobicContact CZ-CD2 3.36Å; A368-L386 HydrophobicContact CB-CD1 4.26Å; L386-L397 HydrophobicContact CD2-CB 4.1Å; L386-L397 HydrophobicContact CD2-CD2 4.01Å; L386-L397 HydrophobicContact CD2-CG 4.14Å; L386-L397 PolarHBondContact O-N 3.38Å; L386-G398 PolarHBondContact N-O 2.89Å; L386-G398 PolarHBondContact O-N 3.47Å; L386-G398 VanDerWaalsContact O-N 3.12Å; L386-Y415 HydrophobicContact CB-CD1 3.73Å; L386-Y415 HydrophobicContact CB-CE1 3.87Å; L386-Y415 HydrophobicContact CD1-CD1 4.24Å; L386-Y415 HydrophobicContact CD1-CE1 3.83Å; L386-Y415 HydrophobicContact CD2-CD1 4.46Å; L386-Y415 HydrophobicContact CG-CD1 4.35Å; L386-Y415 HydrophobicContact CG-CE1 4.36Å
387	V	98.1	Very high	87.7	Confident	2 Å²	2	31.3 Å²	31.3	1%	0.012	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	140.4	-170.8	178.6	0	0	0	0	111.6	W210 I304 H322 T323 P385 H394 F395	W210-V387 HydrophobicContact CH2-CG1 4.4Å; W210-V387 HydrophobicContact CZ2-CB 4.37Å; W210-V387 HydrophobicContact CZ2-CG1 3.92Å; W210-V387 HydrophobicContact CZ2-CG2 4.15Å; I304-V387 HydrophobicContact CD1-CG1 3.86Å; I304-V387 HydrophobicContact CD1-CG2 4.08Å; H322-V387 CarbonylContact C-O 3.52Å; H322-V387 WeakPolarHBondContact CA-O 3.42Å; T323-V387 PolarHBondContact N-O 2.9Å; T323-V387 PolarHBondContact O-N 3.02Å; P385-V387 HydrophobicContact CB-CG2 3.71Å; P385-V387 HydrophobicContact CG-CG2 4.28Å; V387-H394 HydrophobicContact CG1-CB 3.6Å; V387-F395 WeakPolarHBondContact CA-O 3.24Å
388	T	98.1	Very high	89.7	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	127.4	172.7	-53.1	0	0	0	0	109.8	L316 V319 H322 H394 F395 L397	L316-T388 HydrophobicContact CB-CG2 4.17Å; L316-T388 HydrophobicContact CD2-CG2 3.99Å; V319-T388 HydrophobicContact CB-CG2 3.74Å; V319-T388 HydrophobicContact CG1-CG2 3.9Å; V319-T388 HydrophobicContact CG2-CG2 3.7Å; H322-T388 PolarHBondContact ND1-OG1 3.25Å; T388-H394 WeakPolarHBondContact O-CA 2.99Å; T388-F395 PolarHBondContact N-O 3.42Å; T388-F395 PolarHBondContact O-N 2.8Å; T388-L397 WeakPolarHBondContact OG1-CD2 3.4Å
389	K	96.7	Very high	91.5	Very high	124 Å²	124	30.3 Å²	30.3	54%	0.539	14%	0.141	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	121.4	168.2	-176.1	179.9	175.1	-178.9	0	108.4	K391	K389-K391 WeakPolarHBondContact CE-O 3.46Å
390	F	95.8	Very high	93.5	Very high	28 Å²	28	24.2 Å²	24.2	12%	0.123	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	119.2	172.7	-172.2	-106.1	0	0	0	108.7	N138 L311 D315 L316 K392 T393 F395	N138-F390 HydrophobicContact CB-CZ 4.02Å; L311-F390 HydrophobicContact CD1-CD1 3.98Å; L311-F390 HydrophobicContact CD1-CE1 3.79Å; L311-F390 HydrophobicContact CD1-CG 4.47Å; L311-F390 HydrophobicContact CD1-CZ 4.13Å; D315-F390 HydrophobicContact CB-CD2 4.49Å; D315-F390 HydrophobicContact CB-CE2 3.78Å; D315-F390 HydrophobicContact CB-CZ 4.04Å; L316-F390 HydrophobicContact CD2-CB 3.47Å; L316-F390 VanDerWaalsContact CD2-CB 3.47Å; L316-F390 HydrophobicContact CD2-CD2 3.99Å; L316-F390 HydrophobicContact CD2-CG 3.82Å; F390-K392 PolarHBondContact O-N 3.26Å; F390-T393 PolarHBondContact N-O 2.86Å; F390-T393 PolarHBondContact O-N 2.79Å; F390-F395 HydrophobicContact CB-CD2 4.02Å; F390-F395 HydrophobicContact CB-CE2 4.16Å
391	K	92.9	Very high	95.1	Very high	86 Å²	86	23.6 Å²	23.6	37%	0.374	11%	0.108	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.8	-109.5	-167.2	-54.1	-164.9	-167.9	-173.2	0	111.9	G140 C141 D142 K389	G140-K391 PolarHBondContact O-NZ 3.24Å; C141-K391 VanDerWaalsContact C-NZ 3.25Å; C141-K391 WeakPolarHBondContact O-CE 3.03Å; C141-K391 PolarHBondContact O-NZ 3.32Å; D142-K391 HydrophobicContact CB-CD 4.33Å; D142-K391 WeakPolarHBondContact OD1-CD 3.15Å; D142-K391 WeakPolarHBondContact OD1-CE 3.22Å; D142-K391 IonicContact OD1-NZ 3.31Å; D142-K391 PolarHBondContact OD1-NZ 2.86Å; K389-K391 WeakPolarHBondContact CE-O 3.46Å
392	K	92.1	Very high	95.4	Very high	172 Å²	172	25.8 Å²	25.8	75%	0.748	12%	0.115	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.8	-3.6	-177.6	-63.9	175.1	-173.8	163.7	0	113.8	F390	F390-K392 PolarHBondContact O-N 3.26Å
393	T	96.3	Very high	94.8	Very high	3 Å²	3	26.3 Å²	26.3	2%	0.018	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	147	-167.8	-54.8	0	0	0	0	111	H143 Y162 C305 F390 F395	H143-T393 VanDerWaalsContact NE2-CB 3.34Å; H143-T393 WeakPolarHBondContact NE2-CB 3.37Å; H143-T393 PolarHBondContact NE2-OG1 3.19Å; Y162-T393 HydrophobicContact CE2-CG2 4.3Å; Y162-T393 PolarHBondContact OH-OG1 3.35Å; C305-T393 HydrophobicContact CB-CG2 4.35Å; C305-T393 WeakPolarHBondContact SG-CG2 3.38Å; F390-T393 PolarHBondContact N-O 2.86Å; F390-T393 PolarHBondContact O-N 2.79Å; T393-F395 HydrophobicContact CG2-CD2 4.38Å; T393-F395 HydrophobicContact CG2-CE2 3.76Å; T393-F395 HydrophobicContact CG2-CZ 3.86Å
