A0A087XFJ0_POEFO Loading...

RING-type E3 ubiquitin transferase

AlphaFold DB , UniProt , Accession A0A087XFJ0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 772 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.3	Very low	29.8	Very low	242 Å²	242	160.8 Å²	160.8	100%	1.192	85%	0.848	S	S	*	*				0	113.1	0	-79.7	-175.2	158.9	0	0	106.4
2	S	26	Very low	30.8	Very low	111 Å²	111	158 Å²	158	78%	0.776	85%	0.852	S	S	*	*			cis	-159.8	146.2	23.5	-60.4	0	0	0	0	109.6
3	L	30.7	Very low	31.8	Very low	167 Å²	167	151.2 Å²	151.2	87%	0.874	82%	0.819	S	S	*	*			trans	-61	143.5	169	-75.9	96.4	0	0	0	111.3
4	I	28	Very low	32.9	Very low	173 Å²	173	145.1 Å²	145.1	89%	0.887	79%	0.793	S	S	*	*			trans	-132.4	135.9	150.4	-62.2	-176.4	0	0	0	109
5	M	26.7	Very low	34.2	Very low	171 Å²	171	142.3 Å²	142.3	84%	0.842	79%	0.785	S	S	*	*			trans	-76.5	140.6	-157.6	-63.9	179.2	127.7	0	0	114.3	K7	M5-K7 PolarHBondContact O-N 3.27Å
6	A	26	Very low	35.2	Very low	102 Å²	102	138.9 Å²	138.9	84%	0.843	77%	0.769	S	S	*	*			trans	-69.3	114.2	160.3	0	0	0	0	0	109.9
7	K	27.3	Very low	36.4	Very low	201 Å²	201	133.4 Å²	133.4	87%	0.874	74%	0.74	S	S	*	*			trans	-81.4	116.6	162.1	-94	-177.6	172.5	-179.2	0	108.6	M5	M5-K7 PolarHBondContact O-N 3.27Å
8	R	29.7	Very low	37.4	Very low	242 Å²	242	132.3 Å²	132.3	91%	0.913	72%	0.723	S	S	*	*			trans	-70.6	119	165.4	-92.2	176	166.8	173.1	-4.5	108.6
9	E	29.6	Very low	38.3	Very low	175 Å²	175	131.3 Å²	131.3	82%	0.818	71%	0.713	S	S	*	*			trans	-104.5	111	159.9	-81.3	-176.5	172.6	0	0	109.8
10	T	35.7	Very low	39.3	Very low	143 Å²	143	127.8 Å²	127.8	88%	0.877	69%	0.692	S	S	*	*			trans	-69.5	116.8	170.4	44.3	0	0	0	0	109.8
11	G	35.1	Very low	40.3	Very low	42 Å²	42	123.4 Å²	123.4	43%	0.433	67%	0.669	S	S	.	*			trans	-164.9	112.3	171.3	0	0	0	0	0	109.7	T13 R18	G11-T13 VanDerWaalsContact C-N 3.34Å; G11-T13 PolarHBondContact O-N 3.41Å; G11-R18 PolarHBondContact O-NH2 2.96Å
12	S	42.3	Very low	41.4	Very low	127 Å²	127	120.1 Å²	120.1	89%	0.888	65%	0.648	S	S	*	*			trans	-72.3	76.8	-173.8	56.3	0	0	0	0	112.5
13	T	43.1	Very low	43	Very low	70 Å²	70	121 Å²	121	43%	0.429	64%	0.64	S	S	.	*			trans	-119.6	133.5	168	46.1	0	0	0	0	109.7	G11 R18	G11-T13 VanDerWaalsContact C-N 3.34Å; G11-T13 PolarHBondContact O-N 3.41Å; T13-R18 VanDerWaalsContact OG1-CG 3.22Å; T13-R18 WeakPolarHBondContact OG1-CG 3.15Å; T13-R18 PolarHBondContact OG1-NE 3.34Å
14	S	47.4	Very low	44.5	Very low	65 Å²	65	119.2 Å²	119.2	46%	0.455	63%	0.625	S	S	.	*			trans	-47.9	138.8	179.7	169	0	0	0	0	110.9	V16 V17 R18	S14-V16 PolarHBondContact O-N 3.49Å; S14-V16 VanDerWaalsContact O-N 3.09Å; S14-V17 WeakPolarHBondContact O-CA 3.38Å; S14-V17 WeakPolarHBondContact O-CB 2.99Å; S14-V17 PolarHBondContact O-N 2.71Å; S14-R18 PolarHBondContact O-N 2.97Å
15	P	52.4	Low	46.6	Very low	103 Å²	103	111 Å²	111	67%	0.669	58%	0.583	S	S	*	*	H	α-helix	trans	-56.2	-29.5	-179	20.4	-31.3	0	0	0	112.8	Q19	P15-Q19 WeakPolarHBondContact O-CB 3.21Å; P15-Q19 PolarHBondContact O-N 3.48Å; P15-Q19 VanDerWaalsContact O-N 3.07Å
16	V	50.8	Low	49.1	Very low	88 Å²	88	104.8 Å²	104.8	53%	0.533	55%	0.554	S	S	.	*	H	α-helix	trans	-67.1	-43.3	174.4	-178.4	0	0	0	0	111.4	S14 Q19 I20	S14-V16 PolarHBondContact O-N 3.49Å; S14-V16 VanDerWaalsContact O-N 3.09Å; V16-Q19 PolarHBondContact O-N 3.41Å; V16-I20 HydrophobicContact CG1-CD1 3.98Å; V16-I20 VanDerWaalsContact O-CG1 3.31Å; V16-I20 WeakPolarHBondContact O-CG1 3.29Å; V16-I20 PolarHBondContact O-N 3.17Å
17	V	54.7	Low	51.7	Low	45 Å²	45	99.9 Å²	99.9	27%	0.273	51%	0.514	S	S	.	.	H	α-helix	trans	-66.1	-41.7	177.6	175.1	0	0	0	0	110.9	S14 Q19 I20 D21 L94	S14-V17 WeakPolarHBondContact O-CA 3.38Å; S14-V17 WeakPolarHBondContact O-CB 2.99Å; S14-V17 PolarHBondContact O-N 2.71Å; V17-Q19 VanDerWaalsContact C-N 3.26Å; V17-Q19 PolarHBondContact O-N 3.5Å; V17-I20 PolarHBondContact O-N 2.89Å; V17-D21 VanDerWaalsContact O-CB 3.28Å; V17-D21 WeakPolarHBondContact O-CB 3.38Å; V17-D21 PolarHBondContact O-N 2.91Å; V17-L94 HydrophobicContact CG1-CD2 3.81Å
18	R	55.1	Low	54.1	Low	115 Å²	115	93.7 Å²	93.7	43%	0.434	50%	0.496	S	S	.	.	H	α-helix	trans	-63.7	-30.9	174.9	-74.4	-178.4	163.1	-151.7	-9.3	113.1	G11 T13 S14 K22	G11-R18 PolarHBondContact O-NH2 2.96Å; T13-R18 VanDerWaalsContact OG1-CG 3.22Å; T13-R18 WeakPolarHBondContact OG1-CG 3.15Å; T13-R18 PolarHBondContact OG1-NE 3.34Å; S14-R18 PolarHBondContact O-N 2.97Å; R18-K22 WeakPolarHBondContact O-CB 3.43Å; R18-K22 WeakPolarHBondContact O-CG 3.43Å; R18-K22 PolarHBondContact O-N 3.03Å
19	Q	54.8	Low	56.4	Low	113 Å²	113	85.1 Å²	85.1	53%	0.528	47%	0.468	S	S	.	.	H	α-helix	trans	-77	-38.8	178.3	-161.4	166	5.8	0	0	111.5	P15 V16 V17 Q23	P15-Q19 WeakPolarHBondContact O-CB 3.21Å; P15-Q19 PolarHBondContact O-N 3.48Å; P15-Q19 VanDerWaalsContact O-N 3.07Å; V16-Q19 PolarHBondContact O-N 3.41Å; V17-Q19 VanDerWaalsContact C-N 3.26Å; V17-Q19 PolarHBondContact O-N 3.5Å; Q19-Q23 VanDerWaalsContact O-CB 3.27Å; Q19-Q23 WeakPolarHBondContact O-CB 3.28Å; Q19-Q23 WeakPolarHBondContact O-CG 3.41Å; Q19-Q23 PolarHBondContact O-N 3.04Å
20	I	57.9	Low	58.9	Low	60 Å²	60	79 Å²	79	31%	0.308	44%	0.444	S	S	.	.	H	α-helix	trans	-65.5	-45.6	173.2	-65.5	165	0	0	0	111	V16 V17 K22 Q23 F24 L90	V16-I20 HydrophobicContact CG1-CD1 3.98Å; V16-I20 VanDerWaalsContact O-CG1 3.31Å; V16-I20 WeakPolarHBondContact O-CG1 3.29Å; V16-I20 PolarHBondContact O-N 3.17Å; V17-I20 PolarHBondContact O-N 2.89Å; I20-K22 PolarHBondContact O-N 3.18Å; I20-Q23 PolarHBondContact O-N 2.83Å; I20-F24 WeakPolarHBondContact O-CB 3.45Å; I20-F24 PolarHBondContact O-N 3.32Å; I20-L90 HydrophobicContact CG2-CD2 4.06Å
21	D	58.9	Low	61	Low	37 Å²	37	78.4 Å²	78.4	20%	0.198	44%	0.435	C	S	.	.	H	α-helix	trans	-62.8	-38.8	-178.9	-164.6	25.5	0	0	0	112.2	V17 V26 R33	V17-D21 VanDerWaalsContact O-CB 3.28Å; V17-D21 WeakPolarHBondContact O-CB 3.38Å; V17-D21 PolarHBondContact O-N 2.91Å; D21-V26 WeakPolarHBondContact O-CG2 3.31Å; D21-R33 IonicContact OD1-CZ 2.95Å; D21-R33 IonicContact OD1-NE 3.75Å; D21-R33 PolarHBondContact OD1-NE 3.13Å; D21-R33 IonicContact OD1-NH2 2.75Å; D21-R33 PolarHBondContact OD1-NH2 2.67Å; D21-R33 IonicContact OD2-CZ 2.81Å; D21-R33 IonicContact OD2-NE 3.47Å; D21-R33 IonicContact OD2-NH2 3.35Å; D21-R33 PolarHBondContact OD2-NH2 3.29Å
22	K	57.8	Low	63.1	Low	172 Å²	172	81.8 Å²	81.8	75%	0.748	44%	0.443	S	S	*	.	H	α-helix	trans	-82.2	-29	178.4	-73.5	-174.1	176.4	-173.7	0	115	R18 I20	R18-K22 WeakPolarHBondContact O-CB 3.43Å; R18-K22 WeakPolarHBondContact O-CG 3.43Å; R18-K22 PolarHBondContact O-N 3.03Å; I20-K22 PolarHBondContact O-N 3.18Å
23	Q	59.3	Low	64.7	Low	130 Å²	130	81.4 Å²	81.4	61%	0.607	42%	0.422	S	S	*	.	H	α-helix	trans	-97.8	-27.2	-174.3	-68.4	-176.1	-19.5	0	0	114.1	Q19 I20	Q19-Q23 VanDerWaalsContact O-CB 3.27Å; Q19-Q23 WeakPolarHBondContact O-CB 3.28Å; Q19-Q23 WeakPolarHBondContact O-CG 3.41Å; Q19-Q23 PolarHBondContact O-N 3.04Å; I20-Q23 PolarHBondContact O-N 2.83Å
24	F	62.1	Low	66.4	Low	129 Å²	129	79.6 Å²	79.6	57%	0.566	41%	0.407	S	S	*	.	H	α-helix	trans	-120.7	-13.1	-170.5	-67.3	-86.2	0	0	0	114.7	I20	I20-F24 WeakPolarHBondContact O-CB 3.45Å; I20-F24 PolarHBondContact O-N 3.32Å
25	L	72.9	Confident	67.7	Low	0 Å²	0	82.6 Å²	82.6	0%	0	41%	0.414	C	S	.	.	S	Bend	trans	-116.7	7.7	-172.5	-67.2	179.5	0	0	0	115	R33 Y34 I87 L90 M91 L94	L25-R33 WeakPolarHBondContact O-CA 3.5Å; L25-Y34 VanDerWaalsContact C-CE2 3.43Å; L25-Y34 WeakPolarHBondContact O-CD2 3.33Å; L25-Y34 PolarHBondContact O-N 3.38Å; L25-I87 HydrophobicContact CD2-CG2 3.82Å; L25-L90 HydrophobicContact CD1-CD2 4.13Å; L25-L90 HydrophobicContact CD2-CB 4.34Å; L25-L90 HydrophobicContact CD2-CD2 3.83Å; L25-L90 HydrophobicContact CG-CD2 4.16Å; L25-M91 HydrophobicContact CB-SD 3.71Å; L25-M91 HydrophobicContact CD1-CG 4.46Å; L25-M91 HydrophobicContact CD1-SD 3.69Å; L25-M91 HydrophobicContact CD2-CG 3.79Å; L25-M91 HydrophobicContact CD2-SD 3.74Å; L25-M91 HydrophobicContact CG-SD 3.91Å; L25-L94 HydrophobicContact CD1-CD1 3.47Å; L25-L94 VanDerWaalsContact CD1-CD1 3.47Å
26	V	78.5	Confident	68.8	Low	41 Å²	41	80.6 Å²	80.6	25%	0.248	40%	0.398	C	S	.	.	B	Isolated β-bridge	trans	-110.4	135.1	-179.2	176.3	0	0	0	0	110.5	D21 L31 D32 Y34	D21-V26 WeakPolarHBondContact O-CG2 3.31Å; V26-L31 WeakPolarHBondContact CG1-O 3.26Å; V26-D32 WeakPolarHBondContact CA-O 3.34Å; V26-Y34 VanDerWaalsContact O-CZ 3.23Å; V26-Y34 PolarHBondContact O-OH 3.24Å
27	C	80.1	Confident	70.2	Confident	0 Å²	0	76.8 Å²	76.8	0%	0	38%	0.375	C	S	.	.			trans	-77	129.5	175.1	-179.5	0	0	0	0	111.2	I29 C30 L31 D32 Y34 C47	C27-I29 PolarHBondContact O-N 3.07Å; C27-I29 VanDerWaalsContact O-N 3.1Å; C27-C30 VanDerWaalsContact CB-SG 3.59Å; C27-L31 WeakPolarHBondContact O-CA 3.36Å; C27-L31 PolarHBondContact O-N 3.48Å; C27-D32 PolarHBondContact N-O 3.39Å; C27-Y34 HydrophobicContact CB-CD1 3.66Å; C27-Y34 HydrophobicContact CB-CE1 3.55Å; C27-C47 WeakPolarHBondContact CB-SG 3.49Å; C27-C47 PolarHBondContact SG-N 3.32Å
28	S	78.1	Confident	71.4	Confident	71 Å²	71	75.2 Å²	75.2	50%	0.497	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-8	-179.5	-42.2	0	0	0	0	115
29	I	78.6	Confident	72.7	Confident	62 Å²	62	71.1 Å²	71.1	32%	0.318	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-54.3	178.7	-59.4	169.8	0	0	0	110.7	C27 F46 C50 L51 P65	C27-I29 PolarHBondContact O-N 3.07Å; C27-I29 VanDerWaalsContact O-N 3.1Å; I29-F46 HydrophobicContact CD1-CB 4.26Å; I29-F46 HydrophobicContact CD1-CD1 3.61Å; I29-F46 HydrophobicContact CD1-CE1 4.27Å; I29-F46 HydrophobicContact CD1-CG 4.1Å; I29-F46 HydrophobicContact CG1-CD1 3.77Å; I29-F46 HydrophobicContact CG1-CE1 4.17Å; I29-C50 HydrophobicContact CB-CB 3.92Å; I29-C50 HydrophobicContact CD1-CB 3.88Å; I29-C50 HydrophobicContact CG2-CB 3.85Å; I29-L51 HydrophobicContact CD1-CD2 4.19Å; I29-P65 HydrophobicContact CD1-CG 4.08Å; I29-P65 HydrophobicContact CG1-CG 4.35Å
30	C	81.6	Confident	73.9	Confident	46 Å²	46	65.9 Å²	65.9	31%	0.311	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-10.6	179.1	61	0	0	0	0	113.8	C27 D32	C27-C30 VanDerWaalsContact CB-SG 3.59Å; C30-D32 PolarHBondContact O-N 3.08Å
31	L	79.5	Confident	74.7	Confident	131 Å²	131	67.3 Å²	67.3	69%	0.686	34%	0.341	S	S	*	.	S	Bend	trans	57.4	14.3	-174.8	-54	177.2	0	0	0	114.4	V26 C27	V26-L31 WeakPolarHBondContact CG1-O 3.26Å; C27-L31 WeakPolarHBondContact O-CA 3.36Å; C27-L31 PolarHBondContact O-N 3.48Å
32	D	78.6	Confident	75.5	Confident	112 Å²	112	66.5 Å²	66.5	60%	0.599	34%	0.338	S	S	*	.	S	Bend	trans	-107.6	167.7	174.7	-70.7	-41.3	0	0	0	111.4	V26 C27 C30	V26-D32 WeakPolarHBondContact CA-O 3.34Å; C27-D32 PolarHBondContact N-O 3.39Å; C30-D32 PolarHBondContact O-N 3.08Å
33	R	76.5	Confident	76.4	Confident	119 Å²	119	65.2 Å²	65.2	45%	0.449	34%	0.338	S	S	.	.	B	Isolated β-bridge	trans	-53.5	142.4	173.9	-83.5	170.9	164.1	-167.5	7.9	111.7	D21 L25 H35 M91	D21-R33 IonicContact OD1-CZ 2.95Å; D21-R33 IonicContact OD1-NE 3.75Å; D21-R33 PolarHBondContact OD1-NE 3.13Å; D21-R33 IonicContact OD1-NH2 2.75Å; D21-R33 PolarHBondContact OD1-NH2 2.67Å; D21-R33 IonicContact OD2-CZ 2.81Å; D21-R33 IonicContact OD2-NE 3.47Å; D21-R33 IonicContact OD2-NH2 3.35Å; D21-R33 PolarHBondContact OD2-NH2 3.29Å; L25-R33 WeakPolarHBondContact O-CA 3.5Å; R33-H35 PolarHBondContact O-N 3.03Å; R33-M91 HydrophobicContact CB-CE 3.87Å; R33-M91 HydrophobicContact CG-CE 3.93Å; R33-M91 HydrophobicContact CG-SD 4.47Å
34	Y	77.9	Confident	77.3	Confident	33 Å²	33	62.2 Å²	62.2	13%	0.129	32%	0.324	C	S	.	.			trans	-58.6	126.9	-176.4	-72	-69.9	0	0	0	112.8	L25 V26 C27 P37 T45 I87	L25-Y34 VanDerWaalsContact C-CE2 3.43Å; L25-Y34 WeakPolarHBondContact O-CD2 3.33Å; L25-Y34 PolarHBondContact O-N 3.38Å; V26-Y34 VanDerWaalsContact O-CZ 3.23Å; V26-Y34 PolarHBondContact O-OH 3.24Å; C27-Y34 HydrophobicContact CB-CD1 3.66Å; C27-Y34 HydrophobicContact CB-CE1 3.55Å; Y34-P37 HydrophobicContact CD1-CB 4.26Å; Y34-P37 HydrophobicContact CG-CB 4.15Å; Y34-T45 HydrophobicContact CD1-CG2 4.31Å; Y34-T45 HydrophobicContact CE1-CG2 4.08Å; Y34-T45 VanDerWaalsContact CE1-O 3.23Å; Y34-T45 WeakPolarHBondContact CE1-O 3.35Å; Y34-T45 PolarHBondContact OH-O 3.46Å; Y34-I87 HydrophobicContact CD2-CD1 4.45Å; Y34-I87 HydrophobicContact CD2-CG2 3.58Å; Y34-I87 HydrophobicContact CE2-CD1 4.09Å; Y34-I87 HydrophobicContact CE2-CG2 4.22Å; Y34-I87 HydrophobicContact CG-CG2 4.2Å
35	H	76.1	Confident	78.2	Confident	127 Å²	127	56.5 Å²	56.5	59%	0.588	30%	0.3	S	S	*	.	S	Bend	trans	-111.8	116.6	169	-171.4	-35.5	0	0	0	109.1	R33 C47	R33-H35 PolarHBondContact O-N 3.03Å; H35-C47 PolarHBondContact N-SG 3.34Å; H35-C47 WeakPolarHBondContact O-CA 3.26Å; H35-C47 VanDerWaalsContact O-CB 3.31Å; H35-C47 WeakPolarHBondContact O-CB 3.46Å
36	N	74.4	Confident	78.7	Confident	62 Å²	62	56.6 Å²	56.6	33%	0.332	30%	0.3	S	S	.	.	S	Bend	trans	46.9	70.3	-171.6	-155.5	18.4	0	0	0	112.6	K38 E48	N36-K38 PolarHBondContact O-N 3.13Å; N36-E48 HydrophobicContact CB-CB 4.25Å; N36-E48 PolarHBondContact ND2-OE2 2.73Å; N36-E48 PolarHBondContact O-N 3.06Å; N36-E48 VanDerWaalsContact O-N 3.09Å
37	P	80.7	Confident	79	Confident	8 Å²	8	54.9 Å²	54.9	5%	0.052	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	122	-173	23.3	-30.2	0	0	0	112.1	Y34 T45 F46 N83 N84 I87 T88	Y34-P37 HydrophobicContact CD1-CB 4.26Å; Y34-P37 HydrophobicContact CG-CB 4.15Å; P37-T45 HydrophobicContact CB-CG2 3.41Å; P37-T45 VanDerWaalsContact CB-CG2 3.41Å; P37-F46 CarbonylContact C-O 3.59Å; P37-F46 WeakPolarHBondContact CA-O 3.39Å; P37-N83 CarbonylContact O-C 3.54Å; P37-N83 VanDerWaalsContact O-CA 3.28Å; P37-N83 WeakPolarHBondContact O-CA 3.31Å; P37-N84 HydrophobicContact CB-CB 4.14Å; P37-N84 HydrophobicContact CG-CB 4.38Å; P37-N84 PolarHBondContact O-N 2.6Å; P37-I87 HydrophobicContact CB-CG2 4.35Å; P37-I87 HydrophobicContact CG-CG2 4.22Å; P37-T88 WeakPolarHBondContact CG-OG1 3.37Å
38	K	80.4	Confident	79.1	Confident	11 Å²	11	56.5 Å²	56.5	5%	0.048	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	133.3	173	-62.1	-57.5	-163.5	170.4	0	110.8	N36 T45 F46 E48 L51 A79 L81 Q82 N83	N36-K38 PolarHBondContact O-N 3.13Å; K38-T45 VanDerWaalsContact O-CA 3.32Å; K38-T45 WeakPolarHBondContact O-CA 3.34Å; K38-T45 WeakPolarHBondContact O-CG2 3.21Å; K38-F46 PolarHBondContact N-O 3.07Å; K38-F46 PolarHBondContact O-N 3.29Å; K38-E48 HydrophobicContact CG-CB 3.94Å; K38-E48 HydrophobicContact CG-CG 4.26Å; K38-L51 HydrophobicContact CB-CD1 3.99Å; K38-A79 PolarHBondContact NZ-O 3.43Å; K38-L81 HydrophobicContact CB-CB 4.16Å; K38-L81 HydrophobicContact CD-CB 4.22Å; K38-L81 WeakPolarHBondContact CD-O 3.19Å; K38-L81 HydrophobicContact CG-CB 4.43Å; K38-L81 PolarHBondContact NZ-O 2.77Å; K38-Q82 WeakPolarHBondContact CA-O 3.3Å; K38-N83 VanDerWaalsContact CD-OD1 3.25Å; K38-N83 WeakPolarHBondContact CD-OD1 3.48Å; K38-N83 VanDerWaalsContact CE-OD1 3.27Å; K38-N83 WeakPolarHBondContact CE-OD1 3.4Å; K38-N83 PolarHBondContact NZ-OD1 2.87Å
39	V	82.1	Confident	79.3	Confident	30 Å²	30	59.4 Å²	59.4	18%	0.182	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	131.1	177.4	-170.6	0	0	0	0	110.2	Q82 N84	V39-Q82 PolarHBondContact N-O 2.97Å; V39-N84 HydrophobicContact CG2-CB 3.21Å; V39-N84 VanDerWaalsContact CG2-CG 3.41Å; V39-N84 VanDerWaalsContact CG2-ND2 3.28Å; V39-N84 WeakPolarHBondContact CG2-ND2 3.48Å
40	L	78.9	Confident	79.4	Confident	3 Å²	3	57.5 Å²	57.5	2%	0.016	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-87.3	159.6	170.1	-63.8	-178.8	0	0	0	111.4	C42 L43 H44 F46 L51 L62 C64 L81	L40-C42 VanDerWaalsContact CB-SG 3.57Å; L40-C42 PolarHBondContact O-N 2.92Å; L40-L43 WeakPolarHBondContact O-CA 3.36Å; L40-L43 PolarHBondContact O-N 2.97Å; L40-H44 PolarHBondContact N-O 3.43Å; L40-F46 HydrophobicContact CD1-CD2 3.98Å; L40-F46 HydrophobicContact CD1-CE2 3.67Å; L40-F46 HydrophobicContact CG-CD2 4.32Å; L40-F46 HydrophobicContact CG-CE2 4.37Å; L40-L51 HydrophobicContact CD2-CD1 4.41Å; L40-L62 HydrophobicContact CD1-CD2 3.54Å; L40-L62 HydrophobicContact CD2-CD2 3.39Å; L40-L62 HydrophobicContact CG-CD2 4.09Å; L40-C64 HydrophobicContact CD1-CB 3.81Å; L40-L81 HydrophobicContact CD2-CD1 3.86Å
41	P	75.4	Confident	79.3	Confident	90 Å²	90	55.3 Å²	55.3	58%	0.584	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-22.9	174.3	-27.2	36	0	0	0	114.7	L43	P41-L43 PolarHBondContact O-N 2.9Å
42	C	76	Confident	79.3	Confident	19 Å²	19	53.1 Å²	53.1	13%	0.128	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	11.7	172.6	66.7	0	0	0	0	114	L40 H44 C67 Q69	L40-C42 VanDerWaalsContact CB-SG 3.57Å; L40-C42 PolarHBondContact O-N 2.92Å; C42-H44 PolarHBondContact O-N 3.28Å; C42-H44 PolarHBondContact O-ND1 3.42Å; C42-C67 WeakPolarHBondContact CB-SG 3.45Å; C42-Q69 HydrophobicContact CB-CB 4.11Å; C42-Q69 HydrophobicContact CB-CG 4.43Å
43	L	76.2	Confident	79.3	Confident	145 Å²	145	54.7 Å²	54.7	76%	0.759	27%	0.273	S	S	*	.	S	Bend	trans	62.9	2.6	-179.4	-54.4	177.2	0	0	0	116.5	L40 P41	L40-L43 WeakPolarHBondContact O-CA 3.36Å; L40-L43 PolarHBondContact O-N 2.97Å; P41-L43 PolarHBondContact O-N 2.9Å
44	H	77.9	Confident	79.3	Confident	67 Å²	67	54.4 Å²	54.4	31%	0.31	27%	0.273	S	S	.	.			trans	-76.7	139.9	171.1	-68.4	104.3	0	0	0	110.7	L40 C42 F46 V66	L40-H44 PolarHBondContact N-O 3.43Å; C42-H44 PolarHBondContact O-N 3.28Å; C42-H44 PolarHBondContact O-ND1 3.42Å; H44-F46 HydrophobicContact CB-CE2 3.62Å; H44-F46 HydrophobicContact CB-CZ 3.94Å; H44-V66 WeakPolarHBondContact NE2-CG1 3.37Å
45	T	81.3	Confident	79	Confident	10 Å²	10	53.9 Å²	53.9	6%	0.061	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	141.8	-176.7	-55.6	0	0	0	0	110.7	Y34 P37 K38 N84 I87	Y34-T45 HydrophobicContact CD1-CG2 4.31Å; Y34-T45 HydrophobicContact CE1-CG2 4.08Å; Y34-T45 VanDerWaalsContact CE1-O 3.23Å; Y34-T45 WeakPolarHBondContact CE1-O 3.35Å; Y34-T45 PolarHBondContact OH-O 3.46Å; P37-T45 HydrophobicContact CB-CG2 3.41Å; P37-T45 VanDerWaalsContact CB-CG2 3.41Å; K38-T45 VanDerWaalsContact O-CA 3.32Å; K38-T45 WeakPolarHBondContact O-CA 3.34Å; K38-T45 WeakPolarHBondContact O-CG2 3.21Å; T45-N84 HydrophobicContact CG2-CB 3.86Å; T45-N84 PolarHBondContact OG1-ND2 3.19Å; T45-I87 HydrophobicContact CG2-CD1 3.95Å
46	F	83.8	Confident	78.7	Confident	1 Å²	1	51.8 Å²	51.8	0%	0.004	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	159.6	178.6	-56.4	-85.5	0	0	0	111.1	I29 P37 K38 L40 H44 L51 P65 V66	I29-F46 HydrophobicContact CD1-CB 4.26Å; I29-F46 HydrophobicContact CD1-CD1 3.61Å; I29-F46 HydrophobicContact CD1-CE1 4.27Å; I29-F46 HydrophobicContact CD1-CG 4.1Å; I29-F46 HydrophobicContact CG1-CD1 3.77Å; I29-F46 HydrophobicContact CG1-CE1 4.17Å; P37-F46 CarbonylContact C-O 3.59Å; P37-F46 WeakPolarHBondContact CA-O 3.39Å; K38-F46 PolarHBondContact N-O 3.07Å; K38-F46 PolarHBondContact O-N 3.29Å; L40-F46 HydrophobicContact CD1-CD2 3.98Å; L40-F46 HydrophobicContact CD1-CE2 3.67Å; L40-F46 HydrophobicContact CG-CD2 4.32Å; L40-F46 HydrophobicContact CG-CE2 4.37Å; H44-F46 HydrophobicContact CB-CE2 3.62Å; H44-F46 HydrophobicContact CB-CZ 3.94Å; F46-L51 HydrophobicContact CB-CD1 3.84Å; F46-L51 HydrophobicContact CB-CD2 3.75Å; F46-L51 HydrophobicContact CB-CG 3.56Å; F46-L51 HydrophobicContact CD2-CD1 4.37Å; F46-L51 HydrophobicContact CD2-CD2 3.82Å; F46-L51 HydrophobicContact CD2-CG 4.41Å; F46-L51 HydrophobicContact CG-CD2 3.85Å; F46-L51 HydrophobicContact CG-CG 4.23Å; F46-P65 HydrophobicContact CE1-CB 4.33Å; F46-P65 HydrophobicContact CE1-CG 4.16Å; F46-P65 HydrophobicContact CZ-CB 4.38Å; F46-P65 HydrophobicContact CZ-CG 4.15Å; F46-V66 HydrophobicContact CE1-CG2 3.97Å; F46-V66 HydrophobicContact CZ-CB 4.45Å; F46-V66 HydrophobicContact CZ-CG2 3.72Å
47	C	85.1	Confident	77.9	Confident	5 Å²	5	55.4 Å²	55.4	3%	0.034	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	138	171.8	-55.8	0	0	0	0	110.3	C27 H35 K49 C50 L51	C27-C47 WeakPolarHBondContact CB-SG 3.49Å; C27-C47 PolarHBondContact SG-N 3.32Å; H35-C47 PolarHBondContact N-SG 3.34Å; H35-C47 WeakPolarHBondContact O-CA 3.26Å; H35-C47 VanDerWaalsContact O-CB 3.31Å; H35-C47 WeakPolarHBondContact O-CB 3.46Å; C47-K49 VanDerWaalsContact C-N 3.33Å; C47-K49 PolarHBondContact O-N 3.25Å; C47-C50 HydrophobicContact CB-CB 3.96Å; C47-C50 WeakPolarHBondContact O-CB 3.39Å; C47-C50 PolarHBondContact O-N 2.71Å; C47-L51 PolarHBondContact O-N 3.14Å