394	H	98.1	Very high	93.5	Very high	30 Å²	30	30.4 Å²	30.4	14%	0.139	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	129.2	179.4	-63.5	82	0	0	0	110.8	G180 W210 I304 C305 V387 T388	G180-H394 VanDerWaalsContact CA-O 3.24Å; G180-H394 WeakPolarHBondContact CA-O 3.41Å; G180-H394 WeakPolarHBondContact O-CB 3.44Å; G180-H394 PolarHBondContact O-N 3.01Å; G180-H394 PolarHBondContact O-ND1 2.9Å; W210-H394 HydrophobicContact CH2-CB 3.67Å; W210-H394 AromaticContact CH2-CD2 3.74Å; W210-H394 AromaticContact CH2-CG 3.52Å; W210-H394 AromaticContact CH2-ND1 3.97Å; W210-H394 HydrophobicContact CZ2-CB 4.41Å; W210-H394 HydrophobicContact CZ3-CB 3.82Å; W210-H394 AromaticContact CZ3-CG 3.96Å; I304-H394 HydrophobicContact CD1-CB 3.84Å; I304-H394 VanDerWaalsContact CD1-O 3.28Å; I304-H394 WeakPolarHBondContact CD1-O 3.39Å; C305-H394 WeakPolarHBondContact CB-O 3.46Å; C305-H394 PolarHBondContact N-O 3.43Å; V387-H394 HydrophobicContact CG1-CB 3.6Å; T388-H394 WeakPolarHBondContact O-CA 2.99Å
395	F	98.7	Very high	91.8	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	140.8	-178.3	-67.7	-88.4	0	0	0	111.4	H143 F144 A159 C305 P307 L311 L316 V387 T388 F390 T393 L397	H143-F395 HydrophobicContact CB-CZ 4.31Å; H143-F395 AromaticContact CD2-CZ 3.59Å; F144-F395 AromaticContact CE1-CE1 3.8Å; F144-F395 HydrophobicContact CE1-CE1 3.8Å; F144-F395 HydrophobicContact CE1-CZ 4.33Å; F144-F395 HydrophobicContact CZ-CE1 4.17Å; A159-F395 HydrophobicContact CB-CE1 4.18Å; C305-F395 HydrophobicContact CB-CD1 3.47Å; C305-F395 VanDerWaalsContact CB-CD1 3.47Å; C305-F395 HydrophobicContact CB-CE1 3.54Å; C305-F395 HydrophobicContact CB-CG 4.22Å; C305-F395 HydrophobicContact CB-CZ 4.34Å; C305-F395 WeakPolarHBondContact O-CA 3.31Å; P307-F395 HydrophobicContact CB-CB 4.41Å; P307-F395 HydrophobicContact CB-CD1 4.06Å; P307-F395 HydrophobicContact CB-CG 4.49Å; L311-F395 HydrophobicContact CD2-CD1 4.23Å; L311-F395 HydrophobicContact CD2-CD2 4.5Å; L311-F395 HydrophobicContact CD2-CE1 3.99Å; L311-F395 HydrophobicContact CD2-CE2 4.26Å; L311-F395 HydrophobicContact CD2-CG 4.48Å; L311-F395 HydrophobicContact CD2-CZ 4Å; L316-F395 HydrophobicContact CD1-CB 3.62Å; L316-F395 HydrophobicContact CD1-CG 4.25Å; L316-F395 HydrophobicContact CD2-CD2 4.39Å; V387-F395 WeakPolarHBondContact CA-O 3.24Å; T388-F395 PolarHBondContact N-O 3.42Å; T388-F395 PolarHBondContact O-N 2.8Å; F390-F395 HydrophobicContact CB-CD2 4.02Å; F390-F395 HydrophobicContact CB-CE2 4.16Å; T393-F395 HydrophobicContact CG2-CD2 4.38Å; T393-F395 HydrophobicContact CG2-CE2 3.76Å; T393-F395 HydrophobicContact CG2-CZ 3.86Å; F395-L397 PolarHBondContact O-N 3.11Å
396	L	98.7	Very high	90.2	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	114.7	174.4	-171.2	64.9	0	0	0	109.9	V225 L233 I304 C305 L306 P307 P385 G398 I399 V418	V225-L396 HydrophobicContact CG1-CD1 4.26Å; V225-L396 HydrophobicContact CG1-CD2 4.47Å; V225-L396 HydrophobicContact CG2-CD1 4.21Å; V225-L396 HydrophobicContact CG2-CD2 4.5Å; L233-L396 HydrophobicContact CD1-CD2 3.72Å; I304-L396 HydrophobicContact CG1-CB 3.82Å; I304-L396 HydrophobicContact CG2-CB 3.88Å; I304-L396 HydrophobicContact CG2-CD2 4.26Å; C305-L396 PolarHBondContact O-N 2.89Å; L306-L396 HydrophobicContact CD2-CB 4.01Å; L306-L396 HydrophobicContact CD2-CD2 3.99Å; P307-L396 VanDerWaalsContact CD-O 3.28Å; P307-L396 WeakPolarHBondContact CD-O 3.41Å; P385-L396 HydrophobicContact CB-CD1 3.63Å; L396-G398 WeakPolarHBondContact CD1-O 3.31Å; L396-I399 HydrophobicContact CD2-CG1 4.47Å; L396-V418 HydrophobicContact CD2-CG1 4.3Å; L396-V418 HydrophobicContact CD2-CG2 3.97Å; L396-V418 HydrophobicContact CG-CG2 4.05Å
397	L	98.3	Very high	88.3	Confident	3 Å²	3	33.5 Å²	33.5	2%	0.016	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	-36.8	179	-177	62.9	0	0	0	112	L316 F366 L386 T388 F395 V418	L316-L397 HydrophobicContact CB-CD1 4.21Å; L316-L397 HydrophobicContact CD1-CD1 4.49Å; F366-L397 HydrophobicContact CZ-CD2 4.49Å; F366-L397 HydrophobicContact CZ-CG 4.13Å; L386-L397 HydrophobicContact CD2-CB 4.1Å; L386-L397 HydrophobicContact CD2-CD2 4.01Å; L386-L397 HydrophobicContact CD2-CG 4.14Å; L386-L397 PolarHBondContact O-N 3.38Å; T388-L397 WeakPolarHBondContact OG1-CD2 3.4Å; F395-L397 PolarHBondContact O-N 3.11Å; L397-V418 PolarHBondContact O-N 3.38Å
398	G	97.9	Very high	86.7	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	168	-179.1	0	0	0	0	0	113.7	L386 L396 T416	L386-G398 PolarHBondContact N-O 2.89Å; L386-G398 PolarHBondContact O-N 3.47Å; L386-G398 VanDerWaalsContact O-N 3.12Å; L396-G398 WeakPolarHBondContact CD1-O 3.31Å; G398-T416 WeakPolarHBondContact CA-O 3.47Å
399	I	98.2	Very high	85.3	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	131.6	172.1	-64.6	169.6	0	0	0	107.7	L233 A235 I286 G384 L396 S401 Y415 T416 V418	L233-I399 HydrophobicContact CB-CD1 4.31Å; A235-I399 HydrophobicContact CB-CG2 4.27Å; I286-I399 HydrophobicContact CB-CD1 4.48Å; I286-I399 HydrophobicContact CD1-CD1 3.74Å; I286-I399 HydrophobicContact CG1-CD1 3.7Å; G384-I399 WeakPolarHBondContact O-CA 3.28Å; L396-I399 HydrophobicContact CD2-CG1 4.47Å; I399-S401 PolarHBondContact O-N 3.03Å; I399-Y415 CarbonylContact O-C 3.55Å; I399-Y415 VanDerWaalsContact O-CA 3.23Å; I399-Y415 WeakPolarHBondContact O-CA 3.42Å; I399-T416 PolarHBondContact N-O 2.9Å; I399-T416 VanDerWaalsContact N-O 3.12Å; I399-T416 PolarHBondContact O-N 3.06Å; I399-V418 HydrophobicContact CD1-CG2 4.1Å; I399-V418 HydrophobicContact CG1-CG2 3.89Å
400	V	95.5	Very high	84.1	Confident	6 Å²	6	39.2 Å²	39.2	4%	0.036	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.2	121.6	176.2	179.8	0	0	0	0	108.5	V324 D381 G383 G384 Y415	V324-V400 HydrophobicContact CG1-CG2 3.76Å; D381-V400 HydrophobicContact CB-CG1 4.16Å; D381-V400 WeakPolarHBondContact O-CB 2.91Å; G383-V400 PolarHBondContact N-O 2.83Å; G384-V400 WeakPolarHBondContact O-CG2 3.02Å; G384-V400 PolarHBondContact O-N 2.78Å; V400-Y415 HydrophobicContact CB-CE1 4.35Å; V400-Y415 HydrophobicContact CG2-CD1 4.15Å; V400-Y415 HydrophobicContact CG2-CE1 3.66Å
401	S	91.1	Very high	83.2	Confident	3 Å²	3	39 Å²	39	2%	0.021	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	-73.6	-172.5	178	0	0	0	0	111.5	H237 D285 I399 I414	H237-S401 PolarHBondContact CE1-O 2.02Å; D285-S401 WeakPolarHBondContact CB-OG 3.4Å; D285-S401 WeakPolarHBondContact OD2-CB 3.04Å; D285-S401 PolarHBondContact OD2-OG 2.86Å; I399-S401 PolarHBondContact O-N 3.03Å; S401-I414 WeakPolarHBondContact CB-O 3.33Å; S401-I414 PolarHBondContact N-O 3.38Å; S401-I414 VanDerWaalsContact N-O 3.15Å
402	W	83.2	Confident	82.9	Confident	64 Å²	64	35.8 Å²	35.8	24%	0.242	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	173.1	-177	66.7	-87.5	0	0	0	112.6	V282 V359 I414	V282-W402 HydrophobicContact CB-CG 4.21Å; V282-W402 HydrophobicContact CG1-CB 4.41Å; V282-W402 HydrophobicContact CG1-CG 4.2Å; V282-W402 HydrophobicContact CG2-CG 4.29Å; V359-W402 HydrophobicContact CB-CH2 3.95Å; V359-W402 HydrophobicContact CG1-CH2 3.76Å; V359-W402 HydrophobicContact CG1-CZ3 4.01Å; W402-I414 HydrophobicContact CD2-CB 4.15Å; W402-I414 HydrophobicContact CD2-CD1 4Å; W402-I414 HydrophobicContact CD2-CG1 4.3Å; W402-I414 HydrophobicContact CE3-CD1 3.78Å; W402-I414 HydrophobicContact CG-CB 4.36Å; W402-I414 HydrophobicContact CH2-CD1 3.86Å; W402-I414 HydrophobicContact CH2-CG1 4.17Å; W402-I414 HydrophobicContact CZ2-CB 4.3Å; W402-I414 HydrophobicContact CZ2-CD1 4.08Å; W402-I414 HydrophobicContact CZ2-CG1 3.92Å; W402-I414 HydrophobicContact CZ2-CG2 4.19Å; W402-I414 HydrophobicContact CZ3-CD1 3.71Å; W402-I414 HydrophobicContact CZ3-CG1 4.45Å; W402-I414 PolarHBondContact N-O 3.41Å; W402-I414 WeakPolarHBondContact O-CA 3Å; W402-I414 WeakPolarHBondContact O-CB 3.14Å; W402-I414 WeakPolarHBondContact O-CD1 3.33Å; W402-I414 PolarHBondContact O-N 2.87Å
403	G	77	Confident	82.7	Confident	31 Å²	31	27.7 Å²	27.7	32%	0.32	16%	0.159	S	C	.	.			trans	-162.6	158.6	177.6	0	0	0	0	0	111.7	G405	G403-G405 VanDerWaalsContact C-N 3.31Å; G403-G405 CarbonylContact C-O 3.59Å; G403-G405 PolarHBondContact O-N 2.95Å
404	K	66.6	Low	82.6	Confident	87 Å²	87	27.6 Å²	27.6	38%	0.378	16%	0.158	S	C	.	.	S	Bend	trans	-77.6	83.8	171.2	-82.3	-175.9	176.5	176.6	0	109.4	S357 G358 V359 R408 N411	S357-K404 PolarHBondContact O-NZ 3.42Å; G358-K404 PolarHBondContact O-NZ 2.93Å; V359-K404 HydrophobicContact CG1-CD 3.89Å; V359-K404 HydrophobicContact CG1-CG 4.16Å; K404-R408 WeakPolarHBondContact O-CD 3.41Å; K404-N411 HydrophobicContact CB-CB 4.22Å; K404-N411 WeakPolarHBondContact CB-OD1 3.4Å; K404-N411 WeakPolarHBondContact CD-OD1 3.33Å
405	G	60.6	Low	82.4	Confident	26 Å²	26	26.1 Å²	26.1	27%	0.268	15%	0.151	S	C	.	.	S	Bend	trans	75.8	-166.3	-169.8	0	0	0	0	0	111.2	G403	G403-G405 VanDerWaalsContact C-N 3.31Å; G403-G405 CarbonylContact C-O 3.59Å; G403-G405 PolarHBondContact O-N 2.95Å
406	C	62.9	Low	82.4	Confident	8 Å²	8	26.2 Å²	26.2	5%	0.054	15%	0.152	C	C	.	.	S	Bend	trans	-122.1	128.9	173.1	-57.7	0	0	0	0	109.6	E332 C378 K379 R408	E332-C406 HydrophobicContact CB-CB 4.29Å; C378-C406 WeakPolarHBondContact CA-SG 3.14Å; C378-C406 HydrophobicContact CB-CB 3.43Å; C378-C406 VanDerWaalsContact CB-CB 3.43Å; C378-C406 WeakPolarHBondContact CB-SG 3.06Å; C378-C406 WeakPolarHBondContact SG-CB 3.34Å; C378-C406 CovalentContact SG-SG 2.01Å; C378-C406 PolarHBondContact SG-SG 2.87Å; K379-C406 PolarHBondContact N-SG 3.35Å; C406-R408 PolarHBondContact O-N 3.49Å; C406-R408 VanDerWaalsContact O-N 3.08Å