48	E	82.4	Confident	76.9	Confident	35 Å²	35	63.8 Å²	63.8	16%	0.164	34%	0.335	C	S	.	.	H	α-helix	trans	-52.4	-49.3	179.2	-175.8	-174.5	-174.4	0	0	112.5	N36 K38 C50 L51 Q52 V78 A79	N36-E48 HydrophobicContact CB-CB 4.25Å; N36-E48 PolarHBondContact ND2-OE2 2.73Å; N36-E48 PolarHBondContact O-N 3.06Å; N36-E48 VanDerWaalsContact O-N 3.09Å; K38-E48 HydrophobicContact CG-CB 3.94Å; K38-E48 HydrophobicContact CG-CG 4.26Å; E48-C50 VanDerWaalsContact C-N 3.27Å; E48-C50 PolarHBondContact O-N 3.19Å; E48-L51 PolarHBondContact O-N 3.15Å; E48-Q52 HydrophobicContact CG-CG 4.47Å; E48-Q52 WeakPolarHBondContact O-CG 3.43Å; E48-Q52 PolarHBondContact O-N 2.86Å; E48-Q52 PolarHBondContact OE1-NE2 3.29Å; E48-Q52 VanDerWaalsContact OE1-NE2 3.13Å; E48-V78 HydrophobicContact CG-CG1 4.2Å; E48-A79 WeakPolarHBondContact OE1-CA 3.49Å; E48-A79 WeakPolarHBondContact OE1-CB 3.35Å
49	K	80.8	Confident	76.2	Confident	131 Å²	131	65.3 Å²	65.3	57%	0.57	35%	0.347	S	S	*	.	H	α-helix	trans	-62.2	-34.6	178.8	-67.7	-179.1	179.1	174.6	0	112.6	C47 N53	C47-K49 VanDerWaalsContact C-N 3.33Å; C47-K49 PolarHBondContact O-N 3.25Å; K49-N53 WeakPolarHBondContact O-CB 3.38Å; K49-N53 VanDerWaalsContact O-CG 3.27Å; K49-N53 PolarHBondContact O-N 2.93Å; K49-N53 PolarHBondContact O-ND2 3.19Å
50	C	82.4	Confident	75.5	Confident	22 Å²	22	70.1 Å²	70.1	15%	0.149	37%	0.371	C	S	.	.	H	α-helix	trans	-69.2	-39	178	-69.6	0	0	0	0	111.3	I29 C47 E48 Y54	I29-C50 HydrophobicContact CB-CB 3.92Å; I29-C50 HydrophobicContact CD1-CB 3.88Å; I29-C50 HydrophobicContact CG2-CB 3.85Å; C47-C50 HydrophobicContact CB-CB 3.96Å; C47-C50 WeakPolarHBondContact O-CB 3.39Å; C47-C50 PolarHBondContact O-N 2.71Å; E48-C50 VanDerWaalsContact C-N 3.27Å; E48-C50 PolarHBondContact O-N 3.19Å; C50-Y54 VanDerWaalsContact O-CB 3.25Å; C50-Y54 WeakPolarHBondContact O-CB 3.36Å; C50-Y54 PolarHBondContact O-N 3.35Å; C50-Y54 VanDerWaalsContact O-N 3.12Å
51	L	78.9	Confident	75.2	Confident	0 Å²	0	73.8 Å²	73.8	0%	0	39%	0.394	C	S	.	.	H	α-helix	trans	-70.9	-39.3	174.4	-71.1	178.2	0	0	0	112.3	I29 K38 L40 F46 C47 E48 N53 Y54 I55 L62 V78 L81	I29-L51 HydrophobicContact CD1-CD2 4.19Å; K38-L51 HydrophobicContact CB-CD1 3.99Å; L40-L51 HydrophobicContact CD2-CD1 4.41Å; F46-L51 HydrophobicContact CB-CD1 3.84Å; F46-L51 HydrophobicContact CB-CD2 3.75Å; F46-L51 HydrophobicContact CB-CG 3.56Å; F46-L51 HydrophobicContact CD2-CD1 4.37Å; F46-L51 HydrophobicContact CD2-CD2 3.82Å; F46-L51 HydrophobicContact CD2-CG 4.41Å; F46-L51 HydrophobicContact CG-CD2 3.85Å; F46-L51 HydrophobicContact CG-CG 4.23Å; C47-L51 PolarHBondContact O-N 3.14Å; E48-L51 PolarHBondContact O-N 3.15Å; L51-N53 VanDerWaalsContact C-N 3.33Å; L51-N53 PolarHBondContact O-N 3.11Å; L51-Y54 PolarHBondContact O-N 3.37Å; L51-I55 WeakPolarHBondContact O-CD1 3.37Å; L51-I55 VanDerWaalsContact O-CG1 3.28Å; L51-I55 WeakPolarHBondContact O-CG1 3.43Å; L51-I55 PolarHBondContact O-N 2.83Å; L51-I55 VanDerWaalsContact O-N 3.14Å; L51-L62 HydrophobicContact CD2-CD1 3.98Å; L51-V78 HydrophobicContact CB-CG1 3.57Å; L51-V78 HydrophobicContact CB-CG2 4.4Å; L51-V78 HydrophobicContact CD1-CG1 4.14Å; L51-L81 HydrophobicContact CD1-CD1 4.38Å
52	Q	79.2	Confident	75.3	Confident	86 Å²	86	69.7 Å²	69.7	40%	0.402	37%	0.367	S	S	.	.	H	α-helix	trans	-61.2	-40.7	175.6	-75.8	173.2	-7.9	0	0	112.2	E48 Y54 V78	E48-Q52 HydrophobicContact CG-CG 4.47Å; E48-Q52 WeakPolarHBondContact O-CG 3.43Å; E48-Q52 PolarHBondContact O-N 2.86Å; E48-Q52 PolarHBondContact OE1-NE2 3.29Å; E48-Q52 VanDerWaalsContact OE1-NE2 3.13Å; Q52-Y54 VanDerWaalsContact C-N 3.34Å; Q52-V78 HydrophobicContact CG-CB 3.8Å; Q52-V78 HydrophobicContact CG-CG1 4.05Å; Q52-V78 HydrophobicContact CG-CG2 4.11Å
53	N	78.1	Confident	75.4	Confident	145 Å²	145	71.2 Å²	71.2	78%	0.775	38%	0.378	S	S	*	.	H	α-helix	trans	-75.1	-24	177	-70.1	-14.5	0	0	0	113.2	K49 L51	K49-N53 WeakPolarHBondContact O-CB 3.38Å; K49-N53 VanDerWaalsContact O-CG 3.27Å; K49-N53 PolarHBondContact O-N 2.93Å; K49-N53 PolarHBondContact O-ND2 3.19Å; L51-N53 VanDerWaalsContact C-N 3.33Å; L51-N53 PolarHBondContact O-N 3.11Å
54	Y	77.7	Confident	75.5	Confident	113 Å²	113	64.4 Å²	64.4	44%	0.443	34%	0.342	S	S	.	.	H	α-helix	trans	-79.3	-27	179.5	-174.5	-103.2	0	0	0	112.7	C50 L51 Q52 P65	C50-Y54 VanDerWaalsContact O-CB 3.25Å; C50-Y54 WeakPolarHBondContact O-CB 3.36Å; C50-Y54 PolarHBondContact O-N 3.35Å; C50-Y54 VanDerWaalsContact O-N 3.12Å; L51-Y54 PolarHBondContact O-N 3.37Å; Q52-Y54 VanDerWaalsContact C-N 3.34Å; Y54-P65 HydrophobicContact CD1-CG 4.19Å; Y54-P65 HydrophobicContact CE1-CG 3.84Å; Y54-P65 HydrophobicContact CE2-CG 4.35Å
55	I	71.8	Confident	75.5	Confident	22 Å²	22	63.2 Å²	63.2	11%	0.113	34%	0.34	C	S	.	.	S	Bend	trans	-96.6	129.3	-177.3	-59.6	160.9	0	0	0	110.1	L51 L62 L73 V78	L51-I55 WeakPolarHBondContact O-CD1 3.37Å; L51-I55 VanDerWaalsContact O-CG1 3.28Å; L51-I55 WeakPolarHBondContact O-CG1 3.43Å; L51-I55 PolarHBondContact O-N 2.83Å; L51-I55 VanDerWaalsContact O-N 3.14Å; I55-L62 HydrophobicContact CD1-CB 4.1Å; I55-L62 HydrophobicContact CD1-CD1 3.21Å; I55-L62 HydrophobicContact CD1-CG 4.21Å; I55-L62 HydrophobicContact CG1-CB 4.35Å; I55-L62 HydrophobicContact CG1-CD1 3.51Å; I55-L62 HydrophobicContact CG1-CG 4.39Å; I55-L73 HydrophobicContact CD1-CD1 3.81Å; I55-L73 HydrophobicContact CD1-CD2 4.07Å; I55-L73 HydrophobicContact CG2-CD1 3.97Å; I55-V78 HydrophobicContact CD1-CG2 3.27Å
56	P	68.3	Low	75.3	Confident	83 Å²	83	66.2 Å²	66.2	54%	0.539	36%	0.359	S	S	.	.			trans	-61.2	142	172	-19	30.2	0	0	0	111.1	Q58 S59	P56-Q58 PolarHBondContact O-N 2.69Å; P56-S59 PolarHBondContact O-N 3.02Å
57	P	59.4	Low	75	Confident	137 Å²	137	68.8 Å²	68.8	89%	0.89	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	2.1	-170.1	23.2	-33.5	0	0	0	116.1
58	Q	59.3	Low	74.7	Confident	185 Å²	185	78.5 Å²	78.5	86%	0.864	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.2	2.7	-179.1	-63.2	173.4	0.6	0	0	113.2	P56	P56-Q58 PolarHBondContact O-N 2.69Å
59	S	65.5	Low	74.5	Confident	43 Å²	43	81.8 Å²	81.8	30%	0.301	43%	0.427	S	S	.	.			trans	-86.6	122.6	-178.6	-172.7	0	0	0	0	111.5	P56 T61 L73	P56-S59 PolarHBondContact O-N 3.02Å; S59-T61 VanDerWaalsContact C-N 3.28Å; S59-T61 PolarHBondContact OG-N 3.13Å; S59-T61 PolarHBondContact OG-O 3.5Å; S59-L73 WeakPolarHBondContact O-CD1 3.35Å
60	L	66.9	Low	74.3	Confident	130 Å²	130	80.7 Å²	80.7	68%	0.681	43%	0.432	S	S	*	.	S	Bend	trans	-82.7	-4.1	173.7	-71.5	164.8	0	0	0	113.2	L73	L60-L73 PolarHBondContact O-N 3.45Å
61	T	72.4	Confident	74	Confident	81 Å²	81	80.5 Å²	80.5	50%	0.497	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	139.3	-179	58.3	0	0	0	0	111.1	S59 S71	S59-T61 VanDerWaalsContact C-N 3.28Å; S59-T61 PolarHBondContact OG-N 3.13Å; S59-T61 PolarHBondContact OG-O 3.5Å; T61-S71 WeakPolarHBondContact CA-O 3.37Å
62	L	77.3	Confident	73.8	Confident	4 Å²	4	87.4 Å²	87.4	2%	0.021	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	129.1	174.7	164.6	133.8	0	0	0	110.5	L40 L51 I55 T70 S71 L73	L40-L62 HydrophobicContact CD1-CD2 3.54Å; L40-L62 HydrophobicContact CD2-CD2 3.39Å; L40-L62 HydrophobicContact CG-CD2 4.09Å; L51-L62 HydrophobicContact CD2-CD1 3.98Å; I55-L62 HydrophobicContact CD1-CB 4.1Å; I55-L62 HydrophobicContact CD1-CD1 3.21Å; I55-L62 HydrophobicContact CD1-CG 4.21Å; I55-L62 HydrophobicContact CG1-CB 4.35Å; I55-L62 HydrophobicContact CG1-CD1 3.51Å; I55-L62 HydrophobicContact CG1-CG 4.39Å; L62-T70 CarbonylContact O-C 3.58Å; L62-T70 WeakPolarHBondContact O-CA 3.45Å; L62-S71 WeakPolarHBondContact CD2-OG 3.31Å; L62-S71 PolarHBondContact N-O 2.87Å; L62-S71 PolarHBondContact O-N 3.46Å; L62-S71 PolarHBondContact O-OG 3.42Å; L62-L73 HydrophobicContact CB-CD1 4.09Å; L62-L73 HydrophobicContact CB-CD2 4.44Å; L62-L73 HydrophobicContact CB-CG 4.13Å
63	S	78.3	Confident	73.4	Confident	51 Å²	51	84.1 Å²	84.1	36%	0.357	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	128.9	163.7	48.2	0	0	0	0	110.4	P65	S63-P65 WeakPolarHBondContact O-CD 3.15Å
64	C	78.4	Confident	72.9	Confident	1 Å²	1	79.8 Å²	79.8	1%	0.007	43%	0.431	C	S	.	.			trans	-63.2	130	175.2	176.4	0	0	0	0	110.8	L40 V66 C67 R68 Q69	L40-C64 HydrophobicContact CD1-CB 3.81Å; C64-V66 PolarHBondContact O-N 2.99Å; C64-V66 PolarHBondContact SG-N 3.32Å; C64-C67 VanDerWaalsContact CB-SG 3.53Å; C64-R68 WeakPolarHBondContact O-CA 3.3Å; C64-R68 PolarHBondContact O-N 2.93Å; C64-Q69 PolarHBondContact N-O 2.81Å
65	P	77.6	Confident	72.2	Confident	42 Å²	42	84 Å²	84	27%	0.273	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-26.7	178.4	-26	33.6	0	0	0	114.8	I29 F46 Y54 S63	I29-P65 HydrophobicContact CD1-CG 4.08Å; I29-P65 HydrophobicContact CG1-CG 4.35Å; F46-P65 HydrophobicContact CE1-CB 4.33Å; F46-P65 HydrophobicContact CE1-CG 4.16Å; F46-P65 HydrophobicContact CZ-CB 4.38Å; F46-P65 HydrophobicContact CZ-CG 4.15Å; Y54-P65 HydrophobicContact CD1-CG 4.19Å; Y54-P65 HydrophobicContact CE1-CG 3.84Å; Y54-P65 HydrophobicContact CE2-CG 4.35Å; S63-P65 WeakPolarHBondContact O-CD 3.15Å
66	V	78.6	Confident	71.6	Confident	74 Å²	74	91.5 Å²	91.5	45%	0.448	49%	0.487	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-52.6	-173.9	177.8	0	0	0	0	111.5	H44 F46 C64	H44-V66 WeakPolarHBondContact NE2-CG1 3.37Å; F46-V66 HydrophobicContact CE1-CG2 3.97Å; F46-V66 HydrophobicContact CZ-CB 4.45Å; F46-V66 HydrophobicContact CZ-CG2 3.72Å; C64-V66 PolarHBondContact O-N 2.99Å; C64-V66 PolarHBondContact SG-N 3.32Å
67	C	76.8	Confident	71.7	Confident	55 Å²	55	88.9 Å²	88.9	37%	0.372	48%	0.475	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.7	-3.5	-175.3	67.6	0	0	0	0	114.5	C42 C64 Q69	C42-C67 WeakPolarHBondContact CB-SG 3.45Å; C64-C67 VanDerWaalsContact CB-SG 3.53Å; C67-Q69 PolarHBondContact O-N 3Å
68	R	78.6	Confident	72.2	Confident	208 Å²	208	82.9 Å²	82.9	79%	0.785	44%	0.435	S	S	*	.			trans	59	7.7	-178	-56.1	-176.1	-179.8	-173.9	-0	115.6	C64 T70	C64-R68 WeakPolarHBondContact O-CA 3.3Å; C64-R68 PolarHBondContact O-N 2.93Å; R68-T70 PolarHBondContact O-N 3.19Å
69	Q	78.1	Confident	72.5	Confident	105 Å²	105	76.5 Å²	76.5	49%	0.491	41%	0.414	S	S	.	.			trans	-61.8	129.7	173.8	-173.9	172.6	-5.1	0	0	110.1	C42 C64 C67	C42-Q69 HydrophobicContact CB-CB 4.11Å; C42-Q69 HydrophobicContact CB-CG 4.43Å; C64-Q69 PolarHBondContact N-O 2.81Å; C67-Q69 PolarHBondContact O-N 3Å
70	T	77.3	Confident	72.6	Confident	108 Å²	108	76.6 Å²	76.6	66%	0.663	42%	0.417	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.4	135.9	177.2	49.7	0	0	0	0	110.5	L62 R68	L62-T70 CarbonylContact O-C 3.58Å; L62-T70 WeakPolarHBondContact O-CA 3.45Å; R68-T70 PolarHBondContact O-N 3.19Å
71	S	75.1	Confident	72.9	Confident	18 Å²	18	71.4 Å²	71.4	13%	0.126	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	146.2	178.4	56.3	0	0	0	0	109.7	T61 L62	T61-S71 WeakPolarHBondContact CA-O 3.37Å; L62-S71 WeakPolarHBondContact CD2-OG 3.31Å; L62-S71 PolarHBondContact N-O 2.87Å; L62-S71 PolarHBondContact O-N 3.46Å; L62-S71 PolarHBondContact O-OG 3.42Å
72	I	75.6	Confident	72.9	Confident	144 Å²	144	75.2 Å²	75.2	74%	0.738	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.5	131.3	178.5	-57.7	170.1	0	0	0	107.9
73	L	70.5	Confident	72.6	Confident	17 Å²	17	77.4 Å²	77.4	9%	0.089	41%	0.414	C	S	.	.	P	Polyproline II helix	trans	-78.8	140.2	178.1	-77.5	154.9	0	0	0	110.4	I55 S59 L60 L62 V78 L81	I55-L73 HydrophobicContact CD1-CD1 3.81Å; I55-L73 HydrophobicContact CD1-CD2 4.07Å; I55-L73 HydrophobicContact CG2-CD1 3.97Å; S59-L73 WeakPolarHBondContact O-CD1 3.35Å; L60-L73 PolarHBondContact O-N 3.45Å; L62-L73 HydrophobicContact CB-CD1 4.09Å; L62-L73 HydrophobicContact CB-CD2 4.44Å; L62-L73 HydrophobicContact CB-CG 4.13Å; L73-V78 HydrophobicContact CD2-CG2 4.03Å; L73-L81 HydrophobicContact CD2-CD1 4.31Å
74	P	68	Low	72.4	Confident	54 Å²	54	76.3 Å²	76.3	35%	0.351	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-63.2	158.4	171.5	-16	28.6	0	0	0	111.6	K76 G77 A80 L81	P74-K76 PolarHBondContact O-N 2.83Å; P74-G77 WeakPolarHBondContact O-CA 3.42Å; P74-G77 PolarHBondContact O-N 3.13Å; P74-A80 HydrophobicContact CB-CB 3.79Å; P74-A80 HydrophobicContact CG-CB 4.03Å; P74-L81 HydrophobicContact CG-CD2 4.41Å
75	E	61.9	Low	71.8	Confident	203 Å²	203	81.7 Å²	81.7	95%	0.949	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-28.1	-175.6	-65.7	-177.1	168	0	0	114.4	G77	E75-G77 VanDerWaalsContact C-N 3.27Å; E75-G77 PolarHBondContact O-N 3.33Å
76	K	60.3	Low	71.2	Confident	179 Å²	179	86.9 Å²	86.9	78%	0.778	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	13.3	176.1	-70.5	-179.8	-175.6	180	0	113.5	P74 A80	P74-K76 PolarHBondContact O-N 2.83Å; K76-A80 HydrophobicContact CB-CB 3.78Å
77	G	69.2	Low	70.6	Confident	28 Å²	28	84.2 Å²	84.2	29%	0.289	43%	0.429	S	S	.	.	G	3₁₀ helix	trans	69.2	-157.2	177.5	0	0	0	0	0	114.3	P74 E75 A79 A80	P74-G77 WeakPolarHBondContact O-CA 3.42Å; P74-G77 PolarHBondContact O-N 3.13Å; E75-G77 VanDerWaalsContact C-N 3.27Å; E75-G77 PolarHBondContact O-N 3.33Å; G77-A79 PolarHBondContact O-N 2.85Å; G77-A80 PolarHBondContact O-N 2.85Å; G77-A80 VanDerWaalsContact O-N 3.12Å
78	V	70	Confident	70.1	Confident	11 Å²	11	83.6 Å²	83.6	7%	0.067	42%	0.424	C	S	.	.	G	3₁₀ helix	trans	-58	-30.6	-176.7	-179.5	0	0	0	0	113	E48 L51 Q52 I55 L73 A80 L81	E48-V78 HydrophobicContact CG-CG1 4.2Å; L51-V78 HydrophobicContact CB-CG1 3.57Å; L51-V78 HydrophobicContact CB-CG2 4.4Å; L51-V78 HydrophobicContact CD1-CG1 4.14Å; Q52-V78 HydrophobicContact CG-CB 3.8Å; Q52-V78 HydrophobicContact CG-CG1 4.05Å; Q52-V78 HydrophobicContact CG-CG2 4.11Å; I55-V78 HydrophobicContact CD1-CG2 3.27Å; L73-V78 HydrophobicContact CD2-CG2 4.03Å; V78-A80 PolarHBondContact O-N 3.35Å; V78-L81 HydrophobicContact CG1-CD1 4.18Å; V78-L81 WeakPolarHBondContact O-CB 3.2Å; V78-L81 PolarHBondContact O-N 3.14Å; V78-L81 VanDerWaalsContact O-N 3.15Å
79	A	66.7	Low	69.5	Low	50 Å²	50	76.5 Å²	76.5	41%	0.413	40%	0.402	S	S	.	.	G	3₁₀ helix	trans	-62.2	-26.4	-179.8	0	0	0	0	0	112.8	K38 E48 G77	K38-A79 PolarHBondContact NZ-O 3.43Å; E48-A79 WeakPolarHBondContact OE1-CA 3.49Å; E48-A79 WeakPolarHBondContact OE1-CB 3.35Å; G77-A79 PolarHBondContact O-N 2.85Å
80	A	67.6	Low	68.9	Low	45 Å²	45	74 Å²	74	37%	0.372	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-85.9	-3.8	-179.8	0	0	0	0	0	114.6	P74 K76 G77 V78	P74-A80 HydrophobicContact CB-CB 3.79Å; P74-A80 HydrophobicContact CG-CB 4.03Å; K76-A80 HydrophobicContact CB-CB 3.78Å; G77-A80 PolarHBondContact O-N 2.85Å; G77-A80 VanDerWaalsContact O-N 3.12Å; V78-A80 PolarHBondContact O-N 3.35Å
81	L	72.7	Confident	68.3	Low	21 Å²	21	70 Å²	70	11%	0.11	37%	0.365	C	S	.	.	S	Bend	trans	-67.4	147.6	170.4	-67.1	169.6	0	0	0	110.2	K38 L40 L51 L73 P74 V78 N83	K38-L81 HydrophobicContact CB-CB 4.16Å; K38-L81 HydrophobicContact CD-CB 4.22Å; K38-L81 WeakPolarHBondContact CD-O 3.19Å; K38-L81 HydrophobicContact CG-CB 4.43Å; K38-L81 PolarHBondContact NZ-O 2.77Å; L40-L81 HydrophobicContact CD2-CD1 3.86Å; L51-L81 HydrophobicContact CD1-CD1 4.38Å; L73-L81 HydrophobicContact CD2-CD1 4.31Å; P74-L81 HydrophobicContact CG-CD2 4.41Å; V78-L81 HydrophobicContact CG1-CD1 4.18Å; V78-L81 WeakPolarHBondContact O-CB 3.2Å; V78-L81 PolarHBondContact O-N 3.14Å; V78-L81 VanDerWaalsContact O-N 3.15Å; L81-N83 PolarHBondContact O-N 3.07Å
82	Q	71.9	Confident	67.8	Low	161 Å²	161	73.4 Å²	73.4	75%	0.752	38%	0.379	S	S	*	.	P	Polyproline II helix	trans	-64	135.7	-179.9	-68.9	-176.6	-18.7	0	0	110.8	K38 V39	K38-Q82 WeakPolarHBondContact CA-O 3.3Å; V39-Q82 PolarHBondContact N-O 2.97Å
83	N	72.5	Confident	67.2	Low	51 Å²	51	70.6 Å²	70.6	27%	0.273	37%	0.369	S	S	.	.	B	Isolated β-bridge	trans	-71.6	141.6	172.3	-70.2	-12.9	0	0	0	109.7	P37 K38 L81 F85	P37-N83 CarbonylContact O-C 3.54Å; P37-N83 VanDerWaalsContact O-CA 3.28Å; P37-N83 WeakPolarHBondContact O-CA 3.31Å; K38-N83 VanDerWaalsContact CD-OD1 3.25Å; K38-N83 WeakPolarHBondContact CD-OD1 3.48Å; K38-N83 VanDerWaalsContact CE-OD1 3.27Å; K38-N83 WeakPolarHBondContact CE-OD1 3.4Å; K38-N83 PolarHBondContact NZ-OD1 2.87Å; L81-N83 PolarHBondContact O-N 3.07Å; N83-F85 VanDerWaalsContact C-N 3.34Å; N83-F85 HydrophobicContact CB-CD2 4.42Å; N83-F85 HydrophobicContact CB-CE1 4.37Å; N83-F85 HydrophobicContact CB-CE2 4.04Å; N83-F85 HydrophobicContact CB-CZ 4.02Å; N83-F85 VanDerWaalsContact O-CD2 3.29Å; N83-F85 WeakPolarHBondContact O-CD2 3.33Å; N83-F85 PolarHBondContact O-N 2.94Å
84	N	72.7	Confident	66.7	Low	27 Å²	27	71.4 Å²	71.4	14%	0.144	37%	0.373	C	S	.	.			trans	-80.9	82.1	172.6	-157.6	-35.3	0	0	0	110.7	P37 V39 T45 F86 I87 T88	P37-N84 HydrophobicContact CB-CB 4.14Å; P37-N84 HydrophobicContact CG-CB 4.38Å; P37-N84 PolarHBondContact O-N 2.6Å; V39-N84 HydrophobicContact CG2-CB 3.21Å; V39-N84 VanDerWaalsContact CG2-CG 3.41Å; V39-N84 VanDerWaalsContact CG2-ND2 3.28Å; V39-N84 WeakPolarHBondContact CG2-ND2 3.48Å; T45-N84 HydrophobicContact CG2-CB 3.86Å; T45-N84 PolarHBondContact OG1-ND2 3.19Å; N84-F86 PolarHBondContact O-N 3.25Å; N84-F86 WeakPolarHBondContact OD1-CB 3.25Å; N84-F86 PolarHBondContact OD1-N 2.46Å; N84-I87 HydrophobicContact CB-CB 4.08Å; N84-I87 HydrophobicContact CB-CD1 4.4Å; N84-I87 HydrophobicContact CB-CG1 4.33Å; N84-I87 WeakPolarHBondContact ND2-CD1 3.31Å; N84-I87 PolarHBondContact O-N 2.88Å; N84-I87 VanDerWaalsContact O-N 3.09Å; N84-I87 PolarHBondContact OD1-N 2.72Å; N84-T88 PolarHBondContact O-N 3.11Å; N84-T88 PolarHBondContact O-OG1 2.9Å
85	F	65.6	Low	66.2	Low	114 Å²	114	73.7 Å²	73.7	50%	0.5	38%	0.379	S	S	.	.	H	α-helix	trans	-59.6	-27.4	179.7	-65.1	-78.7	0	0	0	113.1	N83 N89	N83-F85 VanDerWaalsContact C-N 3.34Å; N83-F85 HydrophobicContact CB-CD2 4.42Å; N83-F85 HydrophobicContact CB-CE1 4.37Å; N83-F85 HydrophobicContact CB-CE2 4.04Å; N83-F85 HydrophobicContact CB-CZ 4.02Å; N83-F85 VanDerWaalsContact O-CD2 3.29Å; N83-F85 WeakPolarHBondContact O-CD2 3.33Å; N83-F85 PolarHBondContact O-N 2.94Å; F85-N89 VanDerWaalsContact O-CB 3.3Å; F85-N89 WeakPolarHBondContact O-CB 3.4Å; F85-N89 PolarHBondContact O-N 3.11Å; F85-N89 PolarHBondContact O-ND2 3.13Å; F85-N89 PolarHBondContact O-OD1 2.87Å
86	F	65.4	Low	65.9	Low	152 Å²	152	71 Å²	71	67%	0.667	36%	0.36	S	S	*	.	H	α-helix	trans	-64.6	-45.1	174.7	-179.3	-94.1	0	0	0	111.6	N84 L90	N84-F86 PolarHBondContact O-N 3.25Å; N84-F86 WeakPolarHBondContact OD1-CB 3.25Å; N84-F86 PolarHBondContact OD1-N 2.46Å; F86-L90 VanDerWaalsContact O-CB 3.31Å; F86-L90 WeakPolarHBondContact O-CB 3.39Å; F86-L90 PolarHBondContact O-N 3.07Å
87	I	66.5	Low	65.3	Low	17 Å²	17	68.1 Å²	68.1	9%	0.087	35%	0.353	C	S	.	.	H	α-helix	trans	-70.5	-40.7	177.9	-70.2	-176.5	0	0	0	111	L25 Y34 P37 T45 N84 N89 L90 M91	L25-I87 HydrophobicContact CD2-CG2 3.82Å; Y34-I87 HydrophobicContact CD2-CD1 4.45Å; Y34-I87 HydrophobicContact CD2-CG2 3.58Å; Y34-I87 HydrophobicContact CE2-CD1 4.09Å; Y34-I87 HydrophobicContact CE2-CG2 4.22Å; Y34-I87 HydrophobicContact CG-CG2 4.2Å; P37-I87 HydrophobicContact CB-CG2 4.35Å; P37-I87 HydrophobicContact CG-CG2 4.22Å; T45-I87 HydrophobicContact CG2-CD1 3.95Å; N84-I87 HydrophobicContact CB-CB 4.08Å; N84-I87 HydrophobicContact CB-CD1 4.4Å; N84-I87 HydrophobicContact CB-CG1 4.33Å; N84-I87 WeakPolarHBondContact ND2-CD1 3.31Å; N84-I87 PolarHBondContact O-N 2.88Å; N84-I87 VanDerWaalsContact O-N 3.09Å; N84-I87 PolarHBondContact OD1-N 2.72Å; I87-N89 PolarHBondContact O-N 3.32Å; I87-L90 PolarHBondContact O-N 3.48Å; I87-M91 HydrophobicContact CG2-CG 4.37Å; I87-M91 WeakPolarHBondContact O-CB 3.33Å; I87-M91 WeakPolarHBondContact O-CG 3.49Å; I87-M91 PolarHBondContact O-N 2.75Å
88	T	65.9	Low	64.2	Low	43 Å²	43	71.6 Å²	71.6	26%	0.264	37%	0.369	S	S	.	.	H	α-helix	trans	-60.7	-45.5	176.2	-50.5	0	0	0	0	111.4	P37 N84 M91 E92	P37-T88 WeakPolarHBondContact CG-OG1 3.37Å; N84-T88 PolarHBondContact O-N 3.11Å; N84-T88 PolarHBondContact O-OG1 2.9Å; T88-M91 WeakPolarHBondContact O-CB 3.26Å; T88-M91 PolarHBondContact O-N 2.89Å; T88-E92 PolarHBondContact O-N 3.07Å
89	N	66.3	Low	62.8	Low	59 Å²	59	79.6 Å²	79.6	32%	0.316	41%	0.406	S	S	.	.	H	α-helix	trans	-67.2	-39.1	177.3	-69.4	-6.9	0	0	0	112.1	F85 I87 M91 E92 V93	F85-N89 VanDerWaalsContact O-CB 3.3Å; F85-N89 WeakPolarHBondContact O-CB 3.4Å; F85-N89 PolarHBondContact O-N 3.11Å; F85-N89 PolarHBondContact O-ND2 3.13Å; F85-N89 PolarHBondContact O-OD1 2.87Å; I87-N89 PolarHBondContact O-N 3.32Å; N89-M91 VanDerWaalsContact C-N 3.29Å; N89-M91 PolarHBondContact O-N 2.92Å; N89-E92 PolarHBondContact O-N 3.49Å; N89-V93 WeakPolarHBondContact O-CG2 3.48Å; N89-V93 PolarHBondContact O-N 3.14Å
90	L	66.4	Low	61.4	Low	52 Å²	52	82.8 Å²	82.8	27%	0.272	42%	0.423	S	S	.	.	H	α-helix	trans	-63.6	-37	176.3	-157.8	84.4	0	0	0	111.5	I20 L25 F86 I87 L94	I20-L90 HydrophobicContact CG2-CD2 4.06Å; L25-L90 HydrophobicContact CD1-CD2 4.13Å; L25-L90 HydrophobicContact CD2-CB 4.34Å; L25-L90 HydrophobicContact CD2-CD2 3.83Å; L25-L90 HydrophobicContact CG-CD2 4.16Å; F86-L90 VanDerWaalsContact O-CB 3.31Å; F86-L90 WeakPolarHBondContact O-CB 3.39Å; F86-L90 PolarHBondContact O-N 3.07Å; I87-L90 PolarHBondContact O-N 3.48Å; L90-L94 WeakPolarHBondContact O-CG 3.36Å; L90-L94 PolarHBondContact O-N 3.37Å
91	M	62.6	Low	60	Low	23 Å²	23	85.2 Å²	85.2	11%	0.113	44%	0.438	C	S	.	.	H	α-helix	trans	-65	-42.1	174	-73.8	-71.2	-62.6	0	0	112.3	L25 R33 I87 T88 N89 Q95	L25-M91 HydrophobicContact CB-SD 3.71Å; L25-M91 HydrophobicContact CD1-CG 4.46Å; L25-M91 HydrophobicContact CD1-SD 3.69Å; L25-M91 HydrophobicContact CD2-CG 3.79Å; L25-M91 HydrophobicContact CD2-SD 3.74Å; L25-M91 HydrophobicContact CG-SD 3.91Å; R33-M91 HydrophobicContact CB-CE 3.87Å; R33-M91 HydrophobicContact CG-CE 3.93Å; R33-M91 HydrophobicContact CG-SD 4.47Å; I87-M91 HydrophobicContact CG2-CG 4.37Å; I87-M91 WeakPolarHBondContact O-CB 3.33Å; I87-M91 WeakPolarHBondContact O-CG 3.49Å; I87-M91 PolarHBondContact O-N 2.75Å; T88-M91 WeakPolarHBondContact O-CB 3.26Å; T88-M91 PolarHBondContact O-N 2.89Å; N89-M91 VanDerWaalsContact C-N 3.29Å; N89-M91 PolarHBondContact O-N 2.92Å; M91-Q95 VanDerWaalsContact O-CG 3.29Å; M91-Q95 WeakPolarHBondContact O-CG 3.48Å; M91-Q95 PolarHBondContact O-N 3.11Å
92	E	65.2	Low	58.2	Low	90 Å²	90	95.6 Å²	95.6	42%	0.421	48%	0.475	S	S	.	.	H	α-helix	trans	-69	-41.1	179.1	-74.5	179.9	-172.9	0	0	112.8	T88 N89 Q95 R96	T88-E92 PolarHBondContact O-N 3.07Å; N89-E92 PolarHBondContact O-N 3.49Å; E92-Q95 PolarHBondContact O-N 3.41Å; E92-R96 PolarHBondContact O-N 3.03Å
93	V	63.8	Low	56.4	Low	85 Å²	85	92.4 Å²	92.4	52%	0.515	48%	0.477	S	S	.	.	H	α-helix	trans	-64.2	-43.4	178.4	171.4	0	0	0	0	111.3	N89 Q95 R96	N89-V93 WeakPolarHBondContact O-CG2 3.48Å; N89-V93 PolarHBondContact O-N 3.14Å; V93-Q95 VanDerWaalsContact C-N 3.29Å; V93-Q95 PolarHBondContact O-N 3.41Å; V93-R96 PolarHBondContact O-N 2.88Å
94	L	59.6	Low	54.3	Low	34 Å²	34	99.2 Å²	99.2	18%	0.178	51%	0.507	C	S	.	.	H	α-helix	trans	-71.4	-21.8	178.5	-70.3	173.3	0	0	0	113.6	V17 L25 L90 T98	V17-L94 HydrophobicContact CG1-CD2 3.81Å; L25-L94 HydrophobicContact CD1-CD1 3.47Å; L25-L94 VanDerWaalsContact CD1-CD1 3.47Å; L90-L94 WeakPolarHBondContact O-CG 3.36Å; L90-L94 PolarHBondContact O-N 3.37Å; L94-T98 PolarHBondContact O-OG1 2.91Å
95	Q	58.3	Low	52.5	Low	102 Å²	102	102.5 Å²	102.5	48%	0.477	54%	0.537	S	S	.	.	H	α-helix	trans	-72.6	-36.9	171.9	-77.8	173.5	15.2	0	0	111.8	M91 E92 V93 D97 T98	M91-Q95 VanDerWaalsContact O-CG 3.29Å; M91-Q95 WeakPolarHBondContact O-CG 3.48Å; M91-Q95 PolarHBondContact O-N 3.11Å; E92-Q95 PolarHBondContact O-N 3.41Å; V93-Q95 VanDerWaalsContact C-N 3.29Å; V93-Q95 PolarHBondContact O-N 3.41Å; Q95-D97 PolarHBondContact O-N 3.45Å; Q95-T98 PolarHBondContact O-N 3.14Å; Q95-T98 PolarHBondContact O-OG1 2.81Å
96	R	53.8	Low	50.7	Low	148 Å²	148	102.5 Å²	102.5	56%	0.558	55%	0.551	S	S	*	*	H	α-helix	trans	-63.9	-34.3	179.5	-73.2	-179.4	-179.1	162.2	5.5	113.8	E92 V93 T98 E99	E92-R96 PolarHBondContact O-N 3.03Å; V93-R96 PolarHBondContact O-N 2.88Å; R96-T98 PolarHBondContact O-N 2.76Å; R96-T98 VanDerWaalsContact O-N 3.14Å; R96-E99 PolarHBondContact O-N 2.93Å
97	D	49.2	Very low	48.9	Very low	118 Å²	118	102.8 Å²	102.8	63%	0.631	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65	-15.2	176.9	-81.3	-20.9	0	0	0	113.6	Q95	Q95-D97 PolarHBondContact O-N 3.45Å
98	T	45.5	Very low	47.6	Very low	100 Å²	100	108 Å²	108	61%	0.613	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.2	-19	-177.2	-35.8	0	0	0	0	112.7	L94 Q95 R96	L94-T98 PolarHBondContact O-OG1 2.91Å; Q95-T98 PolarHBondContact O-N 3.14Å; Q95-T98 PolarHBondContact O-OG1 2.81Å; R96-T98 PolarHBondContact O-N 2.76Å; R96-T98 VanDerWaalsContact O-N 3.14Å
99	E	40.6	Very low	46.1	Very low	180 Å²	180	113.5 Å²	113.5	84%	0.841	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.7	-9.9	-174.7	-67.9	-168.7	159.5	0	0	114.6	R96 S101	R96-E99 PolarHBondContact O-N 2.93Å; E99-S101 PolarHBondContact O-N 2.9Å
100	C	37	Very low	44.3	Very low	116 Å²	116	119.8 Å²	119.8	78%	0.784	65%	0.646	S	S	*	*			trans	-100.3	61.8	178.3	-162.1	0	0	0	0	112.4
101	S	38.9	Very low	42.7	Very low	97 Å²	97	122.3 Å²	122.3	68%	0.678	67%	0.668	S	S	*	*			trans	-125.1	53.6	173.6	-66.7	0	0	0	0	112.5	E99	E99-S101 PolarHBondContact O-N 2.9Å
102	R	34.7	Very low	41.2	Very low	238 Å²	238	126 Å²	126	90%	0.898	70%	0.702	S	S	*	*	S	Bend	trans	-135.7	103.4	161.3	-85.8	178.8	65.4	164.8	-2.3	109.7
103	A	33.6	Very low	39.6	Very low	94 Å²	94	128.7 Å²	128.7	78%	0.777	72%	0.72	S	S	*	*			trans	40.4	121.4	151.5	0	0	0	0	0	117.5
104	E	28.5	Very low	38.2	Very low	195 Å²	195	128.6 Å²	128.6	91%	0.911	73%	0.727	S	S	*	*				-164.1	161.8	58.9	-91.8	171.8	171.9	0	0	111.7
105	A	34.8	Very low	37	Very low	95 Å²	95	131.7 Å²	131.7	79%	0.785	76%	0.758	S	S	*	*			trans	-68.8	140.2	-172.1	0	0	0	0	0	115.2
106	C	28.1	Very low	36	Very low	115 Å²	115	131.7 Å²	131.7	78%	0.777	77%	0.769	S	S	*	*				179.3	131.1	122.5	-93.2	0	0	0	0	113.7
107	N	27.3	Very low	35.2	Very low	158 Å²	158	130.9 Å²	130.9	85%	0.845	78%	0.781	S	S	*	*			trans	74.9	133.8	149.1	-62	-21.5	0	0	0	122.3
108	V	38.5	Very low	35	Very low	127 Å²	127	130.7 Å²	130.7	77%	0.77	79%	0.788	S	S	*	*			trans	-88.6	153.7	-169.5	-177.1	0	0	0	0	110.1
109	L	34.4	Very low	35.3	Very low	158 Å²	158	132.4 Å²	132.4	83%	0.827	79%	0.789	S	S	*	*	S	Bend	trans	85.9	83	169.3	-67.5	118.9	0	0	0	116.8
110	E	29.2	Very low	36.1	Very low	190 Å²	190	127.9 Å²	127.9	89%	0.888	78%	0.775	S	S	*	*			trans	162.1	83.8	138.4	-94.1	177.7	173.1	0	0	109.5
111	S	33.4	Very low	37.2	Very low	106 Å²	106	126.6 Å²	126.6	74%	0.741	76%	0.76	S	S	*	*			trans	-148.2	9.9	172.9	-53.1	0	0	0	0	115.4	N113	S111-N113 PolarHBondContact O-N 2.85Å
112	A	31.1	Very low	38.3	Very low	101 Å²	101	125.4 Å²	125.4	84%	0.835	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.1	-7.9	172.6	0	0	0	0	0	113.6
113	N	31.3	Very low	39.7	Very low	146 Å²	146	114.5 Å²	114.5	78%	0.781	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.9	2.2	178.8	-75.9	-0.4	0	0	0	114.3	S111 A115 S116	S111-N113 PolarHBondContact O-N 2.85Å; N113-A115 VanDerWaalsContact C-N 3.32Å; N113-A115 PolarHBondContact O-N 3.36Å; N113-S116 PolarHBondContact O-OG 3.41Å
114	A	33.7	Very low	41.1	Very low	82 Å²	82	115.8 Å²	115.8	68%	0.678	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	18.1	-174.3	0	0	0	0	0	115.2
115	A	34.7	Very low	42.7	Very low	100 Å²	100	112 Å²	112	83%	0.826	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.8	23.6	178.7	0	0	0	0	0	113.6	N113	N113-A115 VanDerWaalsContact C-N 3.32Å; N113-A115 PolarHBondContact O-N 3.36Å
116	S	37.3	Very low	44.1	Very low	101 Å²	101	110.1 Å²	110.1	71%	0.706	67%	0.673	S	S	*	*			trans	-118.8	21.3	-176.3	52.7	0	0	0	0	115	N113	N113-S116 PolarHBondContact O-OG 3.41Å
117	T	38.2	Very low	45.6	Very low	131 Å²	131	113.8 Å²	113.8	80%	0.804	68%	0.679	S	S	*	*			trans	-115.6	81.8	165.3	44.6	0	0	0	0	109.8	Q119	T117-Q119 PolarHBondContact O-N 3.23Å
118	C	44.5	Very low	47.2	Very low	115 Å²	115	109.8 Å²	109.8	78%	0.777	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-59.8	128.7	160.6	-68.3	0	0	0	0	108
119	Q	51.9	Low	48.7	Very low	135 Å²	135	107.7 Å²	107.7	63%	0.631	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-57.2	127.7	167.1	-84.9	179.3	-70.7	0	0	108.1	T117 L121	T117-Q119 PolarHBondContact O-N 3.23Å; Q119-L121 PolarHBondContact O-N 3.12Å
120	P	57.1	Low	50.6	Low	85 Å²	85	102.6 Å²	102.6	55%	0.552	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-61.9	128.6	-178.8	16.4	-24.8	0	0	0	110.4	S122 V130	P120-S122 PolarHBondContact O-N 2.77Å; P120-V130 HydrophobicContact CB-CB 4.08Å; P120-V130 HydrophobicContact CB-CG1 3.29Å; P120-V130 HydrophobicContact CB-CG2 3.68Å; P120-V130 HydrophobicContact CG-CG1 4.17Å; P120-V130 HydrophobicContact CG-CG2 3.71Å
121	L	60.2	Low	52.6	Low	89 Å²	89	95.5 Å²	95.5	47%	0.466	60%	0.598	S	S	.	*	P	Polyproline II helix	trans	-64	128.8	177.5	-73.3	162	0	0	0	109.5	Q119 M131	Q119-L121 PolarHBondContact O-N 3.12Å; L121-M131 HydrophobicContact CB-CE 3.42Å; L121-M131 VanDerWaalsContact CB-CE 3.42Å; L121-M131 HydrophobicContact CD1-CE 4.49Å; L121-M131 PolarHBondContact O-N 2.87Å
122	S	62.7	Low	54.4	Low	73 Å²	73	96 Å²	96	51%	0.51	59%	0.589	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-78.1	146	176.6	50	0	0	0	0	111.4	P120 K129	P120-S122 PolarHBondContact O-N 2.77Å; S122-K129 CarbonylContact C-O 3.5Å; S122-K129 VanDerWaalsContact CA-O 3.24Å; S122-K129 WeakPolarHBondContact CA-O 3.47Å
123	C	62.8	Low	56.5	Low	9 Å²	9	93.7 Å²	93.7	6%	0.061	56%	0.56	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-62.2	131.2	177	-178.4	0	0	0	0	110.4	N125 H126 K129 M131 C143	C123-N125 PolarHBondContact O-N 2.82Å; C123-H126 HydrophobicContact CB-CB 4.04Å; C123-H126 CarbonylContact O-C 3.42Å; C123-H126 PolarHBondContact O-N 2.86Å; C123-H126 VanDerWaalsContact O-O 3.09Å; C123-K129 PolarHBondContact N-O 3.09Å; C123-M131 HydrophobicContact CB-CG 4.29Å; C123-C143 HydrophobicContact CB-CB 3.94Å; C123-C143 VanDerWaalsContact SG-SG 3.69Å
124	P	64.2	Low	58.7	Low	121 Å²	121	88.5 Å²	88.5	79%	0.786	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-29.4	178.4	-22	31.8	0	0	0	114
125	N	61.9	Low	60.8	Low	115 Å²	115	84.6 Å²	84.6	62%	0.615	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-16.5	179.2	-92.2	10.9	0	0	0	113.3	C123	C123-N125 PolarHBondContact O-N 2.82Å
126	H	64.1	Low	62.5	Low	55 Å²	55	85.1 Å²	85.1	26%	0.255	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	97.3	-176.1	-59.3	111.1	0	0	0	110.3	C123 G128 K129 C143 E145 C146	C123-H126 HydrophobicContact CB-CB 4.04Å; C123-H126 CarbonylContact O-C 3.42Å; C123-H126 PolarHBondContact O-N 2.86Å; C123-H126 VanDerWaalsContact O-O 3.09Å; H126-G128 PolarHBondContact O-N 3.02Å; H126-K129 HydrophobicContact CB-CB 4.27Å; H126-K129 HydrophobicContact CB-CD 4.25Å; H126-K129 HydrophobicContact CB-CG 4.46Å; H126-K129 PolarHBondContact O-N 2.75Å; H126-C143 PolarHBondContact ND1-SG 3.47Å; H126-C143 VanDerWaalsContact ND1-SG 3.42Å; H126-E145 IonicContact CD2-OE2 2.67Å; H126-E145 PolarHBondContact CD2-OE2 2.81Å; H126-E145 IonicContact CG-OE2 3.06Å; H126-E145 IonicContact NE2-OE2 3.31Å; H126-C146 PolarHBondContact CE1-SG 3Å; H126-C146 PolarHBondContact ND1-SG 3.42Å
127	E	59.7	Low	64.1	Low	192 Å²	192	84.1 Å²	84.1	90%	0.897	48%	0.476	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-56.5	130.9	-177.6	-69.7	-168.6	159.6	0	0	112	K129	E127-K129 VanDerWaalsContact C-N 3.3Å; E127-K129 PolarHBondContact O-N 2.83Å
128	G	60.3	Low	65.6	Low	74 Å²	74	80.1 Å²	80.1	76%	0.763	45%	0.452	S	S	*	.	E	Extended strand (participates in β ladder)	trans	79	-2.6	176.5	0	0	0	0	0	116.3	H126	H126-G128 PolarHBondContact O-N 3.02Å
129	K	70.4	Confident	66.9	Low	83 Å²	83	82.1 Å²	82.1	36%	0.361	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	134	-179.4	-65.4	-167.7	176.6	110.2	0	112.8	S122 C123 H126 E127 C143 E145	S122-K129 CarbonylContact C-O 3.5Å; S122-K129 VanDerWaalsContact CA-O 3.24Å; S122-K129 WeakPolarHBondContact CA-O 3.47Å; C123-K129 PolarHBondContact N-O 3.09Å; H126-K129 HydrophobicContact CB-CB 4.27Å; H126-K129 HydrophobicContact CB-CD 4.25Å; H126-K129 HydrophobicContact CB-CG 4.46Å; H126-K129 PolarHBondContact O-N 2.75Å; E127-K129 VanDerWaalsContact C-N 3.3Å; E127-K129 PolarHBondContact O-N 2.83Å; K129-C143 HydrophobicContact CB-CB 4.25Å; K129-E145 VanDerWaalsContact CD-CD 3.43Å; K129-E145 HydrophobicContact CD-CG 4.02Å; K129-E145 VanDerWaalsContact CD-OE2 3.28Å; K129-E145 WeakPolarHBondContact CD-OE2 3.16Å; K129-E145 WeakPolarHBondContact CE-OE1 3.27Å; K129-E145 VanDerWaalsContact CE-OE2 3.3Å; K129-E145 WeakPolarHBondContact CE-OE2 3.38Å; K129-E145 IonicContact NZ-OE1 2.64Å; K129-E145 PolarHBondContact NZ-OE1 2.94Å; K129-E145 IonicContact NZ-OE2 2.67Å; K129-E145 PolarHBondContact NZ-OE2 3.09Å
130	V	73.1	Confident	67.6	Low	52 Å²	52	78.6 Å²	78.6	32%	0.315	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	140.4	-176.5	178.2	0	0	0	0	111.5	P120 E132 C143	P120-V130 HydrophobicContact CB-CB 4.08Å; P120-V130 HydrophobicContact CB-CG1 3.29Å; P120-V130 HydrophobicContact CB-CG2 3.68Å; P120-V130 HydrophobicContact CG-CG1 4.17Å; P120-V130 HydrophobicContact CG-CG2 3.71Å; V130-E132 HydrophobicContact CB-CG 4.3Å; V130-E132 HydrophobicContact CG1-CG 3.81Å; V130-E132 PolarHBondContact O-N 3.24Å; V130-C143 WeakPolarHBondContact O-CA 3.38Å; V130-C143 WeakPolarHBondContact O-CB 3.5Å
131	M	70.9	Confident	68.4	Low	40 Å²	40	76.7 Å²	76.7	20%	0.197	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	109.8	170.5	-63.3	-176	-73.5	0	0	110.5	L121 C123 A141 M142	L121-M131 HydrophobicContact CB-CE 3.42Å; L121-M131 VanDerWaalsContact CB-CE 3.42Å; L121-M131 HydrophobicContact CD1-CE 4.49Å; L121-M131 PolarHBondContact O-N 2.87Å; C123-M131 HydrophobicContact CB-CG 4.29Å; M131-A141 HydrophobicContact SD-CB 4.39Å; M131-M142 CarbonylContact C-O 3.52Å; M131-M142 WeakPolarHBondContact CA-O 3.43Å
132	E	73.1	Confident	69.1	Low	117 Å²	117	72.7 Å²	72.7	55%	0.547	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	-13.2	-175.7	-63.2	-171.5	148.5	0	0	113.6	V130 M142 L159	V130-E132 HydrophobicContact CB-CG 4.3Å; V130-E132 HydrophobicContact CG1-CG 3.81Å; V130-E132 PolarHBondContact O-N 3.24Å; E132-M142 PolarHBondContact N-O 3.35Å; E132-L159 WeakPolarHBondContact O-CB 3.28Å; E132-L159 PolarHBondContact O-N 2.82Å
133	F	74.6	Confident	69.7	Low	52 Å²	52	69.3 Å²	69.3	23%	0.228	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	153.7	-175.7	-62.2	-85.2	0	0	0	111.2	A141 M142 L144 T147	F133-A141 CarbonylContact O-C 3.54Å; F133-A141 WeakPolarHBondContact O-CA 3.48Å; F133-M142 HydrophobicContact CB-CG 4.07Å; F133-M142 PolarHBondContact N-O 2.92Å; F133-M142 PolarHBondContact O-N 3.26Å; F133-L144 HydrophobicContact CD2-CD1 4.36Å; F133-L144 HydrophobicContact CE2-CB 4.18Å; F133-L144 HydrophobicContact CE2-CD1 3.5Å; F133-L144 VanDerWaalsContact CE2-CD1 3.5Å; F133-L144 HydrophobicContact CE2-CG 4.44Å; F133-L144 HydrophobicContact CZ-CD1 3.86Å; F133-T147 HydrophobicContact CB-CG2 3.85Å; F133-T147 HydrophobicContact CD2-CG2 4.21Å; F133-T147 HydrophobicContact CG-CG2 4.04Å
134	Y	77.4	Confident	70.3	Confident	38 Å²	38	73.1 Å²	73.1	15%	0.149	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	132.2	175.3	-176.3	-99.3	0	0	0	109.7	E136 E139 T156 V157 L159 V162	Y134-E136 HydrophobicContact CD1-CG 4.27Å; Y134-E136 HydrophobicContact CE1-CG 4.33Å; Y134-E139 VanDerWaalsContact OH-CA 3.26Å; Y134-E139 WeakPolarHBondContact OH-CA 3.23Å; Y134-T156 WeakPolarHBondContact O-CA 3.32Å; Y134-V157 HydrophobicContact CD1-CG2 4.34Å; Y134-V157 PolarHBondContact N-O 2.94Å; Y134-V157 WeakPolarHBondContact O-CG2 3.08Å; Y134-V157 PolarHBondContact O-N 2.98Å; Y134-L159 HydrophobicContact CD2-CD1 4.17Å; Y134-L159 HydrophobicContact CG-CD1 4.45Å; Y134-V162 HydrophobicContact CD1-CB 4.38Å; Y134-V162 HydrophobicContact CD1-CG1 3.75Å; Y134-V162 HydrophobicContact CD1-CG2 4.09Å; Y134-V162 HydrophobicContact CE1-CG1 3.96Å; Y134-V162 HydrophobicContact CG-CG1 4.1Å
135	C	77.1	Confident	70.5	Confident	0 Å²	0	71 Å²	71	0%	0	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	118.5	173.2	174.8	0	0	0	0	109.8	S137 C138 E139 T140 M142 H154 T156	C135-S137 VanDerWaalsContact C-N 3.32Å; C135-S137 PolarHBondContact O-N 2.63Å; C135-C138 HydrophobicContact CB-CB 4.34Å; C135-C138 PolarHBondContact O-N 3.5Å; C135-C138 PolarHBondContact SG-N 3.37Å; C135-C138 VanDerWaalsContact SG-N 3.44Å; C135-E139 WeakPolarHBondContact O-CA 3.48Å; C135-E139 PolarHBondContact O-N 2.71Å; C135-T140 PolarHBondContact N-O 3.47Å; C135-T140 PolarHBondContact O-N 2.98Å; C135-M142 HydrophobicContact CB-CE 3.12Å; C135-M142 HydrophobicContact CB-SD 3.83Å; C135-H154 WeakPolarHBondContact SG-CB 3.46Å; C135-T156 HydrophobicContact CB-CG2 4.19Å
136	E	71.4	Confident	70.9	Confident	110 Å²	110	66.1 Å²	66.1	51%	0.514	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-31.9	179	-64.2	-176.6	163.8	0	0	112.1	Y134 C138 V155 V157	Y134-E136 HydrophobicContact CD1-CG 4.27Å; Y134-E136 HydrophobicContact CE1-CG 4.33Å; E136-C138 VanDerWaalsContact C-N 3.34Å; E136-C138 PolarHBondContact O-N 2.9Å; E136-V155 PolarHBondContact N-O 3.04Å; E136-V157 HydrophobicContact CG-CG2 4.15Å
137	S	71.3	Confident	71.1	Confident	80 Å²	80	64.6 Å²	64.6	56%	0.559	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-24.8	-179.1	-49.3	0	0	0	0	113.6	C135	C135-S137 VanDerWaalsContact C-N 3.32Å; C135-S137 PolarHBondContact O-N 2.63Å
138	C	68.9	Low	71.6	Confident	47 Å²	47	61.8 Å²	61.8	32%	0.318	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.6	-4.5	-178	-57.7	0	0	0	0	113.3	C135 E136 T140 H151 H154	C135-C138 HydrophobicContact CB-CB 4.34Å; C135-C138 PolarHBondContact O-N 3.5Å; C135-C138 PolarHBondContact SG-N 3.37Å; C135-C138 VanDerWaalsContact SG-N 3.44Å; E136-C138 VanDerWaalsContact C-N 3.34Å; E136-C138 PolarHBondContact O-N 2.9Å; C138-T140 WeakPolarHBondContact CB-OG1 3.41Å; C138-T140 WeakPolarHBondContact O-CG2 3.31Å; C138-T140 PolarHBondContact O-N 3.07Å; C138-H151 PolarHBondContact SG-CE1 3.43Å; C138-H151 PolarHBondContact SG-ND1 3.11Å; C138-H154 PolarHBondContact SG-CE1 3.45Å
139	E	71.8	Confident	72.2	Confident	157 Å²	157	60.6 Å²	60.6	73%	0.734	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.9	29.2	-174.8	-59.3	-175.7	175.5	0	0	114.5	Y134 C135	Y134-E139 VanDerWaalsContact OH-CA 3.26Å; Y134-E139 WeakPolarHBondContact OH-CA 3.23Å; C135-E139 WeakPolarHBondContact O-CA 3.48Å; C135-E139 PolarHBondContact O-N 2.71Å
140	T	67.3	Low	72	Confident	62 Å²	62	63.8 Å²	63.8	38%	0.38	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	140.3	-174	49.1	0	0	0	0	113.1	C135 C138	C135-T140 PolarHBondContact N-O 3.47Å; C135-T140 PolarHBondContact O-N 2.98Å; C138-T140 WeakPolarHBondContact CB-OG1 3.41Å; C138-T140 WeakPolarHBondContact O-CG2 3.31Å; C138-T140 PolarHBondContact O-N 3.07Å
141	A	73.9	Confident	71.7	Confident	44 Å²	44	62.7 Å²	62.7	36%	0.364	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	141.2	167.9	0	0	0	0	0	110.2	M131 F133 L159	M131-A141 HydrophobicContact SD-CB 4.39Å; F133-A141 CarbonylContact O-C 3.54Å; F133-A141 WeakPolarHBondContact O-CA 3.48Å; A141-L159 HydrophobicContact CB-CD1 4.05Å; A141-L159 HydrophobicContact CB-CD2 4.39Å
142	M	73.1	Confident	71.5	Confident	6 Å²	6	70.5 Å²	70.5	3%	0.03	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	156.9	-170.1	57.8	-175	57.2	0	0	113.1	M131 E132 F133 C135 C146 T147 H151 T156	M131-M142 CarbonylContact C-O 3.52Å; M131-M142 WeakPolarHBondContact CA-O 3.43Å; E132-M142 PolarHBondContact N-O 3.35Å; F133-M142 HydrophobicContact CB-CG 4.07Å; F133-M142 PolarHBondContact N-O 2.92Å; F133-M142 PolarHBondContact O-N 3.26Å; C135-M142 HydrophobicContact CB-CE 3.12Å; C135-M142 HydrophobicContact CB-SD 3.83Å; M142-C146 HydrophobicContact CB-CB 3.87Å; M142-T147 HydrophobicContact CG-CG2 3.97Å; M142-T147 HydrophobicContact SD-CG2 3.77Å; M142-H151 HydrophobicContact CE-CB 4.04Å; M142-H151 WeakPolarHBondContact CE-CD2 3.2Å; M142-H151 VanDerWaalsContact CE-CG 3.41Å; M142-H151 HydrophobicContact SD-CB 3.9Å; M142-T156 HydrophobicContact SD-CG2 3.87Å
143	C	77.1	Confident	71.3	Confident	1 Å²	1	74.2 Å²	74.2	1%	0.007	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	166.8	173.4	69.5	0	0	0	0	111.3	C123 H126 K129 V130 E145 C146 T147	C123-C143 HydrophobicContact CB-CB 3.94Å; C123-C143 VanDerWaalsContact SG-SG 3.69Å; H126-C143 PolarHBondContact ND1-SG 3.47Å; H126-C143 VanDerWaalsContact ND1-SG 3.42Å; K129-C143 HydrophobicContact CB-CB 4.25Å; V130-C143 WeakPolarHBondContact O-CA 3.38Å; V130-C143 WeakPolarHBondContact O-CB 3.5Å; C143-E145 PolarHBondContact O-N 2.85Å; C143-C146 WeakPolarHBondContact O-CB 3.38Å; C143-C146 PolarHBondContact O-N 3.45Å; C143-C146 VanDerWaalsContact O-N 3.08Å; C143-C146 VanDerWaalsContact SG-SG 3.61Å; C143-T147 PolarHBondContact O-N 3.45Å
144	L	73.9	Confident	71.4	Confident	90 Å²	90	75.3 Å²	75.3	47%	0.471	39%	0.385	S	S	.	.	H	α-helix	trans	-54.5	-37.7	-179.6	-171.6	68.7	0	0	0	112.7	F133 C146 T147 E148	F133-L144 HydrophobicContact CD2-CD1 4.36Å; F133-L144 HydrophobicContact CE2-CB 4.18Å; F133-L144 HydrophobicContact CE2-CD1 3.5Å; F133-L144 VanDerWaalsContact CE2-CD1 3.5Å; F133-L144 HydrophobicContact CE2-CG 4.44Å; F133-L144 HydrophobicContact CZ-CD1 3.86Å; L144-C146 PolarHBondContact O-N 3.24Å; L144-T147 PolarHBondContact O-N 2.91Å; L144-T147 PolarHBondContact O-OG1 2.87Å; L144-E148 PolarHBondContact O-N 3.34Å