407	A	58.6	Low	82.4	Confident	31 Å²	31	27.7 Å²	27.7	26%	0.256	16%	0.158	S	C	.	.	S	Bend	trans	57.3	28.8	173.5	0	0	0	0	0	111.8	G373 D376 P409	G373-A407 CarbonylContact C-O 3.56Å; G373-A407 WeakPolarHBondContact CA-O 3.5Å; G373-A407 CarbonylContact O-C 3.58Å; G373-A407 WeakPolarHBondContact O-CA 2.7Å; G373-A407 VanDerWaalsContact O-CB 3.22Å; G373-A407 WeakPolarHBondContact O-CB 3.48Å; D376-A407 HydrophobicContact CB-CB 3.99Å; D376-A407 PolarHBondContact OD2-N 2.83Å; A407-P409 WeakPolarHBondContact O-CD 3.23Å
408	R	64	Low	82.4	Confident	119 Å²	119	27.6 Å²	27.6	45%	0.449	16%	0.157	S	C	.	.			trans	-79.6	123.9	173.8	-74.7	-168.5	179.4	-174.6	-0.2	108.2	E332 K404 C406 G410 N411	E332-R408 VanDerWaalsContact CD-NE 3.26Å; E332-R408 IonicContact OE1-CZ 3.35Å; E332-R408 IonicContact OE1-NE 3.15Å; E332-R408 PolarHBondContact OE1-NE 3.31Å; E332-R408 IonicContact OE1-NH2 2.86Å; E332-R408 PolarHBondContact OE1-NH2 2.95Å; E332-R408 WeakPolarHBondContact OE2-CG 3.33Å; E332-R408 IonicContact OE2-CZ 2.62Å; E332-R408 IonicContact OE2-NE 3.56Å; E332-R408 PolarHBondContact OE2-NE 3.43Å; E332-R408 IonicContact OE2-NH2 3.27Å; E332-R408 PolarHBondContact OE2-NH2 2.94Å; K404-R408 WeakPolarHBondContact O-CD 3.41Å; C406-R408 PolarHBondContact O-N 3.49Å; C406-R408 VanDerWaalsContact O-N 3.08Å; R408-G410 PolarHBondContact O-N 3.03Å; R408-N411 PolarHBondContact O-N 3.25Å; R408-N411 VanDerWaalsContact O-N 3.16Å
409	P	69.2	Low	82.4	Confident	101 Å²	101	27.9 Å²	27.9	66%	0.656	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50.5	137.4	170.8	-25.4	33.8	0	0	0	110.6	L371 A407	L371-P409 CarbonylContact O-C 3.51Å; L371-P409 WeakPolarHBondContact O-CA 3.39Å; A407-P409 WeakPolarHBondContact O-CD 3.23Å
410	G	70	Confident	82.4	Confident	26 Å²	26	30 Å²	30	27%	0.268	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	92.1	-1.8	-176.5	0	0	0	0	0	115.4	S357 L371 R408	S357-G410 PolarHBondContact OG-O 2.81Å; L371-G410 VanDerWaalsContact CD1-C 3.41Å; L371-G410 WeakPolarHBondContact CD1-O 3.35Å; L371-G410 PolarHBondContact O-N 3.27Å; R408-G410 PolarHBondContact O-N 3.03Å
411	N	78.3	Confident	82.5	Confident	24 Å²	24	29.9 Å²	29.9	13%	0.128	17%	0.169	C	C	.	.			trans	-125.7	143	-177	-58.7	-77.6	0	0	0	112.8	S357 K404 R408	S357-N411 WeakPolarHBondContact OG-CA 3.49Å; K404-N411 HydrophobicContact CB-CB 4.22Å; K404-N411 WeakPolarHBondContact CB-OD1 3.4Å; K404-N411 WeakPolarHBondContact CD-OD1 3.33Å; R408-N411 PolarHBondContact O-N 3.25Å; R408-N411 VanDerWaalsContact O-N 3.16Å
412	Y	85.8	Confident	82.9	Confident	18 Å²	18	30.7 Å²	30.7	7%	0.071	17%	0.173	C	C	.	.			trans	-101.8	156.4	170.2	-61.8	-67.8	0	0	0	111	I348 C353 Q356 S357 C367 G369 L371 I414	I348-Y412 HydrophobicContact CD1-CD1 4.4Å; I348-Y412 HydrophobicContact CD1-CE1 3.79Å; I348-Y412 HydrophobicContact CG1-CD1 3.72Å; I348-Y412 HydrophobicContact CG1-CE1 3.57Å; I348-Y412 HydrophobicContact CG1-CE2 4.39Å; I348-Y412 HydrophobicContact CG1-CG 4.18Å; I348-Y412 HydrophobicContact CG2-CD2 4.21Å; I348-Y412 HydrophobicContact CG2-CE1 4.45Å; I348-Y412 HydrophobicContact CG2-CE2 3.81Å; C353-Y412 HydrophobicContact CB-CD2 4.21Å; Q356-Y412 HydrophobicContact CB-CE2 4.29Å; Q356-Y412 PolarHBondContact OE1-OH 2.04Å; S357-Y412 VanDerWaalsContact OG-CD2 3.32Å; S357-Y412 WeakPolarHBondContact OG-CD2 3.34Å; S357-Y412 PolarHBondContact OG-N 3.41Å; C367-Y412 HydrophobicContact CB-CG 4.49Å; G369-Y412 WeakPolarHBondContact O-CD1 3.35Å; G369-Y412 WeakPolarHBondContact O-CE1 3.48Å; L371-Y412 HydrophobicContact CB-CE1 4.09Å; L371-Y412 HydrophobicContact CD1-CD2 4.29Å; L371-Y412 HydrophobicContact CD1-CE1 4.28Å; L371-Y412 HydrophobicContact CD1-CE2 3.71Å; Y412-I414 WeakPolarHBondContact O-CD1 3.42Å
413	G	88.3	Confident	83.5	Confident	1 Å²	1	34.4 Å²	34.4	1%	0.01	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	140.1	167.4	0	0	0	0	0	111.1	C367 A368 Y415	C367-G413 VanDerWaalsContact CA-O 3.28Å; C367-G413 WeakPolarHBondContact CA-O 3.05Å; A368-G413 PolarHBondContact N-O 2.02Å; A368-G413 VanDerWaalsContact N-O 3.07Å; A368-G413 PolarHBondContact O-N 3.41Å; G413-Y415 WeakPolarHBondContact O-CD2 3.23Å; G413-Y415 WeakPolarHBondContact O-CE2 3.17Å
414	I	92.7	Very high	84.5	Confident	1 Å²	1	34.3 Å²	34.3	1%	0.005	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	131.8	177.3	-60.3	89.1	0	0	0	109.4	L361 M365 S401 W402 Y412	L361-I414 HydrophobicContact CD2-CG1 3.9Å; L361-I414 HydrophobicContact CD2-CG2 3.92Å; M365-I414 HydrophobicContact CB-CG2 3.95Å; M365-I414 HydrophobicContact CG-CG2 4.21Å; M365-I414 HydrophobicContact SD-CG2 4.09Å; S401-I414 WeakPolarHBondContact CB-O 3.33Å; S401-I414 PolarHBondContact N-O 3.38Å; S401-I414 VanDerWaalsContact N-O 3.15Å; W402-I414 HydrophobicContact CD2-CB 4.15Å; W402-I414 HydrophobicContact CD2-CD1 4Å; W402-I414 HydrophobicContact CD2-CG1 4.3Å; W402-I414 HydrophobicContact CE3-CD1 3.78Å; W402-I414 HydrophobicContact CG-CB 4.36Å; W402-I414 HydrophobicContact CH2-CD1 3.86Å; W402-I414 HydrophobicContact CH2-CG1 4.17Å; W402-I414 HydrophobicContact CZ2-CB 4.3Å; W402-I414 HydrophobicContact CZ2-CD1 4.08Å; W402-I414 HydrophobicContact CZ2-CG1 3.92Å; W402-I414 HydrophobicContact CZ2-CG2 4.19Å; W402-I414 HydrophobicContact CZ3-CD1 3.71Å; W402-I414 HydrophobicContact CZ3-CG1 4.45Å; W402-I414 PolarHBondContact N-O 3.41Å; W402-I414 WeakPolarHBondContact O-CA 3Å; W402-I414 WeakPolarHBondContact O-CB 3.14Å; W402-I414 WeakPolarHBondContact O-CD1 3.33Å; W402-I414 PolarHBondContact O-N 2.87Å; Y412-I414 WeakPolarHBondContact O-CD1 3.42Å
415	Y	95.9	Very high	86	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	141.7	-175.5	-60.4	-100.9	0	0	0	110.3	V324 M365 F366 A368 S377 L386 I399 V400 G413	V324-Y415 HydrophobicContact CG2-CE1 3.91Å; V324-Y415 WeakPolarHBondContact CG2-OH 3.41Å; M365-Y415 VanDerWaalsContact CA-O 3.31Å; M365-Y415 WeakPolarHBondContact CA-O 3.37Å; F366-Y415 HydrophobicContact CZ-CG 4.46Å; F366-Y415 PolarHBondContact N-O 3.17Å; F366-Y415 PolarHBondContact O-N 3.26Å; A368-Y415 HydrophobicContact CB-CD2 4.02Å; A368-Y415 HydrophobicContact CB-CE2 3.71Å; S377-Y415 PolarHBondContact OG-OH 2.81Å; L386-Y415 HydrophobicContact CB-CD1 3.73Å; L386-Y415 HydrophobicContact CB-CE1 3.87Å; L386-Y415 HydrophobicContact CD1-CD1 4.24Å; L386-Y415 HydrophobicContact CD1-CE1 3.83Å; L386-Y415 HydrophobicContact CD2-CD1 4.46Å; L386-Y415 HydrophobicContact CG-CD1 4.35Å; L386-Y415 HydrophobicContact CG-CE1 4.36Å; I399-Y415 CarbonylContact O-C 3.55Å; I399-Y415 VanDerWaalsContact O-CA 3.23Å; I399-Y415 WeakPolarHBondContact O-CA 3.42Å; V400-Y415 HydrophobicContact CB-CE1 4.35Å; V400-Y415 HydrophobicContact CG2-CD1 4.15Å; V400-Y415 HydrophobicContact CG2-CE1 3.66Å; G413-Y415 WeakPolarHBondContact O-CD2 3.23Å; G413-Y415 WeakPolarHBondContact O-CE2 3.17Å
416	T	98.3	Very high	87.7	Confident	2 Å²	2	34 Å²	34	1%	0.012	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	130.2	168.1	-57.4	0	0	0	0	109.1	D285 I286 G398 I399 V418 Y421	D285-T416 PolarHBondContact O-OG1 2.91Å; I286-T416 HydrophobicContact CB-CG2 4.14Å; G398-T416 WeakPolarHBondContact CA-O 3.47Å; I399-T416 PolarHBondContact N-O 2.9Å; I399-T416 VanDerWaalsContact N-O 3.12Å; I399-T416 PolarHBondContact O-N 3.06Å; T416-V418 PolarHBondContact O-N 3.21Å; T416-Y421 HydrophobicContact CG2-CD2 4Å; T416-Y421 HydrophobicContact CG2-CE2 3.46Å; T416-Y421 VanDerWaalsContact CG2-CE2 3.46Å
417	R	97.9	Very high	89.3	Confident	31 Å²	31	39 Å²	39	12%	0.117	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	101.6	179.9	-178.2	-163.5	-67.9	-107.9	-15.4	110.8	E313 K363 N364 F366 S419 N420 Y421	E313-R417 IonicContact OE1-NH1 3.29Å; E313-R417 PolarHBondContact OE1-NH1 3.1Å; E313-R417 VanDerWaalsContact OE1-NH1 3.15Å; K363-R417 PolarHBondContact O-NE 3.05Å; N364-R417 VanDerWaalsContact O-CB 3.27Å; N364-R417 WeakPolarHBondContact O-CB 3.48Å; N364-R417 PolarHBondContact O-N 3.13Å; F366-R417 HydrophobicContact CD1-CB 3.91Å; F366-R417 HydrophobicContact CD1-CG 4.43Å; F366-R417 HydrophobicContact CE1-CB 4.25Å; R417-S419 VanDerWaalsContact C-N 3.27Å; R417-S419 WeakPolarHBondContact CD-OG 3.5Å; R417-S419 VanDerWaalsContact CG-OG 3.28Å; R417-S419 WeakPolarHBondContact CG-OG 3.32Å; R417-S419 PolarHBondContact O-N 3.11Å; R417-N420 VanDerWaalsContact CD-CG 3.49Å; R417-N420 VanDerWaalsContact CD-OD1 3.31Å; R417-N420 WeakPolarHBondContact CD-OD1 3.38Å; R417-N420 PolarHBondContact O-N 3.47Å; R417-Y421 WeakPolarHBondContact O-CD2 3.39Å; R417-Y421 WeakPolarHBondContact O-CE2 3.44Å
418	V	98.4	Very high	91	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-61.7	-32.6	-176.3	171.1	0	0	0	0	112.9	L306 L396 L397 I399 T416 N420 Y421 L422 I425	L306-V418 HydrophobicContact CD2-CG1 4.02Å; L396-V418 HydrophobicContact CD2-CG1 4.3Å; L396-V418 HydrophobicContact CD2-CG2 3.97Å; L396-V418 HydrophobicContact CG-CG2 4.05Å; L397-V418 PolarHBondContact O-N 3.38Å; I399-V418 HydrophobicContact CD1-CG2 4.1Å; I399-V418 HydrophobicContact CG1-CG2 3.89Å; T416-V418 PolarHBondContact O-N 3.21Å; V418-N420 PolarHBondContact O-N 2.94Å; V418-N420 VanDerWaalsContact O-N 3.07Å; V418-Y421 PolarHBondContact O-N 2.73Å; V418-L422 HydrophobicContact CG1-CD2 4.19Å; V418-L422 PolarHBondContact O-N 3.29Å; V418-I425 HydrophobicContact CG1-CD1 4.26Å