145	E	70.1	Confident	71.2	Confident	75 Å²	75	78 Å²	78	35%	0.35	41%	0.406	S	S	.	.	H	α-helix	trans	-72.2	-30.1	-179.9	-66.1	-174.1	169	0	0	113.6	H126 K129 C143 T147 E148 G149	H126-E145 IonicContact CD2-OE2 2.67Å; H126-E145 PolarHBondContact CD2-OE2 2.81Å; H126-E145 IonicContact CG-OE2 3.06Å; H126-E145 IonicContact NE2-OE2 3.31Å; K129-E145 VanDerWaalsContact CD-CD 3.43Å; K129-E145 HydrophobicContact CD-CG 4.02Å; K129-E145 VanDerWaalsContact CD-OE2 3.28Å; K129-E145 WeakPolarHBondContact CD-OE2 3.16Å; K129-E145 WeakPolarHBondContact CE-OE1 3.27Å; K129-E145 VanDerWaalsContact CE-OE2 3.3Å; K129-E145 WeakPolarHBondContact CE-OE2 3.38Å; K129-E145 IonicContact NZ-OE1 2.64Å; K129-E145 PolarHBondContact NZ-OE1 2.94Å; K129-E145 IonicContact NZ-OE2 2.67Å; K129-E145 PolarHBondContact NZ-OE2 3.09Å; C143-E145 PolarHBondContact O-N 2.85Å; E145-T147 VanDerWaalsContact C-N 3.3Å; E145-E148 PolarHBondContact O-N 2.97Å; E145-G149 PolarHBondContact O-N 3.32Å
146	C	69	Low	71.1	Confident	14 Å²	14	80.4 Å²	80.4	10%	0.095	42%	0.421	C	S	.	.	H	α-helix	trans	-68.9	-30.6	173.1	-74	0	0	0	0	112	H126 M142 C143 L144 E148 E150 H151	H126-C146 PolarHBondContact CE1-SG 3Å; H126-C146 PolarHBondContact ND1-SG 3.42Å; M142-C146 HydrophobicContact CB-CB 3.87Å; C143-C146 WeakPolarHBondContact O-CB 3.38Å; C143-C146 PolarHBondContact O-N 3.45Å; C143-C146 VanDerWaalsContact O-N 3.08Å; C143-C146 VanDerWaalsContact SG-SG 3.61Å; L144-C146 PolarHBondContact O-N 3.24Å; C146-E148 VanDerWaalsContact C-N 3.3Å; C146-E150 PolarHBondContact O-N 2.96Å; C146-H151 PolarHBondContact O-N 3.31Å; C146-H151 VanDerWaalsContact O-N 3.11Å
147	T	68.4	Low	71.4	Confident	22 Å²	22	76.9 Å²	76.9	14%	0.135	41%	0.407	C	S	.	.	H	α-helix	trans	-68	-31.3	174.6	67.9	0	0	0	0	112.4	F133 M142 C143 L144 E145 H151 R152 T156	F133-T147 HydrophobicContact CB-CG2 3.85Å; F133-T147 HydrophobicContact CD2-CG2 4.21Å; F133-T147 HydrophobicContact CG-CG2 4.04Å; M142-T147 HydrophobicContact CG-CG2 3.97Å; M142-T147 HydrophobicContact SD-CG2 3.77Å; C143-T147 PolarHBondContact O-N 3.45Å; L144-T147 PolarHBondContact O-N 2.91Å; L144-T147 PolarHBondContact O-OG1 2.87Å; E145-T147 VanDerWaalsContact C-N 3.3Å; T147-H151 CarbonylContact O-C 3.57Å; T147-R152 WeakPolarHBondContact O-CA 3.33Å; T147-R152 PolarHBondContact O-N 3.18Å; T147-T156 HydrophobicContact CG2-CG2 4.05Å
148	E	69.4	Low	71.8	Confident	134 Å²	134	74.9 Å²	74.9	63%	0.626	39%	0.392	S	S	*	.	H	α-helix	trans	-88	-22.5	-179.2	-65.9	-178.5	176.3	0	0	113	L144 E145 C146	L144-E148 PolarHBondContact O-N 3.34Å; E145-E148 PolarHBondContact O-N 2.97Å; C146-E148 VanDerWaalsContact C-N 3.3Å
149	G	74.5	Confident	72	Confident	49 Å²	49	74.3 Å²	74.3	51%	0.505	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.4	-103.5	177.2	0	0	0	0	0	113.6	E145 H151 R152	E145-G149 PolarHBondContact O-N 3.32Å; G149-H151 VanDerWaalsContact C-N 3.27Å; G149-H151 PolarHBondContact O-N 2.96Å; G149-R152 WeakPolarHBondContact O-CB 3.18Å; G149-R152 PolarHBondContact O-N 3.33Å
150	E	66.3	Low	72	Confident	150 Å²	150	74.8 Å²	74.8	70%	0.701	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-23.5	-169.8	-66.3	-174.7	164.9	0	0	114.4	C146	C146-E150 PolarHBondContact O-N 2.96Å
151	H	67.1	Low	72.2	Confident	29 Å²	29	75.6 Å²	75.6	13%	0.134	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.2	22.1	-178.5	-62.2	-87.4	0	0	0	113.9	C138 M142 C146 T147 G149 E153 H154	C138-H151 PolarHBondContact SG-CE1 3.43Å; C138-H151 PolarHBondContact SG-ND1 3.11Å; M142-H151 HydrophobicContact CE-CB 4.04Å; M142-H151 WeakPolarHBondContact CE-CD2 3.2Å; M142-H151 VanDerWaalsContact CE-CG 3.41Å; M142-H151 HydrophobicContact SD-CB 3.9Å; C146-H151 PolarHBondContact O-N 3.31Å; C146-H151 VanDerWaalsContact O-N 3.11Å; T147-H151 CarbonylContact O-C 3.57Å; G149-H151 VanDerWaalsContact C-N 3.27Å; G149-H151 PolarHBondContact O-N 2.96Å; H151-E153 PolarHBondContact O-N 3.08Å; H151-E153 VanDerWaalsContact O-N 3.15Å; H151-H154 HydrophobicContact CB-CB 4.36Å; H151-H154 AromaticContact CG-ND1 3.83Å; H151-H154 AromaticContact ND1-CE1 3.89Å; H151-H154 AromaticContact ND1-ND1 3.18Å; H151-H154 PolarHBondContact ND1-ND1 3.01Å; H151-H154 VanDerWaalsContact ND1-ND1 3.18Å; H151-H154 PolarHBondContact O-N 2.95Å
152	R	66.8	Low	72.2	Confident	204 Å²	204	74 Å²	74	77%	0.77	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-28.6	-176.3	-171.9	176.1	177.8	-179.2	1	114.7	T147 G149	T147-R152 WeakPolarHBondContact O-CA 3.33Å; T147-R152 PolarHBondContact O-N 3.18Å; G149-R152 WeakPolarHBondContact O-CB 3.18Å; G149-R152 PolarHBondContact O-N 3.33Å
153	E	68.3	Low	72.2	Confident	194 Å²	194	78.5 Å²	78.5	91%	0.907	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.8	-0.1	178.7	-62.1	-165.8	167.4	0	0	113.7	H151	H151-E153 PolarHBondContact O-N 3.08Å; H151-E153 VanDerWaalsContact O-N 3.15Å
154	H	76	Confident	72.1	Confident	75 Å²	75	85.2 Å²	85.2	35%	0.347	42%	0.423	S	S	.	.	S	Bend	trans	-99.4	147.8	-177.9	-60.3	136.3	0	0	0	112.5	C135 C138 H151 T156	C135-H154 WeakPolarHBondContact SG-CB 3.46Å; C138-H154 PolarHBondContact SG-CE1 3.45Å; H151-H154 HydrophobicContact CB-CB 4.36Å; H151-H154 AromaticContact CG-ND1 3.83Å; H151-H154 AromaticContact ND1-CE1 3.89Å; H151-H154 AromaticContact ND1-ND1 3.18Å; H151-H154 PolarHBondContact ND1-ND1 3.01Å; H151-H154 VanDerWaalsContact ND1-ND1 3.18Å; H151-H154 PolarHBondContact O-N 2.95Å; H154-T156 PolarHBondContact O-N 2.84Å
155	V	73.4	Confident	72.2	Confident	95 Å²	95	86.9 Å²	86.9	58%	0.576	43%	0.428	S	S	*	.			trans	-72.4	121.1	174.7	-178	0	0	0	0	108.7	E136	E136-V155 PolarHBondContact N-O 3.04Å
156	T	74.8	Confident	72.5	Confident	51 Å²	51	87.9 Å²	87.9	31%	0.313	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	138.4	180	56.7	0	0	0	0	110.2	Y134 C135 M142 T147 H154	Y134-T156 WeakPolarHBondContact O-CA 3.32Å; C135-T156 HydrophobicContact CB-CG2 4.19Å; M142-T156 HydrophobicContact SD-CG2 3.87Å; T147-T156 HydrophobicContact CG2-CG2 4.05Å; H154-T156 PolarHBondContact O-N 2.84Å
157	V	78.4	Confident	72.8	Confident	36 Å²	36	94.8 Å²	94.8	22%	0.218	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	152.2	-177.2	-74	0	0	0	0	109.8	Y134 E136 L159 V162	Y134-V157 HydrophobicContact CD1-CG2 4.34Å; Y134-V157 PolarHBondContact N-O 2.94Å; Y134-V157 WeakPolarHBondContact O-CG2 3.08Å; Y134-V157 PolarHBondContact O-N 2.98Å; E136-V157 HydrophobicContact CG-CG2 4.15Å; V157-L159 PolarHBondContact O-N 2.82Å; V157-V162 HydrophobicContact CB-CG2 4.15Å; V157-V162 HydrophobicContact CG2-CG2 3.23Å
158	P	78.4	Confident	73.1	Confident	38 Å²	38	96.4 Å²	96.4	25%	0.247	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	129.4	176.8	-22.2	33.4	0	0	0	110.8	R160 D161	P158-R160 HydrophobicContact CB-CG 4Å; P158-R160 PolarHBondContact O-N 3.07Å; P158-R160 VanDerWaalsContact O-N 3.13Å; P158-D161 PolarHBondContact O-N 3.09Å; P158-D161 VanDerWaalsContact O-N 3.1Å
159	L	73.6	Confident	73.7	Confident	35 Å²	35	93.2 Å²	93.2	18%	0.183	46%	0.463	C	S	.	.	H	α-helix	trans	-57.4	-34.3	-174.6	-178.9	65.7	0	0	0	112.2	E132 Y134 A141 V157 D161 L163	E132-L159 WeakPolarHBondContact O-CB 3.28Å; E132-L159 PolarHBondContact O-N 2.82Å; Y134-L159 HydrophobicContact CD2-CD1 4.17Å; Y134-L159 HydrophobicContact CG-CD1 4.45Å; A141-L159 HydrophobicContact CB-CD1 4.05Å; A141-L159 HydrophobicContact CB-CD2 4.39Å; V157-L159 PolarHBondContact O-N 2.82Å; L159-D161 VanDerWaalsContact C-N 3.34Å; L159-D161 PolarHBondContact O-N 2.88Å; L159-L163 HydrophobicContact CD1-CD1 4.32Å; L159-L163 HydrophobicContact CD1-CG 4.13Å; L159-L163 HydrophobicContact CD2-CD1 4.23Å; L159-L163 HydrophobicContact CG-CD1 3.73Å; L159-L163 HydrophobicContact CG-CG 4.03Å; L159-L163 VanDerWaalsContact O-CB 3.27Å; L159-L163 WeakPolarHBondContact O-CB 3.26Å; L159-L163 WeakPolarHBondContact O-CG 2.84Å; L159-L163 PolarHBondContact O-N 2.84Å
160	R	71.4	Confident	73.9	Confident	167 Å²	167	96.1 Å²	96.1	63%	0.63	47%	0.466	S	S	*	.	H	α-helix	trans	-57.4	-41.4	177.8	52.4	161.8	-166.2	-94.3	-4.9	113.6	P158 L163 E164	P158-R160 HydrophobicContact CB-CG 4Å; P158-R160 PolarHBondContact O-N 3.07Å; P158-R160 VanDerWaalsContact O-N 3.13Å; R160-L163 PolarHBondContact O-N 2.88Å; R160-E164 PolarHBondContact O-N 2.9Å; R160-E164 VanDerWaalsContact O-N 3.1Å
161	D	72.4	Confident	74.5	Confident	78 Å²	78	95.3 Å²	95.3	42%	0.417	46%	0.46	S	S	.	.	H	α-helix	trans	-76.6	-38.4	-171.3	-57.7	-22.8	0	0	0	109.4	P158 L159 Q165	P158-D161 PolarHBondContact O-N 3.09Å; P158-D161 VanDerWaalsContact O-N 3.1Å; L159-D161 VanDerWaalsContact C-N 3.34Å; L159-D161 PolarHBondContact O-N 2.88Å; D161-Q165 PolarHBondContact O-N 2.81Å
162	V	73.1	Confident	75.2	Confident	12 Å²	12	98.9 Å²	98.9	7%	0.073	48%	0.48	C	S	.	.	H	α-helix	trans	-67.5	-41.8	171.8	178.3	0	0	0	0	111.4	Y134 V157 E164 Q165 H166	Y134-V162 HydrophobicContact CD1-CB 4.38Å; Y134-V162 HydrophobicContact CD1-CG1 3.75Å; Y134-V162 HydrophobicContact CD1-CG2 4.09Å; Y134-V162 HydrophobicContact CE1-CG1 3.96Å; Y134-V162 HydrophobicContact CG-CG1 4.1Å; V157-V162 HydrophobicContact CB-CG2 4.15Å; V157-V162 HydrophobicContact CG2-CG2 3.23Å; V162-E164 VanDerWaalsContact C-N 3.35Å; V162-E164 PolarHBondContact O-N 3.46Å; V162-Q165 PolarHBondContact O-N 2.77Å; V162-H166 WeakPolarHBondContact CG1-CD2 3.38Å; V162-H166 WeakPolarHBondContact O-CB 3.46Å; V162-H166 PolarHBondContact O-CD2 3.03Å; V162-H166 PolarHBondContact O-N 2.85Å
163	L	73.4	Confident	75.9	Confident	99 Å²	99	94.6 Å²	94.6	52%	0.518	47%	0.469	S	S	.	.	H	α-helix	trans	-61.4	-41.7	178.9	-80	174	0	0	0	112.2	L159 R160 K167	L159-L163 HydrophobicContact CD1-CD1 4.32Å; L159-L163 HydrophobicContact CD1-CG 4.13Å; L159-L163 HydrophobicContact CD2-CD1 4.23Å; L159-L163 HydrophobicContact CG-CD1 3.73Å; L159-L163 HydrophobicContact CG-CG 4.03Å; L159-L163 VanDerWaalsContact O-CB 3.27Å; L159-L163 WeakPolarHBondContact O-CB 3.26Å; L159-L163 WeakPolarHBondContact O-CG 2.84Å; L159-L163 PolarHBondContact O-N 2.84Å; R160-L163 PolarHBondContact O-N 2.88Å; L163-K167 WeakPolarHBondContact O-CB 3.43Å; L163-K167 PolarHBondContact O-N 3.47Å
164	E	76	Confident	76.5	Confident	143 Å²	143	89.3 Å²	89.3	67%	0.668	45%	0.447	S	S	*	.	H	α-helix	trans	-64.8	-42.4	176.1	-73.3	-172.7	170	0	0	111.8	R160 V162 K167 S168	R160-E164 PolarHBondContact O-N 2.9Å; R160-E164 VanDerWaalsContact O-N 3.1Å; V162-E164 VanDerWaalsContact C-N 3.35Å; V162-E164 PolarHBondContact O-N 3.46Å; E164-K167 PolarHBondContact O-N 3.4Å; E164-S168 WeakPolarHBondContact O-CB 3.44Å; E164-S168 PolarHBondContact O-N 2.71Å
165	Q	75.4	Confident	76.8	Confident	125 Å²	125	88.6 Å²	88.6	58%	0.584	45%	0.446	S	S	*	.	H	α-helix	trans	-62.6	-51	175.4	-172.6	176.3	-2.8	0	0	111.7	D161 V162 K167 S168 V169	D161-Q165 PolarHBondContact O-N 2.81Å; V162-Q165 PolarHBondContact O-N 2.77Å; Q165-K167 VanDerWaalsContact C-N 3.34Å; Q165-K167 PolarHBondContact O-N 2.95Å; Q165-S168 PolarHBondContact O-N 3.11Å; Q165-S168 PolarHBondContact O-OG 3.39Å; Q165-V169 WeakPolarHBondContact O-CG2 3.42Å; Q165-V169 PolarHBondContact O-N 2.82Å
166	H	75.6	Confident	77.2	Confident	96 Å²	96	88.6 Å²	88.6	44%	0.444	45%	0.446	S	S	.	.	H	α-helix	trans	-63.2	-38.4	177.9	-82.8	-94.8	0	0	0	112.3	V162 S168 V169 L170	V162-H166 WeakPolarHBondContact CG1-CD2 3.38Å; V162-H166 WeakPolarHBondContact O-CB 3.46Å; V162-H166 PolarHBondContact O-CD2 3.03Å; V162-H166 PolarHBondContact O-N 2.85Å; H166-S168 VanDerWaalsContact C-N 3.33Å; H166-S168 PolarHBondContact O-N 2.87Å; H166-V169 PolarHBondContact O-N 2.83Å; H166-L170 WeakPolarHBondContact O-CB 3.2Å; H166-L170 PolarHBondContact O-N 2.81Å
167	K	75.3	Confident	77.5	Confident	159 Å²	159	90.5 Å²	90.5	69%	0.691	46%	0.457	S	S	*	.	H	α-helix	trans	-62.5	-40.3	174.5	-175.5	178.4	-178.8	-179.2	0	111.5	L163 E164 Q165 K171	L163-K167 WeakPolarHBondContact O-CB 3.43Å; L163-K167 PolarHBondContact O-N 3.47Å; E164-K167 PolarHBondContact O-N 3.4Å; Q165-K167 VanDerWaalsContact C-N 3.34Å; Q165-K167 PolarHBondContact O-N 2.95Å; K167-K171 VanDerWaalsContact O-CB 3.28Å; K167-K171 WeakPolarHBondContact O-CB 3.37Å; K167-K171 PolarHBondContact O-N 2.79Å
168	S	76.4	Confident	77.7	Confident	56 Å²	56	95.3 Å²	95.3	39%	0.392	47%	0.472	S	S	.	.	H	α-helix	trans	-65.7	-41.9	176.4	79.2	0	0	0	0	112.2	E164 Q165 H166 K171 N172	E164-S168 WeakPolarHBondContact O-CB 3.44Å; E164-S168 PolarHBondContact O-N 2.71Å; Q165-S168 PolarHBondContact O-N 3.11Å; Q165-S168 PolarHBondContact O-OG 3.39Å; H166-S168 VanDerWaalsContact C-N 3.33Å; H166-S168 PolarHBondContact O-N 2.87Å; S168-K171 PolarHBondContact O-N 2.96Å; S168-N172 VanDerWaalsContact O-CG 3.31Å; S168-N172 PolarHBondContact O-N 3.1Å; S168-N172 PolarHBondContact O-ND2 3.04Å
169	V	81.1	Confident	77.9	Confident	67 Å²	67	99 Å²	99	41%	0.406	49%	0.489	S	S	.	.	H	α-helix	trans	-64.8	-47.2	176.9	173.6	0	0	0	0	111	Q165 H166 K171 N172 Q173	Q165-V169 WeakPolarHBondContact O-CG2 3.42Å; Q165-V169 PolarHBondContact O-N 2.82Å; H166-V169 PolarHBondContact O-N 2.83Å; V169-K171 VanDerWaalsContact C-N 3.31Å; V169-K171 PolarHBondContact O-N 2.82Å; V169-N172 PolarHBondContact O-N 3.24Å; V169-Q173 WeakPolarHBondContact O-CG 3.34Å; V169-Q173 PolarHBondContact O-N 3.01Å
170	L	78.1	Confident	78.3	Confident	109 Å²	109	104.5 Å²	104.5	57%	0.571	51%	0.507	S	S	*	.	H	α-helix	trans	-60.9	-39.2	176	-86.3	156.9	0	0	0	112	H166 Q173 L174	H166-L170 WeakPolarHBondContact O-CB 3.2Å; H166-L170 PolarHBondContact O-N 2.81Å; L170-Q173 PolarHBondContact O-N 3.1Å; L170-L174 VanDerWaalsContact O-CB 3.27Å; L170-L174 WeakPolarHBondContact O-CB 3.38Å; L170-L174 PolarHBondContact O-N 3.43Å
171	K	78.8	Confident	78.9	Confident	133 Å²	133	101.4 Å²	101.4	58%	0.578	50%	0.503	S	S	*	.	H	α-helix	trans	-65	-45	176.4	-168.7	176.8	179.7	-175.3	0	111.5	K167 S168 V169 Q173 L174 D175	K167-K171 VanDerWaalsContact O-CB 3.28Å; K167-K171 WeakPolarHBondContact O-CB 3.37Å; K167-K171 PolarHBondContact O-N 2.79Å; S168-K171 PolarHBondContact O-N 2.96Å; V169-K171 VanDerWaalsContact C-N 3.31Å; V169-K171 PolarHBondContact O-N 2.82Å; K171-Q173 VanDerWaalsContact C-N 3.35Å; K171-Q173 PolarHBondContact O-N 2.77Å; K171-L174 PolarHBondContact O-N 2.77Å; K171-D175 WeakPolarHBondContact O-CB 3.19Å; K171-D175 VanDerWaalsContact O-CG 3.29Å; K171-D175 PolarHBondContact O-N 3.23Å
172	N	82.8	Confident	79.6	Confident	104 Å²	104	101.7 Å²	101.7	56%	0.556	51%	0.509	S	S	*	.	H	α-helix	trans	-62.1	-41.1	175.6	-71.4	-20.9	0	0	0	112.2	S168 V169 D175 T176	S168-N172 VanDerWaalsContact O-CG 3.31Å; S168-N172 PolarHBondContact O-N 3.1Å; S168-N172 PolarHBondContact O-ND2 3.04Å; V169-N172 PolarHBondContact O-N 3.24Å; N172-D175 PolarHBondContact O-N 3.39Å; N172-T176 WeakPolarHBondContact O-CB 3.3Å; N172-T176 PolarHBondContact O-N 2.88Å; N172-T176 PolarHBondContact O-OG1 3.31Å
173	Q	81.8	Confident	80	Confident	115 Å²	115	107.6 Å²	107.6	54%	0.537	54%	0.536	S	S	.	.	H	α-helix	trans	-64.8	-42.3	174.5	-72.7	176.4	-18.3	0	0	111.7	V169 L170 K171 T176 V177	V169-Q173 WeakPolarHBondContact O-CG 3.34Å; V169-Q173 PolarHBondContact O-N 3.01Å; L170-Q173 PolarHBondContact O-N 3.1Å; K171-Q173 VanDerWaalsContact C-N 3.35Å; K171-Q173 PolarHBondContact O-N 2.77Å; Q173-T176 WeakPolarHBondContact O-CB 3.43Å; Q173-T176 PolarHBondContact O-N 3.26Å; Q173-V177 WeakPolarHBondContact O-CG2 3.5Å; Q173-V177 PolarHBondContact O-N 3.14Å
174	L	81.2	Confident	80.5	Confident	82 Å²	82	107.3 Å²	107.3	43%	0.429	53%	0.534	S	S	.	.	H	α-helix	trans	-63.2	-43	176.9	-175.1	68.2	0	0	0	111.7	L170 K171 T176 V177 R178	L170-L174 VanDerWaalsContact O-CB 3.27Å; L170-L174 WeakPolarHBondContact O-CB 3.38Å; L170-L174 PolarHBondContact O-N 3.43Å; K171-L174 PolarHBondContact O-N 2.77Å; L174-T176 VanDerWaalsContact C-N 3.34Å; L174-V177 PolarHBondContact O-N 3.49Å; L174-R178 WeakPolarHBondContact O-CB 3.45Å; L174-R178 WeakPolarHBondContact O-CG 3.25Å; L174-R178 PolarHBondContact O-N 2.87Å
175	D	81.8	Confident	80.9	Confident	61 Å²	61	105 Å²	105	33%	0.326	53%	0.53	S	S	.	.	H	α-helix	trans	-66.6	-37.8	177.6	-68.9	-23.9	0	0	0	110.8	K171 N172 V177 R178 N179	K171-D175 WeakPolarHBondContact O-CB 3.19Å; K171-D175 VanDerWaalsContact O-CG 3.29Å; K171-D175 PolarHBondContact O-N 3.23Å; N172-D175 PolarHBondContact O-N 3.39Å; D175-V177 VanDerWaalsContact C-N 3.34Å; D175-V177 PolarHBondContact O-N 3.23Å; D175-R178 PolarHBondContact O-N 3.43Å; D175-N179 WeakPolarHBondContact O-CB 3.48Å; D175-N179 PolarHBondContact O-N 3.1Å; D175-N179 PolarHBondContact O-ND2 3.32Å
176	T	82.4	Confident	81.2	Confident	94 Å²	94	101.9 Å²	101.9	58%	0.577	53%	0.526	S	S	*	.	H	α-helix	trans	-60	-42.5	172.7	-55.2	0	0	0	0	112	N172 Q173 L174	N172-T176 WeakPolarHBondContact O-CB 3.3Å; N172-T176 PolarHBondContact O-N 2.88Å; N172-T176 PolarHBondContact O-OG1 3.31Å; Q173-T176 WeakPolarHBondContact O-CB 3.43Å; Q173-T176 PolarHBondContact O-N 3.26Å; L174-T176 VanDerWaalsContact C-N 3.34Å
177	V	80.1	Confident	81.6	Confident	92 Å²	92	99.5 Å²	99.5	56%	0.558	52%	0.523	S	S	*	.	H	α-helix	trans	-71.7	-42.3	177.2	175.4	0	0	0	0	111.4	Q173 L174 D175 N179 R180	Q173-V177 WeakPolarHBondContact O-CG2 3.5Å; Q173-V177 PolarHBondContact O-N 3.14Å; L174-V177 PolarHBondContact O-N 3.49Å; D175-V177 VanDerWaalsContact C-N 3.34Å; D175-V177 PolarHBondContact O-N 3.23Å; V177-N179 VanDerWaalsContact C-N 3.27Å; V177-N179 PolarHBondContact O-N 3.38Å; V177-R180 WeakPolarHBondContact O-CB 3.28Å; V177-R180 PolarHBondContact O-N 3.41Å
178	R	82	Confident	82.1	Confident	137 Å²	137	97 Å²	97	52%	0.517	52%	0.515	S	S	.	.	H	α-helix	trans	-61	-36.6	176.7	-80.6	178.4	173.6	161.3	-3	112.2	L174 D175 R180 L181 P182	L174-R178 WeakPolarHBondContact O-CB 3.45Å; L174-R178 WeakPolarHBondContact O-CG 3.25Å; L174-R178 PolarHBondContact O-N 2.87Å; D175-R178 PolarHBondContact O-N 3.43Å; R178-R180 PolarHBondContact O-N 3.01Å; R178-L181 HydrophobicContact CG-CD1 4.43Å; R178-L181 WeakPolarHBondContact O-CB 3.41Å; R178-L181 PolarHBondContact O-N 3.38Å; R178-P182 VanDerWaalsContact O-CD 3.26Å; R178-P182 WeakPolarHBondContact O-CD 3.41Å
179	N	83.6	Confident	82.6	Confident	114 Å²	114	95.7 Å²	95.7	61%	0.61	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-15.8	175.8	-70.9	-20.8	0	0	0	113.6	D175 V177	D175-N179 WeakPolarHBondContact O-CB 3.48Å; D175-N179 PolarHBondContact O-N 3.1Å; D175-N179 PolarHBondContact O-ND2 3.32Å; V177-N179 VanDerWaalsContact C-N 3.27Å; V177-N179 PolarHBondContact O-N 3.38Å
180	R	82.5	Confident	82.8	Confident	152 Å²	152	97.3 Å²	97.3	57%	0.574	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-20.6	171.3	-61.8	-178.4	65.1	-169.2	-1.5	113.3	V177 R178 Q183 L184	V177-R180 WeakPolarHBondContact O-CB 3.28Å; V177-R180 PolarHBondContact O-N 3.41Å; R178-R180 PolarHBondContact O-N 3.01Å; R180-Q183 WeakPolarHBondContact O-CB 3.15Å; R180-Q183 PolarHBondContact O-N 3.18Å; R180-L184 PolarHBondContact O-N 2.86Å; R180-L184 VanDerWaalsContact O-N 3.1Å
181	L	82.9	Confident	83.1	Confident	102 Å²	102	96.7 Å²	96.7	53%	0.534	52%	0.518	S	S	.	.	H	α-helix	trans	-60.5	-45.8	-178.9	-68.3	170	0	0	0	112.4	R178 Q183 L184 T185	R178-L181 HydrophobicContact CG-CD1 4.43Å; R178-L181 WeakPolarHBondContact O-CB 3.41Å; R178-L181 PolarHBondContact O-N 3.38Å; L181-Q183 VanDerWaalsContact C-N 3.3Å; L181-Q183 PolarHBondContact O-N 2.76Å; L181-L184 PolarHBondContact O-N 2.97Å; L181-T185 PolarHBondContact O-N 3.44Å; L181-T185 PolarHBondContact O-OG1 3.22Å; L181-T185 VanDerWaalsContact O-OG1 3.04Å
182	P	86.9	Confident	83.5	Confident	84 Å²	84	95.1 Å²	95.1	55%	0.545	52%	0.516	S	S	.	.	H	α-helix	trans	-59.3	-37.7	175.6	-25.1	34.6	0	0	0	113.7	R178 T185 A186	R178-P182 VanDerWaalsContact O-CD 3.26Å; R178-P182 WeakPolarHBondContact O-CD 3.41Å; P182-T185 PolarHBondContact O-N 2.96Å; P182-A186 WeakPolarHBondContact O-CB 3.21Å; P182-A186 PolarHBondContact O-N 3.05Å
183	Q	82.6	Confident	83.7	Confident	135 Å²	135	94.7 Å²	94.7	63%	0.631	51%	0.513	S	S	*	.	H	α-helix	trans	-64.8	-41.4	177.4	-63.6	177.3	-7.2	0	0	111.4	R180 L181 A187	R180-Q183 WeakPolarHBondContact O-CB 3.15Å; R180-Q183 PolarHBondContact O-N 3.18Å; L181-Q183 VanDerWaalsContact C-N 3.3Å; L181-Q183 PolarHBondContact O-N 2.76Å; Q183-A187 WeakPolarHBondContact O-CB 3.32Å; Q183-A187 PolarHBondContact O-N 3.19Å
184	L	83.2	Confident	83.9	Confident	93 Å²	93	93.1 Å²	93.1	49%	0.487	51%	0.508	S	S	.	.	H	α-helix	trans	-67.7	-41.2	175.7	-68.7	174.5	0	0	0	111.8	R180 L181 A186 A187 I188	R180-L184 PolarHBondContact O-N 2.86Å; R180-L184 VanDerWaalsContact O-N 3.1Å; L181-L184 PolarHBondContact O-N 2.97Å; L184-A186 VanDerWaalsContact C-N 3.35Å; L184-A186 PolarHBondContact O-N 3.45Å; L184-A187 PolarHBondContact O-N 2.68Å; L184-I188 VanDerWaalsContact O-CG1 3.27Å; L184-I188 WeakPolarHBondContact O-CG1 3.47Å; L184-I188 PolarHBondContact O-N 2.84Å