419	S	97.9	Very high	92.5	Very high	7 Å²	7	37.6 Å²	37.6	5%	0.049	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-59.1	-22.9	179	64.7	0	0	0	0	114.4	E313 R417 Y421	E313-S419 PolarHBondContact OE1-OG 3.18Å; R417-S419 VanDerWaalsContact C-N 3.27Å; R417-S419 WeakPolarHBondContact CD-OG 3.5Å; R417-S419 VanDerWaalsContact CG-OG 3.28Å; R417-S419 WeakPolarHBondContact CG-OG 3.32Å; R417-S419 PolarHBondContact O-N 3.11Å; S419-Y421 VanDerWaalsContact C-N 3.34Å
420	N	98.1	Very high	93.4	Very high	43 Å²	43	35.7 Å²	35.7	23%	0.23	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-80.5	-13.4	175.5	-76.5	3.3	0	0	0	113.5	K363 N364 R417 V418	K363-N420 PolarHBondContact O-ND2 3.45Å; K363-N420 VanDerWaalsContact O-ND2 3.11Å; N364-N420 PolarHBondContact OD1-ND2 3.14Å; R417-N420 VanDerWaalsContact CD-CG 3.49Å; R417-N420 VanDerWaalsContact CD-OD1 3.31Å; R417-N420 WeakPolarHBondContact CD-OD1 3.38Å; R417-N420 PolarHBondContact O-N 3.47Å; V418-N420 PolarHBondContact O-N 2.94Å; V418-N420 VanDerWaalsContact O-N 3.07Å
421	Y	98.5	Very high	93.4	Very high	5 Å²	5	40.2 Å²	40.2	2%	0.02	21%	0.206	C	C	.	.	S	Bend	trans	-115.4	4.9	-172.6	-60	-78.9	0	0	0	113.3	H274 N284 I286 N364 T416 R417 V418 S419 E423 W424 I425	H274-Y421 AromaticContact CD2-CD1 3.54Å; H274-Y421 AromaticContact CD2-CE1 3.59Å; H274-Y421 AromaticContact NE2-CD1 3.55Å; H274-Y421 AromaticContact NE2-CE1 3.46Å; H274-Y421 WeakPolarHBondContact NE2-CE1 3.42Å; N284-Y421 VanDerWaalsContact CA-OH 3.26Å; N284-Y421 WeakPolarHBondContact CA-OH 3.43Å; N284-Y421 HydrophobicContact CB-CE1 4.27Å; N284-Y421 PolarHBondContact OD1-OH 2.84Å; I286-Y421 HydrophobicContact CD1-CD2 4.18Å; I286-Y421 HydrophobicContact CD1-CG 4.04Å; I286-Y421 HydrophobicContact CG2-CD1 3.67Å; I286-Y421 HydrophobicContact CG2-CD2 4.16Å; I286-Y421 HydrophobicContact CG2-CE1 3.81Å; I286-Y421 HydrophobicContact CG2-CE2 4.3Å; I286-Y421 HydrophobicContact CG2-CG 3.86Å; N364-Y421 HydrophobicContact CB-CE2 4.3Å; N364-Y421 WeakPolarHBondContact CB-OH 3.05Å; N364-Y421 PolarHBondContact ND2-OH 3.04Å; T416-Y421 HydrophobicContact CG2-CD2 4Å; T416-Y421 HydrophobicContact CG2-CE2 3.46Å; T416-Y421 VanDerWaalsContact CG2-CE2 3.46Å; R417-Y421 WeakPolarHBondContact O-CD2 3.39Å; R417-Y421 WeakPolarHBondContact O-CE2 3.44Å; V418-Y421 PolarHBondContact O-N 2.73Å; S419-Y421 VanDerWaalsContact C-N 3.34Å; Y421-E423 VanDerWaalsContact C-N 3.3Å; Y421-E423 PolarHBondContact O-N 3.17Å; Y421-W424 PolarHBondContact O-N 2.71Å; Y421-W424 VanDerWaalsContact O-N 3.11Å; Y421-I425 VanDerWaalsContact O-CG1 3.24Å; Y421-I425 WeakPolarHBondContact O-CG1 3.21Å; Y421-I425 PolarHBondContact O-N 3.06Å
422	L	97.8	Very high	92.2	Very high	20 Å²	20	44.2 Å²	44.2	11%	0.105	23%	0.234	C	C	.	.	H	α-helix	trans	-54.2	-46.1	-176.3	-63.3	172.3	0	0	0	112.3	L306 P307 R309 V418 I425 Q426	L306-L422 HydrophobicContact CB-CD2 4.09Å; L306-L422 HydrophobicContact CD1-CD2 4.35Å; P307-L422 WeakPolarHBondContact O-CD1 3.4Å; P307-L422 WeakPolarHBondContact O-CD2 3.31Å; R309-L422 HydrophobicContact CB-CD1 4.41Å; V418-L422 HydrophobicContact CG1-CD2 4.19Å; V418-L422 PolarHBondContact O-N 3.29Å; L422-I425 PolarHBondContact O-N 3.16Å; L422-Q426 WeakPolarHBondContact O-CB 3.36Å; L422-Q426 VanDerWaalsContact O-CG 3.26Å; L422-Q426 WeakPolarHBondContact O-CG 3.2Å; L422-Q426 PolarHBondContact O-N 3.36Å
423	E	97.1	Very high	90.1	Very high	141 Å²	141	49.9 Å²	49.9	66%	0.659	27%	0.269	S	S	*	.	H	α-helix	trans	-64.9	-44.1	177.8	-173.2	-177.4	176.3	0	0	111.9	Y421 I425 Q426 N427	Y421-E423 VanDerWaalsContact C-N 3.3Å; Y421-E423 PolarHBondContact O-N 3.17Å; E423-I425 VanDerWaalsContact C-N 3.34Å; E423-I425 PolarHBondContact O-N 3.32Å; E423-Q426 PolarHBondContact O-N 3.03Å; E423-N427 WeakPolarHBondContact O-CB 3.42Å; E423-N427 VanDerWaalsContact O-CG 3.26Å; E423-N427 PolarHBondContact O-N 3.39Å
424	W	98	Very high	87.7	Confident	29 Å²	29	55.9 Å²	55.9	11%	0.11	31%	0.306	C	S	.	.	H	α-helix	trans	-60.1	-44.5	176.2	177.4	89.1	0	0	0	111.5	I272 H274 E275 I286 L288 Y421 R428	I272-W424 HydrophobicContact CG2-CZ2 4.06Å; H274-W424 HydrophobicContact CB-CZ2 4.12Å; H274-W424 AromaticContact CD2-CD1 3.77Å; H274-W424 AromaticContact CD2-CD2 3.7Å; H274-W424 AromaticContact CD2-CE2 3.64Å; H274-W424 AromaticContact CD2-CG 3.82Å; H274-W424 AromaticContact CD2-NE1 3.65Å; H274-W424 AromaticContact NE2-CD1 3.9Å; E275-W424 PolarHBondContact OE1-NE1 2.97Å; E275-W424 PolarHBondContact OE2-NE1 3.39Å; I286-W424 HydrophobicContact CD1-CZ3 4.42Å; I286-W424 HydrophobicContact CG1-CZ3 4.15Å; I286-W424 HydrophobicContact CG2-CZ3 4.36Å; L288-W424 HydrophobicContact CB-CH2 4.26Å; L288-W424 HydrophobicContact CD1-CE3 4.23Å; L288-W424 HydrophobicContact CD1-CH2 3.73Å; L288-W424 HydrophobicContact CD1-CZ2 4.46Å; L288-W424 HydrophobicContact CD1-CZ3 3.6Å; L288-W424 HydrophobicContact CG-CH2 3.84Å; L288-W424 HydrophobicContact CG-CZ3 3.75Å; Y421-W424 PolarHBondContact O-N 2.71Å; Y421-W424 VanDerWaalsContact O-N 3.11Å; W424-R428 HydrophobicContact CD2-CG 4.38Å; W424-R428 HydrophobicContact CZ2-CG 4.42Å; W424-R428 WeakPolarHBondContact O-CB 3.4Å; W424-R428 VanDerWaalsContact O-CG 3.3Å; W424-R428 WeakPolarHBondContact O-CG 3.38Å; W424-R428 PolarHBondContact O-N 2.8Å
425	I	98.2	Very high	85	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-61.6	-47	176.3	-63.4	166	0	0	0	110.1	Y227 L233 I286 L306 V418 Y421 L422 E423 T429	Y227-I425 HydrophobicContact CD1-CG2 3.86Å; Y227-I425 HydrophobicContact CE1-CG2 3.42Å; Y227-I425 VanDerWaalsContact CE1-CG2 3.42Å; L233-I425 HydrophobicContact CD1-CD1 4.23Å; L233-I425 HydrophobicContact CD2-CD1 3.87Å; L233-I425 HydrophobicContact CD2-CG1 3.92Å; L233-I425 HydrophobicContact CD2-CG2 4.35Å; I286-I425 HydrophobicContact CD1-CD1 4.07Å; I286-I425 HydrophobicContact CD1-CG1 4.39Å; L306-I425 HydrophobicContact CD1-CB 4.46Å; L306-I425 HydrophobicContact CD1-CD1 4.11Å; L306-I425 HydrophobicContact CD1-CG2 3.82Å; V418-I425 HydrophobicContact CG1-CD1 4.26Å; Y421-I425 VanDerWaalsContact O-CG1 3.24Å; Y421-I425 WeakPolarHBondContact O-CG1 3.21Å; Y421-I425 PolarHBondContact O-N 3.06Å; L422-I425 PolarHBondContact O-N 3.16Å; E423-I425 VanDerWaalsContact C-N 3.34Å; E423-I425 PolarHBondContact O-N 3.32Å; I425-T429 HydrophobicContact CG2-CG2 4.45Å; I425-T429 WeakPolarHBondContact O-CB 3.31Å; I425-T429 VanDerWaalsContact O-CG2 3.24Å; I425-T429 WeakPolarHBondContact O-CG2 3.43Å; I425-T429 PolarHBondContact O-N 3.31Å; I425-T429 VanDerWaalsContact O-N 3.09Å; I425-T429 PolarHBondContact O-OG1 3.43Å
426	Q	95.4	Very high	82.1	Confident	108 Å²	108	65.8 Å²	65.8	51%	0.505	37%	0.371	S	S	.	.	H	α-helix	trans	-62.9	-48.4	-179.9	-74.6	172.8	-2.9	0	0	111.7	L422 E423 R428 T429 A430	L422-Q426 WeakPolarHBondContact O-CB 3.36Å; L422-Q426 VanDerWaalsContact O-CG 3.26Å; L422-Q426 WeakPolarHBondContact O-CG 3.2Å; L422-Q426 PolarHBondContact O-N 3.36Å; E423-Q426 PolarHBondContact O-N 3.03Å; Q426-R428 VanDerWaalsContact C-N 3.34Å; Q426-R428 PolarHBondContact O-N 2.91Å; Q426-T429 CarbonylContact O-C 3.5Å; Q426-T429 PolarHBondContact O-N 2.71Å; Q426-A430 WeakPolarHBondContact O-CB 3.42Å; Q426-A430 PolarHBondContact O-N 3.25Å
427	N	95.9	Very high	79.2	Confident	113 Å²	113	71.6 Å²	71.6	60%	0.604	41%	0.407	S	S	*	.	H	α-helix	trans	-61.7	-39.5	-179.3	-72.4	-14.6	0	0	0	112.5	E423	E423-N427 WeakPolarHBondContact O-CB 3.42Å; E423-N427 VanDerWaalsContact O-CG 3.26Å; E423-N427 PolarHBondContact O-N 3.39Å
428	R	95.8	Very high	76.3	Confident	117 Å²	117	75.9 Å²	75.9	44%	0.442	44%	0.437	S	S	.	.	H	α-helix	trans	-76.2	-22.4	179.1	-68.8	-65.5	-174.2	-172.6	-3.2	113.8	W231 E275 L288 W424 Q426	W231-R428 WeakPolarHBondContact CH2-O 3.36Å; E275-R428 IonicContact OE1-CZ 3.05Å; E275-R428 VanDerWaalsContact OE1-CZ 3.31Å; E275-R428 IonicContact OE1-NE 2.77Å; E275-R428 PolarHBondContact OE1-NE 3.03Å; E275-R428 IonicContact OE1-NH2 3.45Å; E275-R428 PolarHBondContact OE1-NH2 3.43Å; L288-R428 HydrophobicContact CD1-CB 3.59Å; L288-R428 HydrophobicContact CD1-CG 4.32Å; W424-R428 HydrophobicContact CD2-CG 4.38Å; W424-R428 HydrophobicContact CZ2-CG 4.42Å; W424-R428 WeakPolarHBondContact O-CB 3.4Å; W424-R428 VanDerWaalsContact O-CG 3.3Å; W424-R428 WeakPolarHBondContact O-CG 3.38Å; W424-R428 PolarHBondContact O-N 2.8Å; Q426-R428 VanDerWaalsContact C-N 3.34Å; Q426-R428 PolarHBondContact O-N 2.91Å
429	T	94.3	Very high	73.4	Confident	2 Å²	2	84.3 Å²	84.3	1%	0.012	48%	0.476	C	S	.	.	H	α-helix	trans	-112	4.9	-176.3	66.5	0	0	0	0	113.8	Y227 K228 W231 L288 I425 Q426 T431	Y227-T429 HydrophobicContact CD1-CG2 4.27Å; Y227-T429 HydrophobicContact CE1-CG2 4.02Å; Y227-T429 WeakPolarHBondContact CE1-OG1 3.32Å; K228-T429 PolarHBondContact NZ-O 2.95Å; W231-T429 HydrophobicContact CB-CG2 4.27Å; W231-T429 HydrophobicContact CD2-CG2 3.58Å; W231-T429 HydrophobicContact CE3-CG2 3.89Å; W231-T429 HydrophobicContact CG-CG2 3.77Å; W231-T429 HydrophobicContact CZ2-CG2 4.38Å; W231-T429 HydrophobicContact CZ3-CG2 4.4Å; L288-T429 HydrophobicContact CD1-CG2 3.92Å; L288-T429 HydrophobicContact CD2-CG2 3.99Å; I425-T429 HydrophobicContact CG2-CG2 4.45Å; I425-T429 WeakPolarHBondContact O-CB 3.31Å; I425-T429 VanDerWaalsContact O-CG2 3.24Å; I425-T429 WeakPolarHBondContact O-CG2 3.43Å; I425-T429 PolarHBondContact O-N 3.31Å; I425-T429 VanDerWaalsContact O-N 3.09Å; I425-T429 PolarHBondContact O-OG1 3.43Å; Q426-T429 CarbonylContact O-C 3.5Å; Q426-T429 PolarHBondContact O-N 2.71Å; T429-T431 PolarHBondContact O-N 2.9Å