185	T	84	Confident	84	Confident	95 Å²	95	92.4 Å²	92.4	58%	0.583	51%	0.51	S	S	*	.	H	α-helix	trans	-61.8	-42.4	176.2	-56.1	0	0	0	0	111.6	L181 P182 I188 G189	L181-T185 PolarHBondContact O-N 3.44Å; L181-T185 PolarHBondContact O-OG1 3.22Å; L181-T185 VanDerWaalsContact O-OG1 3.04Å; P182-T185 PolarHBondContact O-N 2.96Å; T185-I188 PolarHBondContact O-N 2.82Å; T185-G189 PolarHBondContact O-N 3.32Å; T185-G189 VanDerWaalsContact O-N 3.11Å
186	A	83.2	Confident	84.3	Confident	60 Å²	60	95.8 Å²	95.8	50%	0.496	52%	0.521	S	S	.	.	H	α-helix	trans	-63.6	-42.3	175.2	0	0	0	0	0	112	P182 L184 I188 G189 L190	P182-A186 WeakPolarHBondContact O-CB 3.21Å; P182-A186 PolarHBondContact O-N 3.05Å; L184-A186 VanDerWaalsContact C-N 3.35Å; L184-A186 PolarHBondContact O-N 3.45Å; A186-I188 VanDerWaalsContact C-N 3.35Å; A186-I188 PolarHBondContact O-N 2.84Å; A186-G189 PolarHBondContact O-N 3.1Å; A186-L190 PolarHBondContact O-N 2.92Å; A186-L190 VanDerWaalsContact O-N 3.08Å
187	A	82.1	Confident	84.4	Confident	46 Å²	46	95.7 Å²	95.7	38%	0.38	51%	0.514	S	S	.	.	H	α-helix	trans	-62.8	-39.7	175.8	0	0	0	0	0	112.4	Q183 L184 G189 L190 V191	Q183-A187 WeakPolarHBondContact O-CB 3.32Å; Q183-A187 PolarHBondContact O-N 3.19Å; L184-A187 PolarHBondContact O-N 2.68Å; A187-G189 VanDerWaalsContact C-N 3.31Å; A187-G189 PolarHBondContact O-N 2.9Å; A187-L190 PolarHBondContact O-N 3.44Å; A187-V191 WeakPolarHBondContact O-CG2 3.42Å; A187-V191 PolarHBondContact O-N 3.42Å
188	I	87.8	Confident	84.6	Confident	105 Å²	105	97 Å²	97	54%	0.538	52%	0.518	S	S	.	.	H	α-helix	trans	-60.7	-42	174.6	-69.6	163.8	0	0	0	110.8	L184 T185 A186 V191 N192	L184-I188 VanDerWaalsContact O-CG1 3.27Å; L184-I188 WeakPolarHBondContact O-CG1 3.47Å; L184-I188 PolarHBondContact O-N 2.84Å; T185-I188 PolarHBondContact O-N 2.82Å; A186-I188 VanDerWaalsContact C-N 3.35Å; A186-I188 PolarHBondContact O-N 2.84Å; I188-V191 PolarHBondContact O-N 2.99Å; I188-N192 PolarHBondContact O-N 3.05Å; I188-N192 PolarHBondContact O-ND2 3.19Å
189	G	85.8	Confident	84.8	Confident	29 Å²	29	95.4 Å²	95.4	30%	0.299	52%	0.517	S	S	.	.	H	α-helix	trans	-57.1	-52.9	174.3	0	0	0	0	0	112.3	T185 A186 A187 V191 N192 D193	T185-G189 PolarHBondContact O-N 3.32Å; T185-G189 VanDerWaalsContact O-N 3.11Å; A186-G189 PolarHBondContact O-N 3.1Å; A187-G189 VanDerWaalsContact C-N 3.31Å; A187-G189 PolarHBondContact O-N 2.9Å; G189-V191 VanDerWaalsContact C-N 3.32Å; G189-V191 PolarHBondContact O-N 2.8Å; G189-N192 PolarHBondContact O-N 2.96Å; G189-N192 VanDerWaalsContact O-N 3.11Å; G189-D193 PolarHBondContact O-N 3.31Å
190	L	85.4	Confident	85.1	Confident	102 Å²	102	94.2 Å²	94.2	53%	0.534	51%	0.508	S	S	.	.	H	α-helix	trans	-58.5	-40.5	178.9	-70	171.1	0	0	0	113	A186 A187 D193 I194	A186-L190 PolarHBondContact O-N 2.92Å; A186-L190 VanDerWaalsContact O-N 3.08Å; A187-L190 PolarHBondContact O-N 3.44Å; L190-D193 PolarHBondContact O-N 3.41Å; L190-I194 WeakPolarHBondContact O-CG1 3.43Å; L190-I194 PolarHBondContact O-N 2.79Å
191	V	84.5	Confident	85.1	Confident	96 Å²	96	94 Å²	94	58%	0.582	51%	0.507	S	S	*	.	H	α-helix	trans	-65.2	-41.3	177.5	171.5	0	0	0	0	111.2	A187 I188 G189 S195	A187-V191 WeakPolarHBondContact O-CG2 3.42Å; A187-V191 PolarHBondContact O-N 3.42Å; I188-V191 PolarHBondContact O-N 2.99Å; G189-V191 VanDerWaalsContact C-N 3.32Å; G189-V191 PolarHBondContact O-N 2.8Å; V191-S195 VanDerWaalsContact O-CB 3.32Å; V191-S195 WeakPolarHBondContact O-CB 3.39Å; V191-S195 PolarHBondContact O-N 3.19Å
192	N	87.6	Confident	85.3	Confident	100 Å²	100	94.9 Å²	94.9	54%	0.535	51%	0.507	S	S	.	.	H	α-helix	trans	-65.4	-39.6	176.5	-73	-29.7	0	0	0	111.8	I188 G189 S195 K196	I188-N192 PolarHBondContact O-N 3.05Å; I188-N192 PolarHBondContact O-ND2 3.19Å; G189-N192 PolarHBondContact O-N 2.96Å; G189-N192 VanDerWaalsContact O-N 3.11Å; N192-S195 WeakPolarHBondContact O-CB 3.27Å; N192-S195 PolarHBondContact O-N 2.8Å; N192-K196 PolarHBondContact O-N 2.83Å
193	D	87.1	Confident	85.4	Confident	94 Å²	94	95.1 Å²	95.1	50%	0.503	50%	0.504	S	S	.	.	H	α-helix	trans	-65.1	-46.2	177.6	-68.4	-23.8	0	0	0	111.6	G189 L190 S195 K196 Q197	G189-D193 PolarHBondContact O-N 3.31Å; L190-D193 PolarHBondContact O-N 3.41Å; D193-S195 VanDerWaalsContact C-N 3.3Å; D193-S195 PolarHBondContact O-N 2.85Å; D193-K196 WeakPolarHBondContact O-CB 3.38Å; D193-K196 PolarHBondContact O-N 3.32Å; D193-Q197 WeakPolarHBondContact O-CG 3.3Å; D193-Q197 PolarHBondContact O-N 2.82Å
194	I	84.7	Confident	85.7	Confident	83 Å²	83	94.3 Å²	94.3	43%	0.426	50%	0.5	S	S	.	.	H	α-helix	trans	-62.3	-39.1	175.4	-67.9	170.4	0	0	0	111	L190 K196 Q197 L198	L190-I194 WeakPolarHBondContact O-CG1 3.43Å; L190-I194 PolarHBondContact O-N 2.79Å; I194-K196 VanDerWaalsContact C-N 3.32Å; I194-K196 PolarHBondContact O-N 2.86Å; I194-Q197 PolarHBondContact O-N 3.02Å; I194-L198 WeakPolarHBondContact O-CB 3.45Å; I194-L198 PolarHBondContact O-N 3.44Å
195	S	84.8	Confident	85.7	Confident	67 Å²	67	91.5 Å²	91.5	47%	0.469	49%	0.49	S	S	.	.	H	α-helix	trans	-61	-41.5	175.4	-174.9	0	0	0	0	111.9	V191 N192 D193 L198 M199	V191-S195 VanDerWaalsContact O-CB 3.32Å; V191-S195 WeakPolarHBondContact O-CB 3.39Å; V191-S195 PolarHBondContact O-N 3.19Å; N192-S195 WeakPolarHBondContact O-CB 3.27Å; N192-S195 PolarHBondContact O-N 2.8Å; D193-S195 VanDerWaalsContact C-N 3.3Å; D193-S195 PolarHBondContact O-N 2.85Å; S195-L198 PolarHBondContact O-N 2.9Å; S195-M199 PolarHBondContact O-N 2.92Å
196	K	87.8	Confident	85.9	Confident	131 Å²	131	90.7 Å²	90.7	57%	0.57	49%	0.485	S	S	*	.	H	α-helix	trans	-65.3	-46.9	175.8	-171.7	-177.4	174.8	-165.8	0	111.8	N192 D193 I194 L198 M199 E200	N192-K196 PolarHBondContact O-N 2.83Å; D193-K196 WeakPolarHBondContact O-CB 3.38Å; D193-K196 PolarHBondContact O-N 3.32Å; I194-K196 VanDerWaalsContact C-N 3.32Å; I194-K196 PolarHBondContact O-N 2.86Å; K196-L198 VanDerWaalsContact C-N 3.27Å; K196-L198 PolarHBondContact O-N 2.88Å; K196-M199 WeakPolarHBondContact O-CB 3.31Å; K196-M199 PolarHBondContact O-N 2.85Å; K196-M199 VanDerWaalsContact O-N 3.09Å; K196-E200 WeakPolarHBondContact CE-OE1 3.34Å; K196-E200 IonicContact NZ-OE1 3.72Å; K196-E200 PolarHBondContact O-N 3.04Å
197	Q	83.9	Confident	86.3	Confident	92 Å²	92	91.5 Å²	91.5	43%	0.43	48%	0.484	S	S	.	.	H	α-helix	trans	-59.6	-37.8	176.5	-71.1	177.3	4.6	0	0	112.3	D193 I194 M199 E200 R201	D193-Q197 WeakPolarHBondContact O-CG 3.3Å; D193-Q197 PolarHBondContact O-N 2.82Å; I194-Q197 PolarHBondContact O-N 3.02Å; Q197-M199 VanDerWaalsContact C-N 3.33Å; Q197-M199 PolarHBondContact O-N 2.84Å; Q197-E200 PolarHBondContact O-N 2.85Å; Q197-R201 WeakPolarHBondContact O-CG 3.31Å; Q197-R201 PolarHBondContact O-N 2.94Å
198	L	83.6	Confident	86.5	Confident	121 Å²	121	94 Å²	94	63%	0.634	49%	0.491	S	S	*	.	H	α-helix	trans	-63	-40.1	175.8	-178.5	64.6	0	0	0	111.8	I194 S195 K196 K202	I194-L198 WeakPolarHBondContact O-CB 3.45Å; I194-L198 PolarHBondContact O-N 3.44Å; S195-L198 PolarHBondContact O-N 2.9Å; K196-L198 VanDerWaalsContact C-N 3.27Å; K196-L198 PolarHBondContact O-N 2.88Å; L198-K202 WeakPolarHBondContact O-CB 3.36Å; L198-K202 PolarHBondContact O-N 3.28Å
199	M	87.1	Confident	86.4	Confident	103 Å²	103	92.7 Å²	92.7	51%	0.507	48%	0.484	S	S	.	.	H	α-helix	trans	-68.1	-39	176.7	-75.5	-69.6	-72.1	0	0	112.4	S195 K196 Q197 K202 N203	S195-M199 PolarHBondContact O-N 2.92Å; K196-M199 WeakPolarHBondContact O-CB 3.31Å; K196-M199 PolarHBondContact O-N 2.85Å; K196-M199 VanDerWaalsContact O-N 3.09Å; Q197-M199 VanDerWaalsContact C-N 3.33Å; Q197-M199 PolarHBondContact O-N 2.84Å; M199-K202 PolarHBondContact O-N 2.88Å; M199-K202 HydrophobicContact SD-CD 4.44Å; M199-N203 VanDerWaalsContact O-CG 3.29Å; M199-N203 PolarHBondContact O-N 2.97Å; M199-N203 VanDerWaalsContact O-N 3.13Å; M199-N203 PolarHBondContact O-ND2 2.75Å
200	E	89.1	Confident	86.6	Confident	89 Å²	89	94.2 Å²	94.2	42%	0.416	49%	0.49	S	S	.	.	H	α-helix	trans	-63.3	-52.3	175.2	-72	168.8	178.3	0	0	111	K196 Q197 K202 N203 E204	K196-E200 WeakPolarHBondContact CE-OE1 3.34Å; K196-E200 IonicContact NZ-OE1 3.72Å; K196-E200 PolarHBondContact O-N 3.04Å; Q197-E200 PolarHBondContact O-N 2.85Å; E200-K202 VanDerWaalsContact C-N 3.26Å; E200-K202 PolarHBondContact O-N 2.83Å; E200-N203 WeakPolarHBondContact O-CB 3.49Å; E200-N203 PolarHBondContact O-N 2.84Å; E200-E204 PolarHBondContact O-N 2.79Å
201	R	84.1	Confident	86.8	Confident	146 Å²	146	93.3 Å²	93.3	55%	0.551	49%	0.486	S	S	*	.	H	α-helix	trans	-59.8	-34.7	176.8	-73.5	-176.5	-179.7	155.2	3	113.3	Q197 A205	Q197-R201 WeakPolarHBondContact O-CG 3.31Å; Q197-R201 PolarHBondContact O-N 2.94Å; R201-A205 WeakPolarHBondContact O-CB 3.43Å; R201-A205 PolarHBondContact O-N 3.28Å
202	K	86.4	Confident	86.9	Confident	121 Å²	121	92 Å²	92	53%	0.526	48%	0.478	S	S	.	.	H	α-helix	trans	-60.9	-47.1	173	175.3	-166.7	168.1	-172.5	0	110.7	L198 M199 E200 A205 V206	L198-K202 WeakPolarHBondContact O-CB 3.36Å; L198-K202 PolarHBondContact O-N 3.28Å; M199-K202 PolarHBondContact O-N 2.88Å; M199-K202 HydrophobicContact SD-CD 4.44Å; E200-K202 VanDerWaalsContact C-N 3.26Å; E200-K202 PolarHBondContact O-N 2.83Å; K202-A205 PolarHBondContact O-N 2.95Å; K202-V206 VanDerWaalsContact O-CG2 3.29Å; K202-V206 WeakPolarHBondContact O-CG2 3.42Å; K202-V206 PolarHBondContact O-N 2.87Å
203	N	89.7	Confident	86.8	Confident	90 Å²	90	91.3 Å²	91.3	48%	0.481	47%	0.47	S	S	.	.	H	α-helix	trans	-65.1	-42.7	-178.3	-67.5	-21.7	0	0	0	111	M199 E200 V206 T207	M199-N203 VanDerWaalsContact O-CG 3.29Å; M199-N203 PolarHBondContact O-N 2.97Å; M199-N203 VanDerWaalsContact O-N 3.13Å; M199-N203 PolarHBondContact O-ND2 2.75Å; E200-N203 WeakPolarHBondContact O-CB 3.49Å; E200-N203 PolarHBondContact O-N 2.84Å; N203-V206 PolarHBondContact O-N 2.75Å; N203-T207 PolarHBondContact O-N 3.03Å; N203-T207 PolarHBondContact O-OG1 2.83Å
204	E	88.9	Confident	87	Confident	118 Å²	118	90.7 Å²	90.7	55%	0.551	47%	0.467	S	S	*	.	H	α-helix	trans	-57.3	-51.5	174	-69.5	170.9	175.9	0	0	111.5	E200 V206 T207 D208	E200-E204 PolarHBondContact O-N 2.79Å; E204-V206 VanDerWaalsContact C-N 3.27Å; E204-V206 PolarHBondContact O-N 2.8Å; E204-T207 PolarHBondContact O-N 3.4Å; E204-D208 PolarHBondContact O-N 3.09Å
205	A	82.6	Confident	87.1	Confident	34 Å²	34	93.1 Å²	93.1	28%	0.281	48%	0.477	S	S	.	.	H	α-helix	trans	-59.8	-36.4	178.6	0	0	0	0	0	112.7	R201 K202 I209	R201-A205 WeakPolarHBondContact O-CB 3.43Å; R201-A205 PolarHBondContact O-N 3.28Å; K202-A205 PolarHBondContact O-N 2.95Å; A205-I209 WeakPolarHBondContact O-CD1 3.36Å; A205-I209 WeakPolarHBondContact O-CG1 3.44Å; A205-I209 PolarHBondContact O-N 2.96Å
206	V	88.3	Confident	87.2	Confident	78 Å²	78	93.7 Å²	93.7	47%	0.473	47%	0.474	S	S	.	.	H	α-helix	trans	-66	-43.4	175.3	169.7	0	0	0	0	111	K202 N203 E204 I209 S210	K202-V206 VanDerWaalsContact O-CG2 3.29Å; K202-V206 WeakPolarHBondContact O-CG2 3.42Å; K202-V206 PolarHBondContact O-N 2.87Å; N203-V206 PolarHBondContact O-N 2.75Å; E204-V206 VanDerWaalsContact C-N 3.27Å; E204-V206 PolarHBondContact O-N 2.8Å; V206-I209 PolarHBondContact O-N 3.33Å; V206-S210 PolarHBondContact O-N 3.47Å; V206-S210 PolarHBondContact O-OG 3.36Å
207	T	91.4	Very high	87.2	Confident	77 Å²	77	93.9 Å²	93.9	47%	0.472	48%	0.477	S	S	.	.	H	α-helix	trans	-63.6	-42.1	176.8	-60.6	0	0	0	0	111.9	N203 E204 S210 N211	N203-T207 PolarHBondContact O-N 3.03Å; N203-T207 PolarHBondContact O-OG1 2.83Å; E204-T207 PolarHBondContact O-N 3.4Å; T207-S210 PolarHBondContact O-N 3.26Å; T207-N211 VanDerWaalsContact O-CG 3.29Å; T207-N211 PolarHBondContact O-N 2.92Å; T207-N211 PolarHBondContact O-ND2 2.81Å
208	D	86.4	Confident	87.5	Confident	98 Å²	98	95.9 Å²	95.9	52%	0.524	48%	0.484	S	S	.	.	H	α-helix	trans	-65	-40.8	177.9	-70.2	-17.3	0	0	0	112.2	E204 N211 T212	E204-D208 PolarHBondContact O-N 3.09Å; D208-N211 PolarHBondContact O-N 3.5Å; D208-T212 WeakPolarHBondContact O-CB 3.22Å; D208-T212 VanDerWaalsContact O-CG2 3.29Å; D208-T212 WeakPolarHBondContact O-CG2 3.32Å; D208-T212 PolarHBondContact O-N 2.89Å; D208-T212 PolarHBondContact O-OG1 3.36Å
209	I	85.3	Confident	87.6	Confident	77 Å²	77	92.6 Å²	92.6	40%	0.395	47%	0.474	S	S	.	.	H	α-helix	trans	-60	-48.7	172.7	-69.2	164.5	0	0	0	109.7	A205 V206 N211 T212 F213 L323	A205-I209 WeakPolarHBondContact O-CD1 3.36Å; A205-I209 WeakPolarHBondContact O-CG1 3.44Å; A205-I209 PolarHBondContact O-N 2.96Å; V206-I209 PolarHBondContact O-N 3.33Å; I209-N211 PolarHBondContact O-N 3.21Å; I209-T212 PolarHBondContact O-N 2.73Å; I209-T212 PolarHBondContact O-OG1 3.48Å; I209-F213 HydrophobicContact CG2-CD2 3.92Å; I209-F213 HydrophobicContact CG2-CE2 3.97Å; I209-F213 VanDerWaalsContact O-CD2 3.23Å; I209-F213 WeakPolarHBondContact O-CD2 3.44Å; I209-F213 PolarHBondContact O-N 3.26Å; I209-F213 VanDerWaalsContact O-N 3.16Å; I209-L323 HydrophobicContact CD1-CD2 4.45Å
210	S	89.4	Confident	87.6	Confident	62 Å²	62	91.9 Å²	91.9	43%	0.434	47%	0.472	S	S	.	.	H	α-helix	trans	-58.9	-47.8	178.6	-68.2	0	0	0	0	112.5	V206 T207 T212 F213 D214	V206-S210 PolarHBondContact O-N 3.47Å; V206-S210 PolarHBondContact O-OG 3.36Å; T207-S210 PolarHBondContact O-N 3.26Å; S210-T212 PolarHBondContact O-N 3.39Å; S210-F213 PolarHBondContact O-N 3.49Å; S210-D214 VanDerWaalsContact O-CG 3.29Å; S210-D214 PolarHBondContact O-N 2.99Å
211	N	90.6	Very high	87.7	Confident	83 Å²	83	93 Å²	93	44%	0.444	48%	0.477	S	S	.	.	H	α-helix	trans	-63	-43.6	-178.7	-69.3	-22.2	0	0	0	112.7	T207 D208 I209 F213 D214 E215	T207-N211 VanDerWaalsContact O-CG 3.29Å; T207-N211 PolarHBondContact O-N 2.92Å; T207-N211 PolarHBondContact O-ND2 2.81Å; D208-N211 PolarHBondContact O-N 3.5Å; I209-N211 PolarHBondContact O-N 3.21Å; N211-F213 PolarHBondContact O-N 3.3Å; N211-D214 PolarHBondContact O-N 2.98Å; N211-E215 WeakPolarHBondContact O-CG 3.36Å; N211-E215 PolarHBondContact O-N 2.94Å
212	T	85.3	Confident	88	Confident	69 Å²	69	92.5 Å²	92.5	42%	0.423	48%	0.481	S	S	.	.	H	α-helix	trans	-64.6	-39.6	-179.8	49.6	0	0	0	0	112.3	D208 I209 S210 E215 L216	D208-T212 WeakPolarHBondContact O-CB 3.22Å; D208-T212 VanDerWaalsContact O-CG2 3.29Å; D208-T212 WeakPolarHBondContact O-CG2 3.32Å; D208-T212 PolarHBondContact O-N 2.89Å; D208-T212 PolarHBondContact O-OG1 3.36Å; I209-T212 PolarHBondContact O-N 2.73Å; I209-T212 PolarHBondContact O-OG1 3.48Å; S210-T212 PolarHBondContact O-N 3.39Å; T212-E215 PolarHBondContact O-N 3.43Å; T212-L216 WeakPolarHBondContact O-CG 3.37Å; T212-L216 PolarHBondContact O-N 2.96Å; T212-L216 VanDerWaalsContact O-N 3.15Å
213	F	86.9	Confident	88.1	Confident	84 Å²	84	93.4 Å²	93.4	37%	0.368	48%	0.481	S	S	.	.	H	α-helix	trans	-70.3	-36.6	176.3	-83.1	-96.9	0	0	0	112.3	I209 S210 N211 E215 L216 E217 L320	I209-F213 HydrophobicContact CG2-CD2 3.92Å; I209-F213 HydrophobicContact CG2-CE2 3.97Å; I209-F213 VanDerWaalsContact O-CD2 3.23Å; I209-F213 WeakPolarHBondContact O-CD2 3.44Å; I209-F213 PolarHBondContact O-N 3.26Å; I209-F213 VanDerWaalsContact O-N 3.16Å; S210-F213 PolarHBondContact O-N 3.49Å; N211-F213 PolarHBondContact O-N 3.3Å; F213-E215 VanDerWaalsContact C-N 3.31Å; F213-E215 PolarHBondContact O-N 2.83Å; F213-L216 PolarHBondContact O-N 3.41Å; F213-E217 PolarHBondContact O-N 3.42Å; F213-L320 HydrophobicContact CE1-CB 4.42Å; F213-L320 HydrophobicContact CE1-CD1 4.44Å; F213-L320 HydrophobicContact CZ-CB 3.95Å
214	D	90.4	Very high	88.1	Confident	82 Å²	82	95.3 Å²	95.3	44%	0.439	49%	0.485	S	S	.	.	H	α-helix	trans	-62.6	-37.1	174.4	-73.5	-10.4	0	0	0	112.1	S210 N211 K218	S210-D214 VanDerWaalsContact O-CG 3.29Å; S210-D214 PolarHBondContact O-N 2.99Å; N211-D214 PolarHBondContact O-N 2.98Å; D214-K218 WeakPolarHBondContact O-CG 3.25Å; D214-K218 PolarHBondContact O-N 2.82Å; D214-K218 VanDerWaalsContact O-N 3.17Å
215	E	87.6	Confident	88.3	Confident	133 Å²	133	92.7 Å²	92.7	62%	0.621	48%	0.477	S	S	*	.	H	α-helix	trans	-67.3	-43.4	174.7	-74.1	-177.1	172.4	0	0	112.4	N211 T212 F213 E217 K218 A219	N211-E215 WeakPolarHBondContact O-CG 3.36Å; N211-E215 PolarHBondContact O-N 2.94Å; T212-E215 PolarHBondContact O-N 3.43Å; F213-E215 VanDerWaalsContact C-N 3.31Å; F213-E215 PolarHBondContact O-N 2.83Å; E215-E217 VanDerWaalsContact C-N 3.34Å; E215-E217 PolarHBondContact O-N 2.81Å; E215-K218 PolarHBondContact O-N 3Å; E215-A219 PolarHBondContact O-N 3.28Å
216	L	86.3	Confident	88.7	Confident	80 Å²	80	93.2 Å²	93.2	42%	0.419	48%	0.482	S	S	.	.	H	α-helix	trans	-63.5	-39.5	176.4	-70.5	173.3	0	0	0	111.9	T212 F213 A219 L220 L320	T212-L216 WeakPolarHBondContact O-CG 3.37Å; T212-L216 PolarHBondContact O-N 2.96Å; T212-L216 VanDerWaalsContact O-N 3.15Å; F213-L216 PolarHBondContact O-N 3.41Å; L216-A219 PolarHBondContact O-N 3.39Å; L216-L220 WeakPolarHBondContact O-CG 3.5Å; L216-L220 PolarHBondContact O-N 3.39Å; L216-L320 HydrophobicContact CD1-CD1 3.94Å; L216-L320 HydrophobicContact CD1-CD2 4.32Å
217	E	88.1	Confident	88.7	Confident	134 Å²	134	91.9 Å²	91.9	63%	0.626	47%	0.472	S	S	*	.	H	α-helix	trans	-61.6	-44	175.5	-172.3	176.7	177.6	0	0	111.4	F213 E215 A219 L220 H221	F213-E217 PolarHBondContact O-N 3.42Å; E215-E217 VanDerWaalsContact C-N 3.34Å; E215-E217 PolarHBondContact O-N 2.81Å; E217-A219 PolarHBondContact O-N 3.1Å; E217-L220 PolarHBondContact O-N 2.99Å; E217-H221 WeakPolarHBondContact O-CB 3.31Å; E217-H221 PolarHBondContact O-N 3.23Å
218	K	90.3	Very high	88.7	Confident	135 Å²	135	92.1 Å²	92.1	59%	0.587	47%	0.469	S	S	*	.	H	α-helix	trans	-60.2	-44.5	175.1	-73.2	169.5	-173.3	166	0	111.9	D214 E215 H221 Q222	D214-K218 WeakPolarHBondContact O-CG 3.25Å; D214-K218 PolarHBondContact O-N 2.82Å; D214-K218 VanDerWaalsContact O-N 3.17Å; E215-K218 PolarHBondContact O-N 3Å; K218-H221 PolarHBondContact O-N 3.49Å; K218-Q222 WeakPolarHBondContact O-CG 3.47Å; K218-Q222 PolarHBondContact O-N 3.13Å
219	A	85.4	Confident	89	Confident	51 Å²	51	90.7 Å²	90.7	42%	0.421	46%	0.464	S	S	.	.	H	α-helix	trans	-63.1	-42.8	178.7	0	0	0	0	0	112.2	E215 L216 E217 H221 Q222 R223	E215-A219 PolarHBondContact O-N 3.28Å; L216-A219 PolarHBondContact O-N 3.39Å; E217-A219 PolarHBondContact O-N 3.1Å; A219-H221 VanDerWaalsContact C-N 3.34Å; A219-H221 PolarHBondContact O-N 3Å; A219-Q222 PolarHBondContact O-N 3.49Å; A219-R223 PolarHBondContact O-N 3.32Å
220	L	87.1	Confident	89.2	Confident	89 Å²	89	91.7 Å²	91.7	47%	0.466	47%	0.467	S	S	.	.	H	α-helix	trans	-63.2	-40.8	174.8	-74	172.9	0	0	0	111.8	L216 E217 R223 K224 L313	L216-L220 WeakPolarHBondContact O-CG 3.5Å; L216-L220 PolarHBondContact O-N 3.39Å; E217-L220 PolarHBondContact O-N 2.99Å; L220-R223 PolarHBondContact O-N 2.84Å; L220-K224 PolarHBondContact O-N 3.12Å; L220-L313 HydrophobicContact CD2-CD2 3.82Å
221	H	90.7	Very high	89.3	Confident	113 Å²	113	91.7 Å²	91.7	52%	0.523	46%	0.464	S	S	.	.	H	α-helix	trans	-62.8	-42.6	176.4	-165.9	87.2	0	0	0	112	E217 K218 A219 K224 T225	E217-H221 WeakPolarHBondContact O-CB 3.31Å; E217-H221 PolarHBondContact O-N 3.23Å; K218-H221 PolarHBondContact O-N 3.49Å; A219-H221 VanDerWaalsContact C-N 3.34Å; A219-H221 PolarHBondContact O-N 3Å; H221-K224 WeakPolarHBondContact O-CB 3.48Å; H221-K224 PolarHBondContact O-N 2.92Å; H221-T225 PolarHBondContact O-N 3.07Å; H221-T225 PolarHBondContact O-OG1 2.91Å
222	Q	90.9	Very high	89.4	Confident	134 Å²	134	93.3 Å²	93.3	63%	0.626	47%	0.469	S	S	*	.	H	α-helix	trans	-62.6	-40.9	175.3	-72.4	173.2	-0.4	0	0	112.4	K218 A219 K224 T225 A226	K218-Q222 WeakPolarHBondContact O-CG 3.47Å; K218-Q222 PolarHBondContact O-N 3.13Å; A219-Q222 PolarHBondContact O-N 3.49Å; Q222-K224 VanDerWaalsContact C-N 3.35Å; Q222-T225 PolarHBondContact O-N 2.78Å; Q222-T225 PolarHBondContact O-OG1 3.18Å; Q222-A226 WeakPolarHBondContact O-CB 3.49Å; Q222-A226 PolarHBondContact O-N 3.29Å
223	R	88.9	Confident	89.6	Confident	141 Å²	141	94.6 Å²	94.6	53%	0.532	47%	0.473	S	S	.	.	H	α-helix	trans	-66.2	-39.1	176.6	-176	56.6	177.5	141.3	-2	111.8	A219 L220 A226 L227	A219-R223 PolarHBondContact O-N 3.32Å; L220-R223 PolarHBondContact O-N 2.84Å; R223-A226 PolarHBondContact O-N 2.94Å; R223-L227 HydrophobicContact CG-CD1 4.42Å; R223-L227 WeakPolarHBondContact O-CG 3.47Å; R223-L227 PolarHBondContact O-N 2.59Å; R223-L227 VanDerWaalsContact O-N 3.1Å
224	K	90.4	Very high	89.7	Confident	129 Å²	129	94 Å²	94	56%	0.561	47%	0.474	S	S	*	.	H	α-helix	trans	-58.8	-49.9	174.4	174.7	-174.9	173.2	-178.5	0	111.3	L220 H221 Q222 A226 L227 I228	L220-K224 PolarHBondContact O-N 3.12Å; H221-K224 WeakPolarHBondContact O-CB 3.48Å; H221-K224 PolarHBondContact O-N 2.92Å; Q222-K224 VanDerWaalsContact C-N 3.35Å; K224-A226 PolarHBondContact O-N 3.44Å; K224-L227 PolarHBondContact O-N 2.84Å; K224-I228 HydrophobicContact CG-CD1 4.12Å; K224-I228 WeakPolarHBondContact O-CG1 3.48Å; K224-I228 PolarHBondContact O-N 3.2Å