430	A	88.1	Confident	70.4	Confident	61 Å²	61	90.1 Å²	90.1	50%	0.504	51%	0.512	S	S	.	.	P	Polyproline II helix	trans	-63.2	129.4	171.6	0	0	0	0	0	108.8	Q426	Q426-A430 WeakPolarHBondContact O-CB 3.42Å; Q426-A430 PolarHBondContact O-N 3.25Å
431	T	71.5	Confident	67.5	Low	121 Å²	121	94.1 Å²	94.1	74%	0.742	54%	0.537	S	S	*	.	P	Polyproline II helix	trans	-68.1	129.1	168.3	-42.7	0	0	0	0	106.8	T429 V433	T429-T431 PolarHBondContact O-N 2.9Å; T431-V433 PolarHBondContact O-N 3.47Å
432	P	52.4	Low	64.5	Low	109 Å²	109	99.4 Å²	99.4	71%	0.708	57%	0.572	S	S	*	*	P	Polyproline II helix	trans	-57.1	118.4	172.6	12.6	-17	0	0	0	107.6	T434	P432-T434 VanDerWaalsContact C-N 3.33Å; P432-T434 PolarHBondContact O-N 3.27Å
433	V	40.9	Very low	61.6	Low	136 Å²	136	104 Å²	104	82%	0.824	61%	0.606	S	S	*	*			trans	-61.4	104.1	168.8	179.5	0	0	0	0	104.8	T431 G435	T431-V433 PolarHBondContact O-N 3.47Å; V433-G435 PolarHBondContact O-N 2.89Å
434	T	39.1	Very low	58.8	Low	128 Å²	128	102.1 Å²	102.1	79%	0.785	61%	0.608	S	S	*	*			trans	-64.3	86.1	162.6	45	0	0	0	0	105.8	P432 N436	P432-T434 VanDerWaalsContact C-N 3.33Å; P432-T434 PolarHBondContact O-N 3.27Å; T434-N436 PolarHBondContact O-N 3.29Å; T434-N436 VanDerWaalsContact O-N 3.14Å
435	G	36.2	Very low	56	Low	52 Å²	52	105.2 Å²	105.2	54%	0.536	64%	0.64	S	S	.	*			trans	-58.4	117.9	168.9	0	0	0	0	0	106.7	V433 T437	V433-G435 PolarHBondContact O-N 2.89Å; G435-T437 PolarHBondContact O-N 3.47Å
436	N	34.4	Very low	53.2	Low	156 Å²	156	111.3 Å²	111.3	83%	0.834	68%	0.678	S	S	*	*			trans	-57.3	93.8	157.1	-81.9	-13.8	0	0	0	106.2	T434 T438	T434-N436 PolarHBondContact O-N 3.29Å; T434-N436 VanDerWaalsContact O-N 3.14Å; N436-T438 PolarHBondContact O-N 3.35Å
437	T	37	Very low	50.6	Low	125 Å²	125	112.2 Å²	112.2	77%	0.767	69%	0.69	S	S	*	*			trans	-58.4	101.6	153.3	37.4	0	0	0	0	105.2	G435 E439	G435-T437 PolarHBondContact O-N 3.47Å; T437-E439 PolarHBondContact O-N 2.95Å
438	T	37.8	Very low	48.1	Very low	121 Å²	121	112.9 Å²	112.9	74%	0.742	70%	0.698	S	S	*	*			trans	-54.5	98.5	157.7	41.4	0	0	0	0	106.4	N436 T440	N436-T438 PolarHBondContact O-N 3.35Å; T438-T440 VanDerWaalsContact C-N 3.33Å; T438-T440 PolarHBondContact O-N 2.88Å
439	E	36	Very low	45.5	Very low	177 Å²	177	113.4 Å²	113.4	83%	0.827	71%	0.714	S	S	*	*			trans	-56.6	102.9	162.2	-76.4	-176.8	157	0	0	106.7	T437 V441	T437-E439 PolarHBondContact O-N 2.95Å; E439-V441 VanDerWaalsContact C-N 3.34Å; E439-V441 PolarHBondContact O-N 3.14Å
440	T	36.2	Very low	43	Very low	129 Å²	129	125.7 Å²	125.7	79%	0.791	77%	0.772	S	S	*	*			trans	-66.1	99.9	162.8	43.8	0	0	0	0	107.1	T438	T438-T440 VanDerWaalsContact C-N 3.33Å; T438-T440 PolarHBondContact O-N 2.88Å
441	V	37.1	Very low	40.8	Very low	126 Å²	126	129 Å²	129	76%	0.764	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-54.6	124.8	166.5	178.1	0	0	0	0	108.2	E439 S443	E439-V441 VanDerWaalsContact C-N 3.34Å; E439-V441 PolarHBondContact O-N 3.14Å; V441-S443 PolarHBondContact O-N 2.9Å
442	P	35	Very low	39.2	Very low	117 Å²	117	129.4 Å²	129.4	76%	0.76	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-69.5	122.2	175.6	-9.9	24.6	0	0	0	109.2	S444	P442-S444 PolarHBondContact O-N 2.91Å
443	S	37.3	Very low	38.4	Very low	117 Å²	117	130.5 Å²	130.5	82%	0.818	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-57.2	122.5	167.9	170.5	0	0	0	0	109.8	V441 A445	V441-S443 PolarHBondContact O-N 2.9Å; S443-A445 PolarHBondContact O-N 3.33Å
444	S	38.3	Very low	38.3	Very low	100 Å²	100	130.2 Å²	130.2	70%	0.699	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-49.6	131.3	171.6	50.8	0	0	0	0	112.1	P442	P442-S444 PolarHBondContact O-N 2.91Å
445	A	40.1	Very low	38.2	Very low	94 Å²	94	130.3 Å²	130.3	78%	0.777	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-71.1	123.2	170.2	0	0	0	0	0	110.6	S443 V447	S443-A445 PolarHBondContact O-N 3.33Å; A445-V447 PolarHBondContact O-N 2.65Å
446	T	39.4	Very low	38.4	Very low	128 Å²	128	135.5 Å²	135.5	79%	0.785	81%	0.807	S	S	*	*			trans	-80.1	106.6	168.4	-38.5	0	0	0	0	108.5	T448	T446-T448 PolarHBondContact O-N 3.41Å
447	V	40.2	Very low	38.6	Very low	128 Å²	128	134.1 Å²	134.1	78%	0.776	81%	0.805	S	S	*	*			trans	-68.7	114.2	166.3	174.8	0	0	0	0	107.6	A445	A445-V447 PolarHBondContact O-N 2.65Å
448	T	43.8	Very low	38.8	Very low	126 Å²	126	134.8 Å²	134.8	77%	0.773	81%	0.808	S	S	*	*			trans	-98.9	116.9	168.3	-46.1	0	0	0	0	107.5	T446	T446-T448 PolarHBondContact O-N 3.41Å
449	V	41.6	Very low	38.8	Very low	128 Å²	128	135.9 Å²	135.9	78%	0.776	81%	0.814	S	S	*	*			trans	-79.9	114.4	167.9	174.1	0	0	0	0	107.4
450	Q	41.3	Very low	39.1	Very low	261 Å²	261	132.2 Å²	132.2	100%	1.22	81%	0.813	S	S	*	*			trans	-162	0	143.9	-114.5	176.4	-7.7	0	0	110.7

Retrieved 450 of 450 residues in 650.5 ms (Link to these results)

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