225	T	92.8	Very high	89.7	Confident	63 Å²	63	92.4 Å²	92.4	39%	0.387	47%	0.468	S	S	.	.	H	α-helix	trans	-64.1	-41	-179.6	53.1	0	0	0	0	111.6	H221 Q222 L227 I228 T229	H221-T225 PolarHBondContact O-N 3.07Å; H221-T225 PolarHBondContact O-OG1 2.91Å; Q222-T225 PolarHBondContact O-N 2.78Å; Q222-T225 PolarHBondContact O-OG1 3.18Å; T225-L227 PolarHBondContact O-N 3.4Å; T225-I228 PolarHBondContact O-N 3.44Å; T225-T229 PolarHBondContact O-N 2.93Å; T225-T229 PolarHBondContact O-OG1 3.34Å; T225-T229 VanDerWaalsContact O-OG1 3.11Å
226	A	90.2	Very high	89.9	Confident	45 Å²	45	88.4 Å²	88.4	37%	0.372	46%	0.455	S	S	.	.	H	α-helix	trans	-59	-44.1	176.6	0	0	0	0	0	113.2	Q222 R223 K224 I228 T229 E230	Q222-A226 WeakPolarHBondContact O-CB 3.49Å; Q222-A226 PolarHBondContact O-N 3.29Å; R223-A226 PolarHBondContact O-N 2.94Å; K224-A226 PolarHBondContact O-N 3.44Å; A226-I228 VanDerWaalsContact C-N 3.35Å; A226-I228 PolarHBondContact O-N 3.39Å; A226-T229 PolarHBondContact O-N 2.82Å; A226-E230 WeakPolarHBondContact O-CB 3.31Å; A226-E230 PolarHBondContact O-N 2.58Å
227	L	88.6	Confident	90.1	Very high	50 Å²	50	88.6 Å²	88.6	26%	0.262	46%	0.459	S	S	.	.	H	α-helix	trans	-64	-38.7	177.9	-76.1	171.1	0	0	0	112.5	R223 K224 T225 E230 V231	R223-L227 HydrophobicContact CG-CD1 4.42Å; R223-L227 WeakPolarHBondContact O-CG 3.47Å; R223-L227 PolarHBondContact O-N 2.59Å; R223-L227 VanDerWaalsContact O-N 3.1Å; K224-L227 PolarHBondContact O-N 2.84Å; T225-L227 PolarHBondContact O-N 3.4Å; L227-E230 PolarHBondContact O-N 2.99Å; L227-V231 WeakPolarHBondContact O-CG2 3.42Å; L227-V231 PolarHBondContact O-N 2.79Å; L227-V231 VanDerWaalsContact O-N 3.09Å
228	I	91.4	Very high	90.1	Very high	82 Å²	82	84 Å²	84	42%	0.421	44%	0.437	S	S	.	.	H	α-helix	trans	-63.7	-47.9	176.6	-67.4	168	0	0	0	109.9	K224 T225 A226 E230 V231 E232	K224-I228 HydrophobicContact CG-CD1 4.12Å; K224-I228 WeakPolarHBondContact O-CG1 3.48Å; K224-I228 PolarHBondContact O-N 3.2Å; T225-I228 PolarHBondContact O-N 3.44Å; A226-I228 VanDerWaalsContact C-N 3.35Å; A226-I228 PolarHBondContact O-N 3.39Å; I228-E230 VanDerWaalsContact C-N 3.28Å; I228-E230 PolarHBondContact O-N 3Å; I228-V231 PolarHBondContact O-N 2.97Å; I228-E232 WeakPolarHBondContact O-CG 3.4Å; I228-E232 PolarHBondContact O-N 3.14Å
229	T	92.6	Very high	90.2	Very high	68 Å²	68	83.4 Å²	83.4	42%	0.417	44%	0.437	S	S	.	.	H	α-helix	trans	-61.9	-36	177.8	-54.5	0	0	0	0	112.2	T225 A226 E232 N233	T225-T229 PolarHBondContact O-N 2.93Å; T225-T229 PolarHBondContact O-OG1 3.34Å; T225-T229 VanDerWaalsContact O-OG1 3.11Å; A226-T229 PolarHBondContact O-N 2.82Å; T229-E232 PolarHBondContact O-N 2.87Å; T229-N233 WeakPolarHBondContact O-CB 3.47Å; T229-N233 PolarHBondContact O-N 3.03Å; T229-N233 PolarHBondContact O-ND2 3.08Å
230	E	90	Very high	90.5	Very high	99 Å²	99	87.3 Å²	87.3	46%	0.463	44%	0.444	S	S	.	.	H	α-helix	trans	-64.2	-44.7	175.9	-171.3	171.8	-173.2	0	0	112.1	A226 L227 I228 N233 I234	A226-E230 WeakPolarHBondContact O-CB 3.31Å; A226-E230 PolarHBondContact O-N 2.58Å; L227-E230 PolarHBondContact O-N 2.99Å; I228-E230 VanDerWaalsContact C-N 3.28Å; I228-E230 PolarHBondContact O-N 3Å; E230-N233 PolarHBondContact O-N 3.14Å; E230-I234 HydrophobicContact CG-CD1 4.26Å; E230-I234 WeakPolarHBondContact O-CG1 3.43Å; E230-I234 PolarHBondContact O-N 2.66Å
231	V	90.8	Very high	90.7	Very high	61 Å²	61	85.6 Å²	85.6	37%	0.37	44%	0.437	S	S	.	.	H	α-helix	trans	-61.8	-45	175	172.2	0	0	0	0	111.1	L227 I228 N233 I234 C235	L227-V231 WeakPolarHBondContact O-CG2 3.42Å; L227-V231 PolarHBondContact O-N 2.79Å; L227-V231 VanDerWaalsContact O-N 3.09Å; I228-V231 PolarHBondContact O-N 2.97Å; V231-N233 VanDerWaalsContact C-N 3.3Å; V231-N233 PolarHBondContact O-N 3.43Å; V231-I234 PolarHBondContact O-N 2.98Å; V231-C235 WeakPolarHBondContact O-CB 3.44Å; V231-C235 PolarHBondContact O-N 2.83Å; V231-C235 PolarHBondContact O-SG 2.85Å
232	E	92	Very high	90.6	Very high	117 Å²	117	83.5 Å²	83.5	55%	0.547	43%	0.43	S	S	.	.	H	α-helix	trans	-59	-41.1	176.5	-72.3	174.4	166.2	0	0	112	I228 T229 C235 S236	I228-E232 WeakPolarHBondContact O-CG 3.4Å; I228-E232 PolarHBondContact O-N 3.14Å; T229-E232 PolarHBondContact O-N 2.87Å; E232-C235 PolarHBondContact O-N 2.78Å; E232-S236 WeakPolarHBondContact O-CB 3.28Å; E232-S236 PolarHBondContact O-N 3.44Å
233	N	91.1	Very high	90.7	Very high	96 Å²	96	82.7 Å²	82.7	51%	0.513	43%	0.426	S	S	.	.	H	α-helix	trans	-66.3	-43	177.6	-74.1	-26.6	0	0	0	112.7	T229 E230 V231 S236 T237	T229-N233 WeakPolarHBondContact O-CB 3.47Å; T229-N233 PolarHBondContact O-N 3.03Å; T229-N233 PolarHBondContact O-ND2 3.08Å; E230-N233 PolarHBondContact O-N 3.14Å; V231-N233 VanDerWaalsContact C-N 3.3Å; V231-N233 PolarHBondContact O-N 3.43Å; N233-S236 PolarHBondContact O-N 2.69Å; N233-T237 WeakPolarHBondContact O-CB 3.32Å; N233-T237 PolarHBondContact O-N 3.43Å; N233-T237 PolarHBondContact O-OG1 2.95Å
234	I	88.2	Confident	90.8	Very high	73 Å²	73	80.8 Å²	80.8	37%	0.374	43%	0.43	S	S	.	.	H	α-helix	trans	-62.8	-46.9	176.3	-67.2	166.7	0	0	0	109.9	E230 V231 S236 T237 K238 L304	E230-I234 HydrophobicContact CG-CD1 4.26Å; E230-I234 WeakPolarHBondContact O-CG1 3.43Å; E230-I234 PolarHBondContact O-N 2.66Å; V231-I234 PolarHBondContact O-N 2.98Å; I234-S236 PolarHBondContact O-N 2.88Å; I234-T237 PolarHBondContact O-N 2.86Å; I234-K238 HydrophobicContact CG2-CD 4.29Å; I234-K238 WeakPolarHBondContact O-CG 3.09Å; I234-K238 PolarHBondContact O-N 3.04Å; I234-L304 HydrophobicContact CG2-CD2 3.94Å
235	C	90.1	Very high	90.9	Very high	47 Å²	47	75.3 Å²	75.3	32%	0.318	41%	0.406	S	S	.	.	H	α-helix	trans	-58.8	-47.3	176.2	-72.8	0	0	0	0	111.9	V231 E232 T237 K238 Q239 L304	V231-C235 WeakPolarHBondContact O-CB 3.44Å; V231-C235 PolarHBondContact O-N 2.83Å; V231-C235 PolarHBondContact O-SG 2.85Å; E232-C235 PolarHBondContact O-N 2.78Å; C235-T237 VanDerWaalsContact C-N 3.29Å; C235-T237 PolarHBondContact O-N 3.19Å; C235-K238 PolarHBondContact O-N 2.62Å; C235-Q239 VanDerWaalsContact O-CB 3.25Å; C235-Q239 WeakPolarHBondContact O-CB 3.47Å; C235-Q239 PolarHBondContact O-N 3.11Å; C235-L304 WeakPolarHBondContact SG-CD1 3.44Å
236	S	92.9	Very high	90.9	Very high	49 Å²	49	77 Å²	77	34%	0.343	41%	0.413	S	S	.	.	H	α-helix	trans	-59.3	-41.1	178.1	-173.3	0	0	0	0	111.8	E232 N233 I234 K240	E232-S236 WeakPolarHBondContact O-CB 3.28Å; E232-S236 PolarHBondContact O-N 3.44Å; N233-S236 PolarHBondContact O-N 2.69Å; I234-S236 PolarHBondContact O-N 2.88Å; S236-K240 VanDerWaalsContact O-CG 3.25Å; S236-K240 WeakPolarHBondContact O-CG 3.43Å; S236-K240 PolarHBondContact O-N 3.34Å
237	T	89.1	Confident	91	Very high	85 Å²	85	78.9 Å²	78.9	52%	0.521	42%	0.419	S	S	.	.	H	α-helix	trans	-68.6	-49.3	-179.5	-55.3	0	0	0	0	111.4	N233 I234 C235 Q239 K240 V241	N233-T237 WeakPolarHBondContact O-CB 3.32Å; N233-T237 PolarHBondContact O-N 3.43Å; N233-T237 PolarHBondContact O-OG1 2.95Å; I234-T237 PolarHBondContact O-N 2.86Å; C235-T237 VanDerWaalsContact C-N 3.29Å; C235-T237 PolarHBondContact O-N 3.19Å; T237-Q239 VanDerWaalsContact C-N 3.3Å; T237-Q239 PolarHBondContact O-N 2.76Å; T237-K240 PolarHBondContact O-N 2.92Å; T237-V241 PolarHBondContact O-N 2.86Å
238	K	88.8	Confident	91.1	Very high	37 Å²	37	79.2 Å²	79.2	16%	0.161	43%	0.426	C	S	.	.	H	α-helix	trans	-58.4	-43	175.7	-73.5	-173.2	164	-157.6	0	111.6	I234 C235 K240 V241 L242 E300 N301 H303	I234-K238 HydrophobicContact CG2-CD 4.29Å; I234-K238 WeakPolarHBondContact O-CG 3.09Å; I234-K238 PolarHBondContact O-N 3.04Å; C235-K238 PolarHBondContact O-N 2.62Å; K238-K240 PolarHBondContact O-N 3.13Å; K238-V241 PolarHBondContact O-N 3.11Å; K238-L242 WeakPolarHBondContact O-CG 3.25Å; K238-L242 PolarHBondContact O-N 2.93Å; K238-L242 VanDerWaalsContact O-N 3.1Å; K238-E300 HydrophobicContact CG-CG 4.5Å; K238-N301 PolarHBondContact NZ-O 2.9Å; K238-N301 PolarHBondContact NZ-OD1 2.85Å; K238-H303 PolarHBondContact NZ-O 2.82Å
239	Q	91.3	Very high	91.1	Very high	122 Å²	122	77.9 Å²	77.9	57%	0.57	42%	0.419	S	S	*	.	H	α-helix	trans	-63.9	-40.4	178.2	-171.4	166.9	21.6	0	0	112.3	C235 T237 V241 L242 Q243	C235-Q239 VanDerWaalsContact O-CB 3.25Å; C235-Q239 WeakPolarHBondContact O-CB 3.47Å; C235-Q239 PolarHBondContact O-N 3.11Å; T237-Q239 VanDerWaalsContact C-N 3.3Å; T237-Q239 PolarHBondContact O-N 2.76Å; Q239-V241 VanDerWaalsContact C-N 3.34Å; Q239-V241 PolarHBondContact O-N 2.82Å; Q239-L242 PolarHBondContact O-N 2.82Å; Q239-Q243 WeakPolarHBondContact O-CB 3.35Å; Q239-Q243 PolarHBondContact O-N 3.43Å
240	K	92.1	Very high	91.1	Very high	133 Å²	133	79.3 Å²	79.3	58%	0.578	42%	0.424	S	S	*	.	H	α-helix	trans	-60.6	-41.4	175.3	-76.3	169.5	-173.9	173.7	0	112.5	S236 T237 K238 Q243 T244	S236-K240 VanDerWaalsContact O-CG 3.25Å; S236-K240 WeakPolarHBondContact O-CG 3.43Å; S236-K240 PolarHBondContact O-N 3.34Å; T237-K240 PolarHBondContact O-N 2.92Å; K238-K240 PolarHBondContact O-N 3.13Å; K240-Q243 PolarHBondContact O-N 2.7Å; K240-T244 WeakPolarHBondContact O-CB 3.42Å; K240-T244 PolarHBondContact O-N 3.37Å; K240-T244 PolarHBondContact O-OG1 3.24Å
241	V	91	Very high	91.2	Very high	54 Å²	54	80.3 Å²	80.3	33%	0.327	43%	0.428	S	S	.	.	H	α-helix	trans	-63.2	-49.9	177.4	175.7	0	0	0	0	110.6	T237 K238 Q239 Q243 T244 Q245 H299 E300	T237-V241 PolarHBondContact O-N 2.86Å; K238-V241 PolarHBondContact O-N 3.11Å; Q239-V241 VanDerWaalsContact C-N 3.34Å; Q239-V241 PolarHBondContact O-N 2.82Å; V241-Q243 VanDerWaalsContact C-N 3.32Å; V241-Q243 PolarHBondContact O-N 2.81Å; V241-T244 PolarHBondContact O-N 2.84Å; V241-Q245 PolarHBondContact O-N 2.87Å; V241-H299 HydrophobicContact CG1-CB 4Å; V241-E300 HydrophobicContact CB-CG 4.04Å; V241-E300 HydrophobicContact CG1-CG 3.83Å; V241-E300 HydrophobicContact CG2-CG 4.49Å
242	L	90.1	Very high	91.1	Very high	69 Å²	69	77.6 Å²	77.6	36%	0.361	41%	0.413	S	S	.	.	H	α-helix	trans	-62.6	-39	178.3	-67.8	174.7	0	0	0	112.1	K238 Q239 Q245 L246 P298 E300	K238-L242 WeakPolarHBondContact O-CG 3.25Å; K238-L242 PolarHBondContact O-N 2.93Å; K238-L242 VanDerWaalsContact O-N 3.1Å; Q239-L242 PolarHBondContact O-N 2.82Å; L242-Q245 PolarHBondContact O-N 2.87Å; L242-L246 WeakPolarHBondContact O-CB 3.45Å; L242-L246 PolarHBondContact O-N 2.99Å; L242-P298 HydrophobicContact CD2-CB 4.42Å; L242-E300 HydrophobicContact CD2-CB 3.97Å; L242-E300 HydrophobicContact CG-CB 4.08Å
243	Q	92.7	Very high	91.1	Very high	116 Å²	116	77.7 Å²	77.7	54%	0.542	41%	0.412	S	S	.	.	H	α-helix	trans	-68.7	-39.2	179.5	-166.8	144.2	9.9	0	0	111.9	Q239 K240 V241 L246 T247	Q239-Q243 WeakPolarHBondContact O-CB 3.35Å; Q239-Q243 PolarHBondContact O-N 3.43Å; K240-Q243 PolarHBondContact O-N 2.7Å; V241-Q243 VanDerWaalsContact C-N 3.32Å; V241-Q243 PolarHBondContact O-N 2.81Å; Q243-L246 PolarHBondContact O-N 2.99Å; Q243-T247 PolarHBondContact O-N 3.39Å; Q243-T247 PolarHBondContact O-OG1 2.82Å; Q243-T247 VanDerWaalsContact O-OG1 3.05Å
244	T	91.4	Very high	91.2	Very high	101 Å²	101	79.5 Å²	79.5	62%	0.62	42%	0.417	S	S	*	.	H	α-helix	trans	-62.9	-44.2	173.8	-54.1	0	0	0	0	111.1	K240 V241 T247 S248	K240-T244 WeakPolarHBondContact O-CB 3.42Å; K240-T244 PolarHBondContact O-N 3.37Å; K240-T244 PolarHBondContact O-OG1 3.24Å; V241-T244 PolarHBondContact O-N 2.84Å; T244-T247 PolarHBondContact O-N 3.09Å; T244-S248 PolarHBondContact O-N 3.29Å; T244-S248 VanDerWaalsContact O-N 3.09Å
245	Q	91.1	Very high	91.2	Very high	15 Å²	15	78.8 Å²	78.8	7%	0.07	41%	0.414	C	S	.	.	H	α-helix	trans	-61.6	-44.5	175.4	-175.9	177.6	11.2	0	0	111.5	V241 L242 T247 S248 L249 P295 H297	V241-Q245 PolarHBondContact O-N 2.87Å; L242-Q245 PolarHBondContact O-N 2.87Å; Q245-T247 PolarHBondContact O-N 2.94Å; Q245-S248 PolarHBondContact O-N 3.47Å; Q245-L249 HydrophobicContact CG-CD1 4.13Å; Q245-L249 WeakPolarHBondContact O-CG 3.35Å; Q245-L249 PolarHBondContact O-N 3.3Å; Q245-P295 HydrophobicContact CG-CB 4.48Å; Q245-P295 HydrophobicContact CG-CG 4.26Å; Q245-P295 PolarHBondContact NE2-O 3.32Å; Q245-H297 PolarHBondContact NE2-O 3.04Å
246	L	93	Very high	91.2	Very high	99 Å²	99	79.3 Å²	79.3	52%	0.518	41%	0.413	S	S	.	.	H	α-helix	trans	-60.6	-45	178.3	-179	62.9	0	0	0	111.7	L242 Q243 S248 L249 L250	L242-L246 WeakPolarHBondContact O-CB 3.45Å; L242-L246 PolarHBondContact O-N 2.99Å; Q243-L246 PolarHBondContact O-N 2.99Å; L246-S248 VanDerWaalsContact C-N 3.33Å; L246-S248 PolarHBondContact O-N 3.27Å; L246-L249 PolarHBondContact O-N 3.18Å; L246-L250 HydrophobicContact CD1-CD1 4.24Å; L246-L250 HydrophobicContact CD1-CG 4.27Å; L246-L250 HydrophobicContact CG-CD1 4.03Å; L246-L250 HydrophobicContact CG-CG 4.47Å; L246-L250 WeakPolarHBondContact O-CB 3.28Å; L246-L250 WeakPolarHBondContact O-CG 3.44Å; L246-L250 PolarHBondContact O-N 3.36Å
247	T	93.5	Very high	91.2	Very high	83 Å²	83	82.1 Å²	82.1	51%	0.509	42%	0.421	S	S	.	.	H	α-helix	trans	-60.9	-42.6	176.6	-56.7	0	0	0	0	111.6	Q243 T244 Q245 L250 Q251	Q243-T247 PolarHBondContact O-N 3.39Å; Q243-T247 PolarHBondContact O-OG1 2.82Å; Q243-T247 VanDerWaalsContact O-OG1 3.05Å; T244-T247 PolarHBondContact O-N 3.09Å; Q245-T247 PolarHBondContact O-N 2.94Å; T247-L250 PolarHBondContact O-N 2.97Å; T247-Q251 WeakPolarHBondContact O-CB 3.39Å; T247-Q251 PolarHBondContact O-N 3.44Å
248	S	90.5	Very high	91.4	Very high	57 Å²	57	81 Å²	81	40%	0.399	42%	0.417	S	S	.	.	H	α-helix	trans	-64.1	-42.1	177.5	-178.9	0	0	0	0	112.5	T244 Q245 L246 G252	T244-S248 PolarHBondContact O-N 3.29Å; T244-S248 VanDerWaalsContact O-N 3.09Å; Q245-S248 PolarHBondContact O-N 3.47Å; L246-S248 VanDerWaalsContact C-N 3.33Å; L246-S248 PolarHBondContact O-N 3.27Å; S248-G252 PolarHBondContact O-N 3Å
249	L	91	Very high	91.4	Very high	54 Å²	54	80.1 Å²	80.1	28%	0.283	42%	0.415	S	S	.	.	H	α-helix	trans	-66.6	-42.4	176.8	-73.1	173.2	0	0	0	112.3	Q245 L246 G252 K253 F294 P295	Q245-L249 HydrophobicContact CG-CD1 4.13Å; Q245-L249 WeakPolarHBondContact O-CG 3.35Å; Q245-L249 PolarHBondContact O-N 3.3Å; L246-L249 PolarHBondContact O-N 3.18Å; L249-G252 PolarHBondContact O-N 3.11Å; L249-K253 WeakPolarHBondContact O-CB 3.33Å; L249-K253 PolarHBondContact O-N 2.96Å; L249-F294 HydrophobicContact CD2-CB 4Å; L249-P295 HydrophobicContact CD2-CG 4.22Å; L249-P295 HydrophobicContact CG-CG 4.47Å
250	L	93.1	Very high	91.3	Very high	98 Å²	98	76.8 Å²	76.8	51%	0.513	41%	0.405	S	S	.	.	H	α-helix	trans	-62.3	-45.3	176.6	-74.7	172.1	0	0	0	111.5	L246 T247 G252 K253 E254	L246-L250 HydrophobicContact CD1-CD1 4.24Å; L246-L250 HydrophobicContact CD1-CG 4.27Å; L246-L250 HydrophobicContact CG-CD1 4.03Å; L246-L250 HydrophobicContact CG-CG 4.47Å; L246-L250 WeakPolarHBondContact O-CB 3.28Å; L246-L250 WeakPolarHBondContact O-CG 3.44Å; L246-L250 PolarHBondContact O-N 3.36Å; T247-L250 PolarHBondContact O-N 2.97Å; L250-G252 VanDerWaalsContact C-N 3.34Å; L250-G252 PolarHBondContact O-N 3.3Å; L250-K253 PolarHBondContact O-N 3.04Å; L250-E254 PolarHBondContact O-N 3.35Å
251	Q	91.4	Very high	91.3	Very high	120 Å²	120	74 Å²	74	56%	0.561	40%	0.402	S	S	*	.	H	α-helix	trans	-63.8	-40.8	176	-171.8	-179.5	12.9	0	0	111.7	T247 N255	T247-Q251 WeakPolarHBondContact O-CB 3.39Å; T247-Q251 PolarHBondContact O-N 3.44Å; Q251-N255 WeakPolarHBondContact O-CB 3.36Å; Q251-N255 PolarHBondContact O-N 2.59Å; Q251-N255 PolarHBondContact O-ND2 2.86Å; Q251-N255 VanDerWaalsContact O-ND2 3.11Å
252	G	89.8	Confident	91.2	Very high	5 Å²	5	77.3 Å²	77.3	5%	0.052	41%	0.412	C	S	.	.	H	α-helix	trans	-59.3	-46.4	174.2	0	0	0	0	0	112.6	S248 L249 L250 N255 I256 F294	S248-G252 PolarHBondContact O-N 3Å; L249-G252 PolarHBondContact O-N 3.11Å; L250-G252 VanDerWaalsContact C-N 3.34Å; L250-G252 PolarHBondContact O-N 3.3Å; G252-N255 PolarHBondContact O-N 3.36Å; G252-I256 WeakPolarHBondContact O-CG1 3.28Å; G252-I256 PolarHBondContact O-N 3.32Å; G252-F294 VanDerWaalsContact CA-CE1 3.42Å
253	K	91.3	Very high	91.1	Very high	118 Å²	118	75.3 Å²	75.3	51%	0.513	40%	0.403	S	S	.	.	H	α-helix	trans	-59.9	-51.2	176.8	-178.3	-173.8	166.8	-174.5	0	111.6	L249 L250 N255 I256 E257	L249-K253 WeakPolarHBondContact O-CB 3.33Å; L249-K253 PolarHBondContact O-N 2.96Å; L250-K253 PolarHBondContact O-N 3.04Å; K253-N255 VanDerWaalsContact C-N 3.3Å; K253-N255 PolarHBondContact O-N 2.82Å; K253-I256 PolarHBondContact O-N 3.39Å; K253-I256 VanDerWaalsContact O-N 3.14Å; K253-E257 VanDerWaalsContact CE-CD 3.43Å; K253-E257 WeakPolarHBondContact CE-OE1 3.36Å; K253-E257 HydrophobicContact CG-CG 4.4Å; K253-E257 IonicContact NZ-OE1 3.6Å; K253-E257 WeakPolarHBondContact O-CG 3.45Å; K253-E257 PolarHBondContact O-N 3.39Å
254	E	92.6	Very high	90.8	Very high	135 Å²	135	76.1 Å²	76.1	63%	0.631	41%	0.407	S	S	*	.	H	α-helix	trans	-61.2	-39.1	-179.8	-172.5	178.6	-173.9	0	0	111.9	L250 I256 E257 S258	L250-E254 PolarHBondContact O-N 3.35Å; E254-I256 PolarHBondContact O-N 3.42Å; E254-E257 PolarHBondContact O-N 2.98Å; E254-S258 WeakPolarHBondContact O-CB 3.41Å; E254-S258 PolarHBondContact O-N 2.75Å; E254-S258 PolarHBondContact O-OG 2.73Å
255	N	89.4	Confident	90.6	Very high	57 Å²	57	76.7 Å²	76.7	31%	0.305	40%	0.402	S	S	.	.	H	α-helix	trans	-63.9	-38.5	175.5	-75.3	-29	0	0	0	112.7	Q251 G252 K253 S258 S259	Q251-N255 WeakPolarHBondContact O-CB 3.36Å; Q251-N255 PolarHBondContact O-N 2.59Å; Q251-N255 PolarHBondContact O-ND2 2.86Å; Q251-N255 VanDerWaalsContact O-ND2 3.11Å; G252-N255 PolarHBondContact O-N 3.36Å; K253-N255 VanDerWaalsContact C-N 3.3Å; K253-N255 PolarHBondContact O-N 2.82Å; N255-S258 PolarHBondContact O-OG 3.27Å; N255-S259 VanDerWaalsContact O-CB 3.26Å; N255-S259 WeakPolarHBondContact O-CB 3.48Å; N255-S259 PolarHBondContact O-N 3.39Å; N255-S259 PolarHBondContact O-OG 2.71Å
256	I	90	Very high	90.4	Very high	59 Å²	59	77.2 Å²	77.2	30%	0.303	41%	0.409	S	S	.	.	H	α-helix	trans	-69.6	-50.2	175.5	-69.4	164.3	0	0	0	110	G252 K253 E254 S258 S259 C260 L289 F294	G252-I256 WeakPolarHBondContact O-CG1 3.28Å; G252-I256 PolarHBondContact O-N 3.32Å; K253-I256 PolarHBondContact O-N 3.39Å; K253-I256 VanDerWaalsContact O-N 3.14Å; E254-I256 PolarHBondContact O-N 3.42Å; I256-S258 PolarHBondContact O-N 2.97Å; I256-S259 PolarHBondContact O-N 3.23Å; I256-C260 WeakPolarHBondContact O-CB 3.39Å; I256-C260 PolarHBondContact O-N 3.34Å; I256-C260 PolarHBondContact O-SG 2.9Å; I256-L289 HydrophobicContact CG1-CB 4.46Å; I256-L289 HydrophobicContact CG1-CD2 4.4Å; I256-F294 HydrophobicContact CD1-CD2 4.49Å; I256-F294 HydrophobicContact CD1-CE2 3.59Å; I256-F294 HydrophobicContact CD1-CZ 3.78Å; I256-F294 HydrophobicContact CG1-CZ 4.46Å
257	E	92.6	Very high	90	Very high	107 Å²	107	78 Å²	78	50%	0.5	41%	0.413	S	S	.	.	H	α-helix	trans	-58.2	-46.7	-178.6	-75.3	178.6	158.1	0	0	111.9	K253 E254 S261	K253-E257 VanDerWaalsContact CE-CD 3.43Å; K253-E257 WeakPolarHBondContact CE-OE1 3.36Å; K253-E257 HydrophobicContact CG-CG 4.4Å; K253-E257 IonicContact NZ-OE1 3.6Å; K253-E257 WeakPolarHBondContact O-CG 3.45Å; K253-E257 PolarHBondContact O-N 3.39Å; E254-E257 PolarHBondContact O-N 2.98Å; E257-S261 VanDerWaalsContact O-CB 3.26Å; E257-S261 WeakPolarHBondContact O-CB 3.34Å; E257-S261 PolarHBondContact O-N 2.86Å
258	S	92.5	Very high	89.6	Confident	62 Å²	62	77.7 Å²	77.7	43%	0.434	41%	0.414	S	S	.	.	H	α-helix	trans	-64.4	-42.8	177.2	55.3	0	0	0	0	112.9	E254 N255 I256 F262	E254-S258 WeakPolarHBondContact O-CB 3.41Å; E254-S258 PolarHBondContact O-N 2.75Å; E254-S258 PolarHBondContact O-OG 2.73Å; N255-S258 PolarHBondContact O-OG 3.27Å; I256-S258 PolarHBondContact O-N 2.97Å; S258-F262 WeakPolarHBondContact O-CB 3.37Å; S258-F262 PolarHBondContact O-N 3.26Å
259	S	88.7	Confident	89.3	Confident	19 Å²	19	81.9 Å²	81.9	13%	0.133	43%	0.427	C	S	.	.	H	α-helix	trans	-68.6	-39	179.6	-59.4	0	0	0	0	112	N255 I256 T263 L289	N255-S259 VanDerWaalsContact O-CB 3.26Å; N255-S259 WeakPolarHBondContact O-CB 3.48Å; N255-S259 PolarHBondContact O-N 3.39Å; N255-S259 PolarHBondContact O-OG 2.71Å; I256-S259 PolarHBondContact O-N 3.23Å; S259-T263 WeakPolarHBondContact O-CB 3.48Å; S259-T263 PolarHBondContact O-N 3.36Å; S259-T263 VanDerWaalsContact O-N 3.11Å; S259-T263 PolarHBondContact O-OG1 3.4Å; S259-L289 WeakPolarHBondContact OG-CD1 2.82Å
260	C	90.1	Very high	88.8	Confident	52 Å²	52	80.8 Å²	80.8	35%	0.351	43%	0.428	S	S	.	.	H	α-helix	trans	-65.8	-50	174.4	-70.7	0	0	0	0	110.9	I256 F262 T263 E264	I256-C260 WeakPolarHBondContact O-CB 3.39Å; I256-C260 PolarHBondContact O-N 3.34Å; I256-C260 PolarHBondContact O-SG 2.9Å; C260-F262 VanDerWaalsContact C-N 3.35Å; C260-F262 PolarHBondContact O-N 3.5Å; C260-T263 PolarHBondContact O-N 3.13Å; C260-T263 VanDerWaalsContact O-N 3.14Å; C260-E264 WeakPolarHBondContact O-CB 3.16Å; C260-E264 WeakPolarHBondContact O-CG 3.45Å; C260-E264 PolarHBondContact O-N 3.37Å
261	S	91.8	Very high	88.5	Confident	74 Å²	74	78.4 Å²	78.4	52%	0.517	42%	0.42	S	S	.	.	H	α-helix	trans	-58.8	-43.8	179.7	179.8	0	0	0	0	112.4	E257 E264 H265	E257-S261 VanDerWaalsContact O-CB 3.26Å; E257-S261 WeakPolarHBondContact O-CB 3.34Å; E257-S261 PolarHBondContact O-N 2.86Å; S261-E264 PolarHBondContact O-N 2.73Å; S261-H265 WeakPolarHBondContact O-CB 3.29Å; S261-H265 PolarHBondContact O-N 3.45Å
262	F	88.9	Confident	88	Confident	124 Å²	124	76.4 Å²	76.4	54%	0.544	42%	0.424	S	S	.	.	H	α-helix	trans	-62.1	-45.7	175.6	178.6	-95.4	0	0	0	111.9	S258 C260 H265 A266 M282	S258-F262 WeakPolarHBondContact O-CB 3.37Å; S258-F262 PolarHBondContact O-N 3.26Å; C260-F262 VanDerWaalsContact C-N 3.35Å; C260-F262 PolarHBondContact O-N 3.5Å; F262-H265 PolarHBondContact O-N 2.87Å; F262-A266 WeakPolarHBondContact O-CB 3.35Å; F262-A266 PolarHBondContact O-N 2.79Å; F262-M282 HydrophobicContact CD1-SD 4.37Å; F262-M282 HydrophobicContact CE1-CG 4.2Å; F262-M282 HydrophobicContact CE1-SD 3.96Å
263	T	86.9	Confident	87.7	Confident	27 Å²	27	80.9 Å²	80.9	17%	0.166	45%	0.451	C	S	.	.	H	α-helix	trans	-65.4	-42.8	-179.6	-53.7	0	0	0	0	111.2	S259 C260 A266 L267 M282 V286	S259-T263 WeakPolarHBondContact O-CB 3.48Å; S259-T263 PolarHBondContact O-N 3.36Å; S259-T263 VanDerWaalsContact O-N 3.11Å; S259-T263 PolarHBondContact O-OG1 3.4Å; C260-T263 PolarHBondContact O-N 3.13Å; C260-T263 VanDerWaalsContact O-N 3.14Å; T263-A266 PolarHBondContact O-N 2.9Å; T263-L267 HydrophobicContact CG2-CD1 4.05Å; T263-L267 HydrophobicContact CG2-CG 4.48Å; T263-L267 WeakPolarHBondContact O-CB 3.41Å; T263-L267 WeakPolarHBondContact O-CG 3.39Å; T263-L267 PolarHBondContact O-N 3.33Å; T263-M282 HydrophobicContact CG2-SD 4.5Å; T263-V286 HydrophobicContact CG2-CG2 4.49Å
264	E	87.8	Confident	87.3	Confident	133 Å²	133	80.8 Å²	80.8	62%	0.621	45%	0.452	S	S	*	.	H	α-helix	trans	-62.3	-42.6	175.3	-74.5	175.9	177.6	0	0	111.9	C260 S261 L267 S268	C260-E264 WeakPolarHBondContact O-CB 3.16Å; C260-E264 WeakPolarHBondContact O-CG 3.45Å; C260-E264 PolarHBondContact O-N 3.37Å; S261-E264 PolarHBondContact O-N 2.73Å; E264-L267 PolarHBondContact O-N 3.42Å; E264-S268 WeakPolarHBondContact O-CB 3.12Å; E264-S268 PolarHBondContact O-N 3.15Å; E264-S268 PolarHBondContact O-OG 3.5Å
265	H	87	Confident	86.8	Confident	113 Å²	113	76.3 Å²	76.3	52%	0.523	43%	0.432	S	S	.	.	H	α-helix	trans	-67	-43.3	178.6	-165.7	9.7	0	0	0	111.8	S261 F262 L267 S268 H269	S261-H265 WeakPolarHBondContact O-CB 3.29Å; S261-H265 PolarHBondContact O-N 3.45Å; F262-H265 PolarHBondContact O-N 2.87Å; H265-L267 VanDerWaalsContact C-N 3.33Å; H265-L267 PolarHBondContact O-N 2.82Å; H265-S268 WeakPolarHBondContact CA-OG 3.4Å; H265-S268 PolarHBondContact O-N 3.22Å; H265-S268 PolarHBondContact O-OG 2.69Å; H265-S268 VanDerWaalsContact O-OG 3.13Å; H265-H269 AromaticContact CE1-CG 3.6Å; H265-H269 AromaticContact CE1-ND1 3.57Å; H265-H269 AromaticContact ND1-CE1 3.93Å; H265-H269 AromaticContact ND1-CG 3.58Å; H265-H269 AromaticContact ND1-ND1 3.19Å; H265-H269 PolarHBondContact ND1-ND1 2.85Å; H265-H269 VanDerWaalsContact ND1-ND1 3.19Å; H265-H269 PolarHBondContact O-N 3.38Å
266	A	85.9	Confident	86.5	Confident	25 Å²	25	79.2 Å²	79.2	21%	0.207	45%	0.447	C	S	.	.	H	α-helix	trans	-62.3	-38.9	176.1	0	0	0	0	0	112.2	F262 T263 G270 I275 M282	F262-A266 WeakPolarHBondContact O-CB 3.35Å; F262-A266 PolarHBondContact O-N 2.79Å; T263-A266 PolarHBondContact O-N 2.9Å; A266-G270 WeakPolarHBondContact O-CA 3.48Å; A266-G270 PolarHBondContact O-N 3.39Å; A266-I275 WeakPolarHBondContact O-CD1 3.38Å; A266-I275 WeakPolarHBondContact O-CG1 3.38Å; A266-M282 HydrophobicContact CB-SD 3.94Å
267	L	84.2	Confident	86.2	Confident	115 Å²	115	83.4 Å²	83.4	60%	0.602	47%	0.469	S	S	*	.	H	α-helix	trans	-71.2	-32.8	177.2	-73	172.2	0	0	0	113.4	T263 E264 H265	T263-L267 HydrophobicContact CG2-CD1 4.05Å; T263-L267 HydrophobicContact CG2-CG 4.48Å; T263-L267 WeakPolarHBondContact O-CB 3.41Å; T263-L267 WeakPolarHBondContact O-CG 3.39Å; T263-L267 PolarHBondContact O-N 3.33Å; E264-L267 PolarHBondContact O-N 3.42Å; H265-L267 VanDerWaalsContact C-N 3.33Å; H265-L267 PolarHBondContact O-N 2.82Å
268	S	86.4	Confident	85.8	Confident	77 Å²	77	80.8 Å²	80.8	54%	0.538	46%	0.46	S	S	.	.	H	α-helix	trans	-87.4	-30.3	-175.8	49.6	0	0	0	0	114	E264 H265	E264-S268 WeakPolarHBondContact O-CB 3.12Å; E264-S268 PolarHBondContact O-N 3.15Å; E264-S268 PolarHBondContact O-OG 3.5Å; H265-S268 WeakPolarHBondContact CA-OG 3.4Å; H265-S268 PolarHBondContact O-N 3.22Å; H265-S268 PolarHBondContact O-OG 2.69Å; H265-S268 VanDerWaalsContact O-OG 3.13Å
269	H	83.7	Confident	85.5	Confident	146 Å²	146	83.3 Å²	83.3	68%	0.676	47%	0.465	S	S	*	.	H	α-helix	trans	-124.6	-7.3	-171.8	-61.6	76.1	0	0	0	114.5	H265	H265-H269 AromaticContact CE1-CG 3.6Å; H265-H269 AromaticContact CE1-ND1 3.57Å; H265-H269 AromaticContact ND1-CE1 3.93Å; H265-H269 AromaticContact ND1-CG 3.58Å; H265-H269 AromaticContact ND1-ND1 3.19Å; H265-H269 PolarHBondContact ND1-ND1 2.85Å; H265-H269 VanDerWaalsContact ND1-ND1 3.19Å; H265-H269 PolarHBondContact O-N 3.38Å
270	G	81.6	Confident	85.3	Confident	30 Å²	30	89.6 Å²	89.6	31%	0.309	49%	0.49	S	S	.	.			trans	-78.8	149	-177	0	0	0	0	0	114.1	A266 I275	A266-G270 WeakPolarHBondContact O-CA 3.48Å; A266-G270 PolarHBondContact O-N 3.39Å; G270-I275 WeakPolarHBondContact O-CD1 3.49Å
271	S	85.1	Confident	85.2	Confident	49 Å²	49	93.7 Å²	93.7	34%	0.343	50%	0.504	S	S	.	.			trans	-73	154.3	170.2	71.7	0	0	0	0	111.3	T273 E274 I275	S271-T273 PolarHBondContact O-N 3.18Å; S271-T273 VanDerWaalsContact O-N 3.13Å; S271-T273 PolarHBondContact OG-OG1 2.94Å; S271-E274 WeakPolarHBondContact CB-OE2 3.48Å; S271-E274 PolarHBondContact N-OE2 3.03Å; S271-E274 VanDerWaalsContact N-OE2 3.07Å; S271-E274 PolarHBondContact O-N 2.93Å; S271-E274 VanDerWaalsContact O-N 3.08Å; S271-E274 VanDerWaalsContact OG-CG 3.26Å; S271-E274 WeakPolarHBondContact OG-CG 3.45Å; S271-E274 PolarHBondContact OG-OE2 2.83Å; S271-I275 WeakPolarHBondContact O-CG1 3.41Å; S271-I275 PolarHBondContact O-N 2.94Å
272	A	82.7	Confident	85	Confident	77 Å²	77	91.1 Å²	91.1	64%	0.636	48%	0.484	S	S	*	.	H	α-helix	trans	-55.4	-35.6	-176.7	0	0	0	0	0	113.5	L276	A272-L276 WeakPolarHBondContact O-CD1 3.35Å; A272-L276 WeakPolarHBondContact O-CG 3.18Å; A272-L276 PolarHBondContact O-N 2.87Å
273	T	82.2	Confident	84.8	Confident	100 Å²	100	86.9 Å²	86.9	61%	0.613	48%	0.476	S	S	*	.	H	α-helix	trans	-72.3	-38.4	177.7	30.9	0	0	0	0	113.5	S271 L277	S271-T273 PolarHBondContact O-N 3.18Å; S271-T273 VanDerWaalsContact O-N 3.13Å; S271-T273 PolarHBondContact OG-OG1 2.94Å; T273-L277 WeakPolarHBondContact O-CG 3.44Å; T273-L277 PolarHBondContact O-N 3Å
274	E	82.4	Confident	84.8	Confident	116 Å²	116	90.9 Å²	90.9	54%	0.542	49%	0.492	S	S	.	.	H	α-helix	trans	-71	-39.8	179	-70.3	162.1	155	0	0	111.4	S271 L276 L277 V278	S271-E274 WeakPolarHBondContact CB-OE2 3.48Å; S271-E274 PolarHBondContact N-OE2 3.03Å; S271-E274 VanDerWaalsContact N-OE2 3.07Å; S271-E274 PolarHBondContact O-N 2.93Å; S271-E274 VanDerWaalsContact O-N 3.08Å; S271-E274 VanDerWaalsContact OG-CG 3.26Å; S271-E274 WeakPolarHBondContact OG-CG 3.45Å; S271-E274 PolarHBondContact OG-OE2 2.83Å; E274-L276 PolarHBondContact O-N 3.44Å; E274-L277 PolarHBondContact O-N 3.07Å; E274-V278 PolarHBondContact O-N 3.34Å
275	I	83.3	Confident	84.8	Confident	40 Å²	40	91 Å²	91	21%	0.205	49%	0.487	C	S	.	.	H	α-helix	trans	-61.4	-45.5	176.6	-65.2	170.4	0	0	0	110.3	A266 G270 S271 L277 V278 Q279	A266-I275 WeakPolarHBondContact O-CD1 3.38Å; A266-I275 WeakPolarHBondContact O-CG1 3.38Å; G270-I275 WeakPolarHBondContact O-CD1 3.49Å; S271-I275 WeakPolarHBondContact O-CG1 3.41Å; S271-I275 PolarHBondContact O-N 2.94Å; I275-L277 VanDerWaalsContact C-N 3.34Å; I275-L277 PolarHBondContact O-N 3.28Å; I275-V278 PolarHBondContact O-N 3.46Å; I275-Q279 WeakPolarHBondContact O-CA 3.5Å; I275-Q279 VanDerWaalsContact O-CB 3.28Å; I275-Q279 WeakPolarHBondContact O-CB 3.25Å; I275-Q279 PolarHBondContact O-N 2.88Å
276	L	82.1	Confident	84.8	Confident	119 Å²	119	88.2 Å²	88.2	62%	0.623	48%	0.478	S	S	*	.	H	α-helix	trans	-63.6	-34.9	179.8	-79.3	165.8	0	0	0	113.2	A272 E274 V278	A272-L276 WeakPolarHBondContact O-CD1 3.35Å; A272-L276 WeakPolarHBondContact O-CG 3.18Å; A272-L276 PolarHBondContact O-N 2.87Å; E274-L276 PolarHBondContact O-N 3.44Å; L276-V278 VanDerWaalsContact C-N 3.35Å; L276-V278 PolarHBondContact O-N 2.97Å
277	L	84.4	Confident	84.8	Confident	146 Å²	146	89.4 Å²	89.4	76%	0.764	49%	0.485	S	S	*	.	H	α-helix	trans	-66	-35.8	178.5	-77.7	166	0	0	0	112.5	T273 E274 I275	T273-L277 WeakPolarHBondContact O-CG 3.44Å; T273-L277 PolarHBondContact O-N 3Å; E274-L277 PolarHBondContact O-N 3.07Å; I275-L277 VanDerWaalsContact C-N 3.34Å; I275-L277 PolarHBondContact O-N 3.28Å
278	V	85	Confident	84.9	Confident	53 Å²	53	86.3 Å²	86.3	32%	0.321	48%	0.476	S	S	.	.	H	α-helix	trans	-104	-8.9	-175.2	-158.5	0	0	0	0	112.3	E274 I275 L276 K280 Q281 M282	E274-V278 PolarHBondContact O-N 3.34Å; I275-V278 PolarHBondContact O-N 3.46Å; L276-V278 VanDerWaalsContact C-N 3.35Å; L276-V278 PolarHBondContact O-N 2.97Å; V278-K280 VanDerWaalsContact C-N 3.32Å; V278-K280 PolarHBondContact O-N 2.85Å; V278-Q281 HydrophobicContact CG1-CB 4.38Å; V278-Q281 PolarHBondContact O-N 3.14Å; V278-M282 HydrophobicContact CB-CE 3.98Å; V278-M282 HydrophobicContact CB-CG 4.49Å; V278-M282 HydrophobicContact CG1-CE 4.44Å; V278-M282 HydrophobicContact CG1-CG 3.94Å; V278-M282 HydrophobicContact CG1-SD 4.44Å; V278-M282 PolarHBondContact O-N 2.94Å
279	Q	84.8	Confident	85	Confident	114 Å²	114	84 Å²	84	53%	0.533	46%	0.457	S	S	.	.	H	α-helix	trans	-49.8	-46.9	-175.7	-175.5	-174.6	10.5	0	0	113.3	I275 G283	I275-Q279 WeakPolarHBondContact O-CA 3.5Å; I275-Q279 VanDerWaalsContact O-CB 3.28Å; I275-Q279 WeakPolarHBondContact O-CB 3.25Å; I275-Q279 PolarHBondContact O-N 2.88Å; Q279-G283 PolarHBondContact O-N 3.22Å
280	K	86.2	Confident	84.9	Confident	152 Å²	152	81.1 Å²	81.1	66%	0.661	46%	0.459	S	S	*	.	H	α-helix	trans	-63.9	-44.5	-179	-174.9	178.2	175.1	-177.7	0	111.5	V278 G283 E284	V278-K280 VanDerWaalsContact C-N 3.32Å; V278-K280 PolarHBondContact O-N 2.85Å; K280-G283 PolarHBondContact O-N 3.09Å; K280-E284 WeakPolarHBondContact CE-OE1 3.41Å; K280-E284 WeakPolarHBondContact O-CB 3.25Å; K280-E284 VanDerWaalsContact O-CG 3.29Å; K280-E284 WeakPolarHBondContact O-CG 3.21Å; K280-E284 PolarHBondContact O-N 2.94Å
281	Q	86.5	Confident	85	Confident	138 Å²	138	88.8 Å²	88.8	65%	0.645	48%	0.478	S	S	*	.	H	α-helix	trans	-69	-41.4	-179.8	-66.1	-177.7	-9	0	0	111.9	V278 R285	V278-Q281 HydrophobicContact CG1-CB 4.38Å; V278-Q281 PolarHBondContact O-N 3.14Å; Q281-R285 VanDerWaalsContact O-CB 3.31Å; Q281-R285 WeakPolarHBondContact O-CB 3.47Å; Q281-R285 PolarHBondContact O-N 2.76Å
282	M	88.1	Confident	85	Confident	20 Å²	20	91.9 Å²	91.9	10%	0.099	49%	0.487	C	S	.	.	H	α-helix	trans	-62.7	-47.9	174.2	-69	-174.7	-69.2	0	0	111.2	F262 T263 A266 V278 E284 R285 V286	F262-M282 HydrophobicContact CD1-SD 4.37Å; F262-M282 HydrophobicContact CE1-CG 4.2Å; F262-M282 HydrophobicContact CE1-SD 3.96Å; T263-M282 HydrophobicContact CG2-SD 4.5Å; A266-M282 HydrophobicContact CB-SD 3.94Å; V278-M282 HydrophobicContact CB-CE 3.98Å; V278-M282 HydrophobicContact CB-CG 4.49Å; V278-M282 HydrophobicContact CG1-CE 4.44Å; V278-M282 HydrophobicContact CG1-CG 3.94Å; V278-M282 HydrophobicContact CG1-SD 4.44Å; V278-M282 PolarHBondContact O-N 2.94Å; M282-E284 PolarHBondContact O-N 3.45Å; M282-R285 PolarHBondContact O-N 3.18Å; M282-V286 WeakPolarHBondContact O-CG2 3.22Å; M282-V286 PolarHBondContact O-N 2.97Å
283	G	84.4	Confident	84.9	Confident	35 Å²	35	93.1 Å²	93.1	36%	0.361	49%	0.491	S	S	.	.	H	α-helix	trans	-62.1	-43.1	179.9	0	0	0	0	0	113	Q279 K280 S287	Q279-G283 PolarHBondContact O-N 3.22Å; K280-G283 PolarHBondContact O-N 3.09Å; G283-S287 WeakPolarHBondContact O-CB 3.37Å; G283-S287 PolarHBondContact O-N 3.46Å; G283-S287 PolarHBondContact O-OG 3.4Å
284	E	87.7	Confident	85	Confident	111 Å²	111	90.4 Å²	90.4	52%	0.519	47%	0.471	S	S	.	.	H	α-helix	trans	-64.3	-42.5	175.4	-75.8	173.3	-176.6	0	0	111.7	K280 M282 A288	K280-E284 WeakPolarHBondContact CE-OE1 3.41Å; K280-E284 WeakPolarHBondContact O-CB 3.25Å; K280-E284 VanDerWaalsContact O-CG 3.29Å; K280-E284 WeakPolarHBondContact O-CG 3.21Å; K280-E284 PolarHBondContact O-N 2.94Å; M282-E284 PolarHBondContact O-N 3.45Å; E284-A288 WeakPolarHBondContact O-CB 3.34Å; E284-A288 PolarHBondContact O-N 3.43Å
285	R	86.9	Confident	84.9	Confident	134 Å²	134	86.6 Å²	86.6	51%	0.506	46%	0.456	S	S	.	.	H	α-helix	trans	-66.7	-47.6	179.7	-175.3	63.1	175.1	-179.8	0.1	112.5	Q281 M282 A288 L289	Q281-R285 VanDerWaalsContact O-CB 3.31Å; Q281-R285 WeakPolarHBondContact O-CB 3.47Å; Q281-R285 PolarHBondContact O-N 2.76Å; M282-R285 PolarHBondContact O-N 3.18Å; R285-A288 PolarHBondContact O-N 3.44Å; R285-L289 HydrophobicContact CG-CD1 4.46Å; R285-L289 WeakPolarHBondContact O-CG 3.27Å; R285-L289 PolarHBondContact O-N 3.25Å
286	V	86.9	Confident	84.8	Confident	55 Å²	55	91.7 Å²	91.7	33%	0.333	48%	0.479	S	S	.	.	H	α-helix	trans	-65.2	-42.1	177.8	175.1	0	0	0	0	110.5	T263 M282 A288 L289 A290	T263-V286 HydrophobicContact CG2-CG2 4.49Å; M282-V286 WeakPolarHBondContact O-CG2 3.22Å; M282-V286 PolarHBondContact O-N 2.97Å; V286-A288 VanDerWaalsContact C-N 3.32Å; V286-A288 PolarHBondContact O-N 3.22Å; V286-L289 PolarHBondContact O-N 3.38Å; V286-A290 WeakPolarHBondContact O-CB 3.33Å; V286-A290 PolarHBondContact O-N 3.1Å
287	S	86.4	Confident	84.7	Confident	50 Å²	50	93.1 Å²	93.1	35%	0.35	48%	0.482	S	S	.	.	H	α-helix	trans	-66.4	-32.6	176	-59.2	0	0	0	0	112.9	G283 R291	G283-S287 WeakPolarHBondContact O-CB 3.37Å; G283-S287 PolarHBondContact O-N 3.46Å; G283-S287 PolarHBondContact O-OG 3.4Å; S287-R291 WeakPolarHBondContact O-CB 3.39Å; S287-R291 WeakPolarHBondContact O-CG 3.45Å; S287-R291 PolarHBondContact O-N 3.03Å; S287-R291 PolarHBondContact O-NE 3.04Å
288	A	86.4	Confident	84.7	Confident	51 Å²	51	91 Å²	91	42%	0.421	48%	0.478	S	S	.	.	H	α-helix	trans	-68.9	-42.9	175.2	0	0	0	0	0	111.6	E284 R285 V286 R291 H292	E284-A288 WeakPolarHBondContact O-CB 3.34Å; E284-A288 PolarHBondContact O-N 3.43Å; R285-A288 PolarHBondContact O-N 3.44Å; V286-A288 VanDerWaalsContact C-N 3.32Å; V286-A288 PolarHBondContact O-N 3.22Å; A288-R291 PolarHBondContact O-N 3.11Å; A288-H292 PolarHBondContact O-N 3.48Å; A288-H292 VanDerWaalsContact O-N 3.13Å
289	L	87.4	Confident	84.6	Confident	27 Å²	27	94 Å²	94	14%	0.141	49%	0.488	C	S	.	.	H	α-helix	trans	-67.2	-40.4	175.9	-70.1	169.9	0	0	0	112	I256 S259 R285 V286 R291 H292	I256-L289 HydrophobicContact CG1-CB 4.46Å; I256-L289 HydrophobicContact CG1-CD2 4.4Å; S259-L289 WeakPolarHBondContact OG-CD1 2.82Å; R285-L289 HydrophobicContact CG-CD1 4.46Å; R285-L289 WeakPolarHBondContact O-CG 3.27Å; R285-L289 PolarHBondContact O-N 3.25Å; V286-L289 PolarHBondContact O-N 3.38Å; L289-R291 PolarHBondContact O-N 3.36Å; L289-H292 PolarHBondContact O-N 3.45Å; L289-H292 VanDerWaalsContact O-N 3.15Å
290	A	82.3	Confident	84.5	Confident	86 Å²	86	92 Å²	92	71%	0.711	48%	0.478	S	S	*	.	H	α-helix	trans	-65.2	-24.3	177.1	0	0	0	0	0	113.6	V286	V286-A290 WeakPolarHBondContact O-CB 3.33Å; V286-A290 PolarHBondContact O-N 3.1Å
291	R	84.8	Confident	84.3	Confident	191 Å²	191	89.3 Å²	89.3	72%	0.721	47%	0.471	S	S	*	.	H	α-helix	trans	-94.7	-9.5	175.7	-71.7	-175.6	-68.7	-122.3	0.9	113.5	S287 A288 L289	S287-R291 WeakPolarHBondContact O-CB 3.39Å; S287-R291 WeakPolarHBondContact O-CG 3.45Å; S287-R291 PolarHBondContact O-N 3.03Å; S287-R291 PolarHBondContact O-NE 3.04Å; A288-R291 PolarHBondContact O-N 3.11Å; L289-R291 PolarHBondContact O-N 3.36Å
292	H	84.8	Confident	83.9	Confident	114 Å²	114	86.4 Å²	86.4	53%	0.528	48%	0.479	S	S	.	.	P	Polyproline II helix	trans	-80.1	125.5	-178.2	-168.1	60.6	0	0	0	110.1	A288 L289 F294	A288-H292 PolarHBondContact O-N 3.48Å; A288-H292 VanDerWaalsContact O-N 3.13Å; L289-H292 PolarHBondContact O-N 3.45Å; L289-H292 VanDerWaalsContact O-N 3.15Å; H292-F294 HydrophobicContact CB-CE2 4.44Å; H292-F294 AromaticContact CD2-CE1 3.64Å; H292-F294 AromaticContact CD2-CZ 3.58Å
293	S	79.9	Confident	83.4	Confident	103 Å²	103	91.2 Å²	91.2	72%	0.72	50%	0.5	S	S	*	.	P	Polyproline II helix	trans	-86	123.7	178.7	56.3	0	0	0	0	110.8
294	F	85.4	Confident	83.2	Confident	44 Å²	44	93.9 Å²	93.9	19%	0.193	51%	0.506	C	S	.	.	P	Polyproline II helix	trans	-96.5	150.1	173.5	-64.2	-83.3	0	0	0	111.1	L249 G252 I256 H292 E296	L249-F294 HydrophobicContact CD2-CB 4Å; G252-F294 VanDerWaalsContact CA-CE1 3.42Å; I256-F294 HydrophobicContact CD1-CD2 4.49Å; I256-F294 HydrophobicContact CD1-CE2 3.59Å; I256-F294 HydrophobicContact CD1-CZ 3.78Å; I256-F294 HydrophobicContact CG1-CZ 4.46Å; H292-F294 HydrophobicContact CB-CE2 4.44Å; H292-F294 AromaticContact CD2-CE1 3.64Å; H292-F294 AromaticContact CD2-CZ 3.58Å; F294-E296 VanDerWaalsContact C-N 3.27Å; F294-E296 HydrophobicContact CB-CG 4.38Å; F294-E296 PolarHBondContact O-N 3.22Å
295	P	79.9	Confident	82.7	Confident	35 Å²	35	95.7 Å²	95.7	23%	0.227	52%	0.515	C	S	.	.			trans	-76.1	78.4	175.6	30.8	-33.7	0	0	0	110.7	Q245 L249 H297 H299	Q245-P295 HydrophobicContact CG-CB 4.48Å; Q245-P295 HydrophobicContact CG-CG 4.26Å; Q245-P295 PolarHBondContact NE2-O 3.32Å; L249-P295 HydrophobicContact CD2-CG 4.22Å; L249-P295 HydrophobicContact CG-CG 4.47Å; P295-H297 VanDerWaalsContact C-N 3.27Å; P295-H297 PolarHBondContact O-N 3.39Å; P295-H299 VanDerWaalsContact CB-NE2 3.26Å; P295-H299 WeakPolarHBondContact CB-NE2 3.38Å
296	E	80.1	Confident	82.3	Confident	148 Å²	148	93.3 Å²	93.3	69%	0.692	52%	0.517	S	S	*	.			trans	-73	-14.4	-173.5	-68.3	172	-164	0	0	114.3	F294	F294-E296 VanDerWaalsContact C-N 3.27Å; F294-E296 HydrophobicContact CB-CG 4.38Å; F294-E296 PolarHBondContact O-N 3.22Å
297	H	81.1	Confident	81.8	Confident	148 Å²	148	99.3 Å²	99.3	69%	0.685	54%	0.542	S	S	*	.	S	Bend	trans	-109.2	138.9	-178.9	-59.2	83.1	0	0	0	110.8	Q245 P295 H299	Q245-H297 PolarHBondContact NE2-O 3.04Å; P295-H297 VanDerWaalsContact C-N 3.27Å; P295-H297 PolarHBondContact O-N 3.39Å; H297-H299 PolarHBondContact O-CD2 2.92Å; H297-H299 PolarHBondContact O-N 3.26Å
298	P	83.5	Confident	81.3	Confident	102 Å²	102	101.3 Å²	101.3	66%	0.662	55%	0.551	S	S	*	*			trans	-54.8	127.5	179.3	-23.6	32.7	0	0	0	112	L242 E300	L242-P298 HydrophobicContact CD2-CB 4.42Å; P298-E300 PolarHBondContact O-N 2.82Å
299	H	83.8	Confident	80.6	Confident	117 Å²	117	106.7 Å²	106.7	54%	0.542	57%	0.568	S	S	.	*	S	Bend	trans	-74.8	-15.6	177.9	-70.3	175.3	0	0	0	113.1	V241 P295 H297	V241-H299 HydrophobicContact CG1-CB 4Å; P295-H299 VanDerWaalsContact CB-NE2 3.26Å; P295-H299 WeakPolarHBondContact CB-NE2 3.38Å; H297-H299 PolarHBondContact O-CD2 2.92Å; H297-H299 PolarHBondContact O-N 3.26Å
300	E	82.8	Confident	79.9	Confident	71 Å²	71	109.4 Å²	109.4	33%	0.332	59%	0.586	S	S	.	*	S	Bend	trans	-134.8	155.3	180	-87.1	-65.3	177.5	0	0	111.8	K238 V241 L242 P298	K238-E300 HydrophobicContact CG-CG 4.5Å; V241-E300 HydrophobicContact CB-CG 4.04Å; V241-E300 HydrophobicContact CG1-CG 3.83Å; V241-E300 HydrophobicContact CG2-CG 4.49Å; L242-E300 HydrophobicContact CD2-CB 3.97Å; L242-E300 HydrophobicContact CG-CB 4.08Å; P298-E300 PolarHBondContact O-N 2.82Å
301	N	81.3	Confident	79.2	Confident	96 Å²	96	110 Å²	110	51%	0.513	58%	0.577	S	S	.	*			trans	-108.6	157.4	-180	66.9	43	0	0	0	112.3	K238 H303	K238-N301 PolarHBondContact NZ-O 2.9Å; K238-N301 PolarHBondContact NZ-OD1 2.85Å; N301-H303 VanDerWaalsContact C-N 3.26Å; N301-H303 PolarHBondContact O-N 3.34Å; N301-H303 PolarHBondContact OD1-N 2.8Å
302	G	78.6	Confident	78.4	Confident	77 Å²	77	102.2 Å²	102.2	79%	0.794	56%	0.557	S	S	*	*			trans	-82.8	9.9	178.1	0	0	0	0	0	115	L304	G302-L304 PolarHBondContact O-N 3.44Å
303	H	76.9	Confident	77.8	Confident	120 Å²	120	100.8 Å²	100.8	56%	0.556	55%	0.552	S	S	*	*			trans	-74.4	123.4	-176.4	-177.8	70.7	0	0	0	110.7	K238 N301 E305	K238-H303 PolarHBondContact NZ-O 2.82Å; N301-H303 VanDerWaalsContact C-N 3.26Å; N301-H303 PolarHBondContact O-N 3.34Å; N301-H303 PolarHBondContact OD1-N 2.8Å; H303-E305 IonicContact CE1-OE2 3.96Å; H303-E305 IonicContact NE2-OE2 2.71Å
304	L	79.9	Confident	77.3	Confident	92 Å²	92	104.1 Å²	104.1	48%	0.482	55%	0.549	S	S	.	.			trans	-143.5	110.5	176.3	-79.4	157.3	0	0	0	107	I234 C235 G302	I234-L304 HydrophobicContact CG2-CD2 3.94Å; C235-L304 WeakPolarHBondContact SG-CD1 3.44Å; G302-L304 PolarHBondContact O-N 3.44Å
305	E	78.3	Confident	76.3	Confident	149 Å²	149	109.7 Å²	109.7	70%	0.696	57%	0.569	S	S	*	*			trans	-127.2	121.7	176.6	-173.3	169.9	-172	0	0	108.7	H303	H303-E305 IonicContact CE1-OE2 3.96Å; H303-E305 IonicContact NE2-OE2 2.71Å
306	C	78.3	Confident	75.5	Confident	84 Å²	84	111.3 Å²	111.3	57%	0.568	58%	0.581	S	S	*	*			trans	-107.8	108.3	175.2	-177.3	0	0	0	0	107.9
307	Q	75.6	Confident	75.1	Confident	181 Å²	181	108.2 Å²	108.2	85%	0.846	57%	0.568	S	S	*	*			trans	-97	113.8	175.3	-168.2	175.3	15.9	0	0	109
308	V	76.5	Confident	74.1	Confident	91 Å²	91	108.1 Å²	108.1	55%	0.552	57%	0.568	S	S	*	*			trans	-110.1	110.5	175.8	-174.4	0	0	0	0	108.5	T310	V308-T310 HydrophobicContact CG1-CG2 4.03Å; V308-T310 PolarHBondContact O-N 3.23Å
309	E	70.9	Confident	72.9	Confident	165 Å²	165	109.4 Å²	109.4	77%	0.771	57%	0.57	S	S	*	*			trans	-79.1	109.9	176.3	-172.7	164.4	-147	0	0	110.3
310	T	72.6	Confident	71.9	Confident	84 Å²	84	107.5 Å²	107.5	52%	0.515	56%	0.563	S	S	.	*			trans	-104.1	-18.9	-174.8	54.7	0	0	0	0	113.3	V308 G312 L313 R314	V308-T310 HydrophobicContact CG1-CG2 4.03Å; V308-T310 PolarHBondContact O-N 3.23Å; T310-G312 PolarHBondContact O-N 2.95Å; T310-L313 PolarHBondContact O-N 3.47Å; T310-R314 WeakPolarHBondContact O-CB 3.46Å; T310-R314 PolarHBondContact O-N 3.34Å
311	D	68.6	Low	70.3	Confident	97 Å²	97	107.4 Å²	107.4	52%	0.519	58%	0.581	S	S	.	*	H	α-helix	trans	-74.4	-26.5	-175.2	-70.5	-39.1	0	0	0	113.7	R315	D311-R315 WeakPolarHBondContact O-CG 3.22Å; D311-R315 PolarHBondContact O-N 3.15Å; D311-R315 PolarHBondContact O-NE 3.01Å
312	G	68	Low	69.4	Low	29 Å²	29	108 Å²	108	30%	0.299	59%	0.588	S	S	.	*	H	α-helix	trans	-68.2	-53	170.8	0	0	0	0	0	111.2	T310 R314 R315 S316	T310-G312 PolarHBondContact O-N 2.95Å; G312-R314 PolarHBondContact O-N 2.75Å; G312-R315 PolarHBondContact O-N 3.38Å; G312-S316 PolarHBondContact O-N 3.34Å; G312-S316 PolarHBondContact O-OG 3.09Å
313	L	71.6	Confident	68.3	Low	83 Å²	83	110.5 Å²	110.5	44%	0.435	58%	0.582	S	S	.	*	H	α-helix	trans	-63.3	-39.1	-179.5	-175.9	63.8	0	0	0	112.3	L220 T310 R315 S316 I317	L220-L313 HydrophobicContact CD2-CD2 3.82Å; T310-L313 PolarHBondContact O-N 3.47Å; L313-R315 VanDerWaalsContact C-N 3.31Å; L313-R315 PolarHBondContact O-N 2.74Å; L313-S316 PolarHBondContact O-N 2.85Å; L313-I317 HydrophobicContact CD1-CD1 4.38Å; L313-I317 HydrophobicContact CD1-CG1 4.39Å; L313-I317 HydrophobicContact CD2-CD1 4.49Å; L313-I317 HydrophobicContact CG-CD1 3.91Å; L313-I317 HydrophobicContact CG-CG1 4.38Å; L313-I317 VanDerWaalsContact O-CG1 3.28Å; L313-I317 WeakPolarHBondContact O-CG1 3.43Å; L313-I317 PolarHBondContact O-N 3.27Å
314	R	68.9	Low	67.6	Low	173 Å²	173	110.1 Å²	110.1	65%	0.653	58%	0.583	S	S	*	*	H	α-helix	trans	-62.7	-37	177.5	-170.5	176.8	-176.5	-173.1	1.6	112.6	T310 G312 Q318	T310-R314 WeakPolarHBondContact O-CB 3.46Å; T310-R314 PolarHBondContact O-N 3.34Å; G312-R314 PolarHBondContact O-N 2.75Å; R314-Q318 WeakPolarHBondContact O-CG 3.48Å; R314-Q318 PolarHBondContact O-N 3.21Å
315	R	65.4	Low	66.8	Low	162 Å²	162	111.4 Å²	111.4	61%	0.611	60%	0.595	S	S	*	*	H	α-helix	trans	-70.1	-40.8	173.5	-77.6	-177.8	-79.1	174.9	-4.4	111.5	D311 G312 L313 I317 Q318 N319	D311-R315 WeakPolarHBondContact O-CG 3.22Å; D311-R315 PolarHBondContact O-N 3.15Å; D311-R315 PolarHBondContact O-NE 3.01Å; G312-R315 PolarHBondContact O-N 3.38Å; L313-R315 VanDerWaalsContact C-N 3.31Å; L313-R315 PolarHBondContact O-N 2.74Å; R315-I317 PolarHBondContact O-N 3.43Å; R315-Q318 PolarHBondContact O-N 3.28Å; R315-N319 PolarHBondContact O-ND2 3.04Å
316	S	63.1	Low	66.3	Low	69 Å²	69	105.8 Å²	105.8	48%	0.483	57%	0.571	S	S	.	*	H	α-helix	trans	-64.1	-39.1	176	-57.4	0	0	0	0	112.8	G312 L313 Q318 N319 L320	G312-S316 PolarHBondContact O-N 3.34Å; G312-S316 PolarHBondContact O-OG 3.09Å; L313-S316 PolarHBondContact O-N 2.85Å; S316-Q318 VanDerWaalsContact C-N 3.3Å; S316-Q318 PolarHBondContact O-N 3.33Å; S316-N319 PolarHBondContact O-N 2.83Å; S316-L320 PolarHBondContact O-N 3.26Å
317	I	70.9	Confident	65.8	Low	82 Å²	82	104 Å²	104	42%	0.421	57%	0.567	S	S	.	*	H	α-helix	trans	-62.8	-36.3	178.3	-70.9	165.3	0	0	0	111.9	L313 R315 N319 L320	L313-I317 HydrophobicContact CD1-CD1 4.38Å; L313-I317 HydrophobicContact CD1-CG1 4.39Å; L313-I317 HydrophobicContact CD2-CD1 4.49Å; L313-I317 HydrophobicContact CG-CD1 3.91Å; L313-I317 HydrophobicContact CG-CG1 4.38Å; L313-I317 VanDerWaalsContact O-CG1 3.28Å; L313-I317 WeakPolarHBondContact O-CG1 3.43Å; L313-I317 PolarHBondContact O-N 3.27Å; R315-I317 PolarHBondContact O-N 3.43Å; I317-N319 PolarHBondContact O-N 3.2Å; I317-L320 HydrophobicContact CB-CD1 4.37Å; I317-L320 HydrophobicContact CG1-CD1 4.1Å; I317-L320 PolarHBondContact O-N 3.39Å
318	Q	60.6	Low	65.9	Low	147 Å²	147	95.9 Å²	95.9	69%	0.687	53%	0.531	S	S	*	.	H	α-helix	trans	-65.1	-18	177	-71.3	175.7	-9.4	0	0	113.3	R314 R315 S316	R314-Q318 WeakPolarHBondContact O-CG 3.48Å; R314-Q318 PolarHBondContact O-N 3.21Å; R315-Q318 PolarHBondContact O-N 3.28Å; S316-Q318 VanDerWaalsContact C-N 3.3Å; S316-Q318 PolarHBondContact O-N 3.33Å
319	N	57.4	Low	66.2	Low	129 Å²	129	93.2 Å²	93.2	69%	0.69	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.2	2.4	179.6	-62.3	-26.9	0	0	0	113	R315 S316 I317 G321	R315-N319 PolarHBondContact O-ND2 3.04Å; S316-N319 PolarHBondContact O-N 2.83Å; I317-N319 PolarHBondContact O-N 3.2Å; N319-G321 PolarHBondContact O-N 3.27Å
320	L	63.1	Low	66.6	Low	77 Å²	77	85.4 Å²	85.4	40%	0.403	48%	0.479	S	S	.	.	S	Bend	trans	-76.4	114.6	179.7	-75.2	172.6	0	0	0	111	F213 L216 S316 I317	F213-L320 HydrophobicContact CE1-CB 4.42Å; F213-L320 HydrophobicContact CE1-CD1 4.44Å; F213-L320 HydrophobicContact CZ-CB 3.95Å; L216-L320 HydrophobicContact CD1-CD1 3.94Å; L216-L320 HydrophobicContact CD1-CD2 4.32Å; S316-L320 PolarHBondContact O-N 3.26Å; I317-L320 HydrophobicContact CB-CD1 4.37Å; I317-L320 HydrophobicContact CG1-CD1 4.1Å; I317-L320 PolarHBondContact O-N 3.39Å
321	G	50.6	Low	66.9	Low	69 Å²	69	87.2 Å²	87.2	71%	0.711	48%	0.481	S	S	*	.			trans	90.6	116.3	176.3	0	0	0	0	0	112.8	N319	N319-G321 PolarHBondContact O-N 3.27Å
322	V	61.4	Low	67.5	Low	107 Å²	107	83.7 Å²	83.7	65%	0.648	46%	0.463	S	S	*	.			trans	-125.2	116.6	170.4	179.4	0	0	0	0	107.9	I324	V322-I324 HydrophobicContact CG1-CG1 4.31Å; V322-I324 PolarHBondContact O-N 3.27Å
323	L	56	Low	68.4	Low	131 Å²	131	82.3 Å²	82.3	69%	0.686	45%	0.449	S	S	*	.			trans	-74	110.5	171.5	-74.7	161.9	0	0	0	108.9	I209	I209-L323 HydrophobicContact CD1-CD2 4.45Å
324	I	62	Low	69.1	Low	112 Å²	112	80.4 Å²	80.4	57%	0.574	44%	0.44	S	S	*	.			trans	-93.1	118.6	176.3	-58.2	175.1	0	0	0	108.1	V322 N367	V322-I324 HydrophobicContact CG1-CG1 4.31Å; V322-I324 PolarHBondContact O-N 3.27Å; I324-N367 HydrophobicContact CG2-CB 4.07Å
325	T	63.2	Low	70	Confident	119 Å²	119	72.7 Å²	72.7	73%	0.73	41%	0.414	S	S	*	.			trans	-126.8	146.2	173.3	61.9	0	0	0	0	109.7
326	T	68.6	Low	70.9	Confident	30 Å²	30	68.5 Å²	68.5	18%	0.184	41%	0.406	C	S	.	.			trans	-123.3	140.6	173.4	86.3	0	0	0	0	109.3	A328 G366 A368 Y413	T326-A328 VanDerWaalsContact C-N 3.27Å; T326-G366 WeakPolarHBondContact CG2-O 3.01Å; T326-A368 HydrophobicContact CG2-CB 4.47Å; T326-Y413 PolarHBondContact OG1-OH 2.74Å
327	G	67.6	Low	71.7	Confident	48 Å²	48	67 Å²	67	50%	0.495	40%	0.402	S	S	.	.			trans	-91.6	16.1	174.9	0	0	0	0	0	113.1	D357	G327-D357 WeakPolarHBondContact O-CA 3.42Å
328	A	77.4	Confident	71.9	Confident	9 Å²	9	71.8 Å²	71.8	7%	0.074	42%	0.422	C	S	.	.			trans	-73.9	132.2	-170.7	0	0	0	0	0	111.8	T326 T355 V363 A368 L412	T326-A328 VanDerWaalsContact C-N 3.27Å; A328-T355 HydrophobicContact CB-CG2 4.09Å; A328-V363 HydrophobicContact CB-CG2 4.17Å; A328-A368 HydrophobicContact CB-CB 4Å; A328-L412 HydrophobicContact CB-CD2 3.88Å
329	V	81.6	Confident	72.6	Confident	35 Å²	35	64.8 Å²	64.8	21%	0.212	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	130	-175.6	-179.1	0	0	0	0	110	H331 T332 S333 K356	V329-H331 WeakPolarHBondContact CG1-CE1 3.48Å; V329-H331 VanDerWaalsContact CG1-ND1 3.26Å; V329-H331 WeakPolarHBondContact CG1-ND1 3.12Å; V329-T332 PolarHBondContact O-N 3.05Å; V329-T332 PolarHBondContact O-OG1 2.81Å; V329-S333 WeakPolarHBondContact O-CB 3.31Å; V329-S333 PolarHBondContact O-N 2.91Å; V329-S333 VanDerWaalsContact O-N 3.13Å; V329-S333 PolarHBondContact O-OG 3.33Å; V329-K356 PolarHBondContact N-O 3.42Å
330	G	78.9	Confident	73.6	Confident	2 Å²	2	59.3 Å²	59.3	2%	0.021	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60	-52.1	-172.8	0	0	0	0	0	113.1	T332 S333 P416 V417 R418	G330-T332 PolarHBondContact O-N 2.85Å; G330-T332 VanDerWaalsContact O-N 3.15Å; G330-S333 PolarHBondContact O-N 3Å; G330-S333 VanDerWaalsContact O-N 3.16Å; G330-P416 CarbonylContact C-O 3.59Å; G330-V417 VanDerWaalsContact O-CA 3.3Å; G330-V417 WeakPolarHBondContact O-CA 3.48Å; G330-R418 PolarHBondContact O-N 2.98Å
331	H	79.5	Confident	74.5	Confident	122 Å²	122	64.5 Å²	64.5	57%	0.565	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.1	-16.7	-173.6	67.4	-95.1	0	0	0	115	V329	V329-H331 WeakPolarHBondContact CG1-CE1 3.48Å; V329-H331 VanDerWaalsContact CG1-ND1 3.26Å; V329-H331 WeakPolarHBondContact CG1-ND1 3.12Å
332	T	82.1	Confident	76	Confident	23 Å²	23	66.9 Å²	66.9	14%	0.141	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	-25.6	174.1	57.8	0	0	0	0	112.7	V329 G330 K356 D357	V329-T332 PolarHBondContact O-N 3.05Å; V329-T332 PolarHBondContact O-OG1 2.81Å; G330-T332 PolarHBondContact O-N 2.85Å; G330-T332 VanDerWaalsContact O-N 3.15Å; T332-K356 WeakPolarHBondContact O-CD 3.49Å; T332-K356 PolarHBondContact OG1-O 2.97Å; T332-D357 WeakPolarHBondContact CB-O 3.35Å; T332-D357 WeakPolarHBondContact CG2-O 3.15Å; T332-D357 PolarHBondContact OG1-O 3.02Å
333	S	86.5	Confident	77	Confident	0 Å²	0	62 Å²	62	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	151.1	178.3	-62.1	0	0	0	0	112	V329 G330 T355 K356 V417 R418	V329-S333 WeakPolarHBondContact O-CB 3.31Å; V329-S333 PolarHBondContact O-N 2.91Å; V329-S333 VanDerWaalsContact O-N 3.13Å; V329-S333 PolarHBondContact O-OG 3.33Å; G330-S333 PolarHBondContact O-N 3Å; G330-S333 VanDerWaalsContact O-N 3.16Å; S333-T355 WeakPolarHBondContact OG-CA 3.3Å; S333-K356 PolarHBondContact OG-N 3.36Å; S333-V417 WeakPolarHBondContact O-CG1 3.27Å; S333-R418 WeakPolarHBondContact O-CB 3.38Å; S333-R418 PolarHBondContact O-N 3.49Å
334	V	86.8	Confident	78.3	Confident	43 Å²	43	57.3 Å²	57.3	26%	0.261	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	137.8	-171	-177.5	0	0	0	0	111.1	T336 T354 K356	V334-T336 HydrophobicContact CG1-CG2 4.28Å; V334-T354 PolarHBondContact N-O 2.99Å; V334-T354 PolarHBondContact O-N 3.5Å; V334-K356 HydrophobicContact CG2-CD 4.45Å
335	A	86.9	Confident	79.3	Confident	11 Å²	11	53.3 Å²	53.3	9%	0.091	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	139.4	170.2	0	0	0	0	0	111.2	L340 V353 L410 F422	A335-L340 VanDerWaalsContact C-CD1 3.48Å; A335-L340 HydrophobicContact CB-CD1 3.83Å; A335-L340 HydrophobicContact CB-CD2 4.07Å; A335-L340 WeakPolarHBondContact O-CD1 3.38Å; A335-V353 HydrophobicContact CB-CG2 4.07Å; A335-L410 HydrophobicContact CB-CD1 3.43Å; A335-L410 VanDerWaalsContact CB-CD1 3.43Å; A335-F422 HydrophobicContact CB-CE2 4.27Å; A335-F422 HydrophobicContact CB-CZ 4.12Å
336	T	83.8	Confident	79.9	Confident	74 Å²	74	51 Å²	51	45%	0.454	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	137.1	179	53.9	0	0	0	0	111.2	V334 T352	V334-T336 HydrophobicContact CG1-CG2 4.28Å; T336-T352 PolarHBondContact N-O 3.21Å; T336-T352 PolarHBondContact O-N 2.57Å; T336-T352 VanDerWaalsContact O-O 3.13Å; T336-T352 PolarHBondContact OG1-O 3.32Å
337	G	80.3	Confident	80.5	Confident	38 Å²	38	55 Å²	55	39%	0.392	31%	0.312	S	S	.	.	S	Bend	trans	153.3	150.4	177.3	0	0	0	0	0	111.5	G339 L340	G337-G339 PolarHBondContact O-N 3.35Å; G337-L340 WeakPolarHBondContact O-CB 3.32Å; G337-L340 PolarHBondContact O-N 3.1Å; G337-L340 VanDerWaalsContact O-N 3.17Å
338	E	74.6	Confident	81.3	Confident	181 Å²	181	57.8 Å²	57.8	85%	0.846	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-64.1	-29.3	177.2	-65.2	-171.6	165.3	0	0	111.7	L340 R341 H342	E338-L340 PolarHBondContact O-N 3.14Å; E338-R341 PolarHBondContact O-N 2.75Å; E338-R341 VanDerWaalsContact O-N 3.16Å; E338-H342 PolarHBondContact O-N 2.84Å; E338-H342 VanDerWaalsContact O-N 3.17Å
339	G	75.8	Confident	81.5	Confident	1 Å²	1	58.6 Å²	58.6	1%	0.01	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-64.1	4	170.9	0	0	0	0	0	116.1	G337 H342 Y398	G337-G339 PolarHBondContact O-N 3.35Å; G339-H342 WeakPolarHBondContact CA-O 3.37Å; G339-Y398 PolarHBondContact O-OH 2.53Å
340	L	79.5	Confident	81.7	Confident	13 Å²	13	60.8 Å²	60.8	7%	0.068	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-87.5	-14.7	170	-70	170	0	0	0	113	A335 G337 E338 I351 F408 L410 F422	A335-L340 VanDerWaalsContact C-CD1 3.48Å; A335-L340 HydrophobicContact CB-CD1 3.83Å; A335-L340 HydrophobicContact CB-CD2 4.07Å; A335-L340 WeakPolarHBondContact O-CD1 3.38Å; G337-L340 WeakPolarHBondContact O-CB 3.32Å; G337-L340 PolarHBondContact O-N 3.1Å; G337-L340 VanDerWaalsContact O-N 3.17Å; E338-L340 PolarHBondContact O-N 3.14Å; L340-I351 HydrophobicContact CD2-CD1 3.65Å; L340-I351 HydrophobicContact CD2-CG2 4.46Å; L340-I351 HydrophobicContact CG-CD1 4.4Å; L340-I351 HydrophobicContact CG-CG2 4.17Å; L340-F408 HydrophobicContact CD2-CD1 3.91Å; L340-F408 HydrophobicContact CD2-CE1 3.89Å; L340-L410 HydrophobicContact CD2-CD1 4.46Å; L340-F422 HydrophobicContact CD2-CD1 4.44Å; L340-F422 HydrophobicContact CD2-CD2 4Å; L340-F422 HydrophobicContact CD2-CE2 4.19Å; L340-F422 HydrophobicContact CD2-CG 4.14Å; L340-F422 HydrophobicContact CD2-CZ 4.48Å
341	R	81.6	Confident	82.2	Confident	186 Å²	186	60.7 Å²	60.7	70%	0.702	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.6	-39.1	-174.9	-63.9	179.6	-177.7	-111	0.5	112.7	E338 R425	E338-R341 PolarHBondContact O-N 2.75Å; E338-R341 VanDerWaalsContact O-N 3.16Å; R341-R425 PolarHBondContact O-N 3.12Å
342	H	81.1	Confident	82.6	Confident	120 Å²	120	57.3 Å²	57.3	56%	0.556	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.7	138.5	-177.6	-55.8	99.4	0	0	0	110.4	E338 G339 R425	E338-H342 PolarHBondContact O-N 2.84Å; E338-H342 VanDerWaalsContact O-N 3.17Å; G339-H342 WeakPolarHBondContact CA-O 3.37Å; H342-R425 WeakPolarHBondContact CA-O 3.4Å
343	A	82.8	Confident	82.9	Confident	5 Å²	5	56.2 Å²	56.2	4%	0.041	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	147.8	172.7	0	0	0	0	0	110.2	Y398 L400 L424 R425 A426 V427	A343-Y398 HydrophobicContact CB-CE2 4.06Å; A343-L400 HydrophobicContact CB-CD1 3.93Å; A343-L424 HydrophobicContact CB-CD1 4.1Å; A343-R425 PolarHBondContact N-O 3.38Å; A343-A426 VanDerWaalsContact O-CA 3.31Å; A343-A426 WeakPolarHBondContact O-CA 3.35Å; A343-V427 PolarHBondContact O-N 3.47Å
344	V	83.6	Confident	83	Confident	31 Å²	31	57.8 Å²	57.8	19%	0.188	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	130.1	176.5	-178.9	0	0	0	0	108.9	G346 Q347 V427 P429	V344-G346 PolarHBondContact O-N 3.31Å; V344-Q347 HydrophobicContact CB-CB 4.09Å; V344-Q347 HydrophobicContact CG1-CB 4.38Å; V344-Q347 PolarHBondContact O-N 3.13Å; V344-V427 WeakPolarHBondContact CA-O 3.35Å; V344-P429 HydrophobicContact CG1-CB 4.28Å; V344-P429 HydrophobicContact CG1-CG 3.83Å
345	V	83.3	Confident	82.8	Confident	29 Å²	29	55.8 Å²	55.8	18%	0.176	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	130	179.7	176.7	0	0	0	0	110.4	Q347 E403 A426 V427	V345-Q347 VanDerWaalsContact C-N 3.3Å; V345-Q347 PolarHBondContact O-N 3.16Å; V345-E403 HydrophobicContact CG2-CG 3.91Å; V345-A426 HydrophobicContact CG2-CB 3.94Å; V345-V427 PolarHBondContact N-O 3.02Å
346	G	75.6	Confident	82.6	Confident	69 Å²	69	57.9 Å²	57.9	71%	0.711	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.5	-5	-179.2	0	0	0	0	0	115.7	V344 L400	V344-G346 PolarHBondContact O-N 3.31Å; G346-L400 PolarHBondContact N-O 2.6Å
347	Q	81.6	Confident	82.4	Confident	116 Å²	116	56.3 Å²	56.3	54%	0.542	30%	0.302	S	S	.	.	S	Bend	trans	-100.2	135.7	175.4	-168.9	173.1	2.2	0	0	110.9	V344 V345 T349	V344-Q347 HydrophobicContact CB-CB 4.09Å; V344-Q347 HydrophobicContact CG1-CB 4.38Å; V344-Q347 PolarHBondContact O-N 3.13Å; V345-Q347 VanDerWaalsContact C-N 3.3Å; V345-Q347 PolarHBondContact O-N 3.16Å; Q347-T349 PolarHBondContact O-N 3.45Å
348	H	83.1	Confident	82.3	Confident	106 Å²	106	61.5 Å²	61.5	49%	0.491	31%	0.314	S	S	.	.			trans	-71.9	123.1	173.3	-172.7	84.8	0	0	0	109.6
349	T	83.4	Confident	82.4	Confident	26 Å²	26	58.1 Å²	58.1	16%	0.16	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	134.3	-179.8	-53.9	0	0	0	0	109.3	Q347 G397 Y398	Q347-T349 PolarHBondContact O-N 3.45Å; T349-G397 WeakPolarHBondContact O-CA 3.46Å; T349-Y398 PolarHBondContact N-O 3.03Å; T349-Y398 PolarHBondContact O-N 3.23Å
350	T	85.9	Confident	82.1	Confident	80 Å²	80	59.5 Å²	59.5	49%	0.491	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	143.5	178.1	55.9	0	0	0	0	111	V396	T350-V396 WeakPolarHBondContact CA-O 3.31Å
351	I	89.6	Confident	81.9	Confident	1 Å²	1	65.1 Å²	65.1	1%	0.005	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	156.7	172.6	62.8	163.3	0	0	0	109.7	L340 E395 V396 F408 L410	L340-I351 HydrophobicContact CD2-CD1 3.65Å; L340-I351 HydrophobicContact CD2-CG2 4.46Å; L340-I351 HydrophobicContact CG-CD1 4.4Å; L340-I351 HydrophobicContact CG-CG2 4.17Å; I351-E395 CarbonylContact O-C 3.59Å; I351-E395 WeakPolarHBondContact O-CA 3.49Å; I351-V396 HydrophobicContact CD1-CB 4.02Å; I351-V396 HydrophobicContact CG1-CB 3.64Å; I351-V396 HydrophobicContact CG1-CG1 4.47Å; I351-V396 HydrophobicContact CG1-CG2 4.41Å; I351-V396 WeakPolarHBondContact CG1-O 3.41Å; I351-V396 PolarHBondContact N-O 2.88Å; I351-V396 PolarHBondContact O-N 2.99Å; I351-F408 HydrophobicContact CD1-CD1 4.35Å; I351-F408 HydrophobicContact CD1-CE1 3.22Å; I351-F408 HydrophobicContact CD1-CZ 3.6Å; I351-L410 HydrophobicContact CD1-CD1 4.12Å
352	T	87.8	Confident	81.7	Confident	51 Å²	51	60.9 Å²	60.9	31%	0.313	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	125.7	179	-47.2	0	0	0	0	110.2	T336 Y394	T336-T352 PolarHBondContact N-O 3.21Å; T336-T352 PolarHBondContact O-N 2.57Å; T336-T352 VanDerWaalsContact O-O 3.13Å; T336-T352 PolarHBondContact OG1-O 3.32Å; T352-Y394 CarbonylContact C-O 3.5Å; T352-Y394 WeakPolarHBondContact CA-O 3.09Å
353	V	88.1	Confident	81.5	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	124.4	171.9	-176.9	0	0	0	0	108.7	A335 L370 T393 Y394 V396 L410	A335-V353 HydrophobicContact CB-CG2 4.07Å; V353-L370 HydrophobicContact CB-CD2 3.86Å; V353-L370 HydrophobicContact CG1-CD1 4.28Å; V353-L370 HydrophobicContact CG1-CD2 3.98Å; V353-L370 HydrophobicContact CG2-CD2 3.97Å; V353-T393 CarbonylContact O-C 3.56Å; V353-T393 VanDerWaalsContact O-CA 3.31Å; V353-T393 WeakPolarHBondContact O-CA 3.42Å; V353-Y394 PolarHBondContact N-O 2.92Å; V353-Y394 PolarHBondContact O-N 3.05Å; V353-V396 HydrophobicContact CG2-CG2 3.95Å; V353-L410 HydrophobicContact CG2-CD1 3.68Å; V353-L410 HydrophobicContact CG2-CD2 4.26Å
354	T	87.1	Confident	80.9	Confident	32 Å²	32	64.6 Å²	64.6	20%	0.196	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	117.9	178.4	-55.5	0	0	0	0	109.3	V334 L362 T393	V334-T354 PolarHBondContact N-O 2.99Å; V334-T354 PolarHBondContact O-N 3.5Å; T354-L362 HydrophobicContact CG2-CD2 3.35Å; T354-T393 HydrophobicContact CG2-CG2 4.35Å
355	T	84.2	Confident	79.9	Confident	1 Å²	1	65.4 Å²	65.4	1%	0.006	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	141.8	180	56.6	0	0	0	0	112.3	A328 S333 V363 G392 Y394 L412	A328-T355 HydrophobicContact CB-CG2 4.09Å; S333-T355 WeakPolarHBondContact OG-CA 3.3Å; T355-V363 PolarHBondContact O-N 3Å; T355-V363 VanDerWaalsContact O-N 3.14Å; T355-G392 PolarHBondContact N-O 3.35Å; T355-G392 PolarHBondContact OG1-O 2.9Å; T355-Y394 HydrophobicContact CG2-CD2 3.89Å; T355-Y394 HydrophobicContact CG2-CE2 3.44Å; T355-Y394 VanDerWaalsContact CG2-CE2 3.44Å; T355-L412 HydrophobicContact CG2-CD1 4.09Å; T355-L412 HydrophobicContact CG2-CD2 4.18Å
356	K	81.9	Confident	79.1	Confident	56 Å²	56	64.2 Å²	64.2	24%	0.243	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	152.9	179.8	-69.2	-178.3	172.3	-167.9	0	111	V329 T332 S333 V334 G360 E361 L362	V329-K356 PolarHBondContact N-O 3.42Å; T332-K356 WeakPolarHBondContact O-CD 3.49Å; T332-K356 PolarHBondContact OG1-O 2.97Å; S333-K356 PolarHBondContact OG-N 3.36Å; V334-K356 HydrophobicContact CG2-CD 4.45Å; K356-G360 WeakPolarHBondContact CD-O 3.34Å; K356-E361 CarbonylContact C-O 3.6Å; K356-E361 WeakPolarHBondContact CA-O 3.36Å; K356-E361 WeakPolarHBondContact CB-O 3.34Å; K356-L362 HydrophobicContact CG-CD2 4.11Å
357	D	80.4	Confident	79	Confident	40 Å²	40	64.5 Å²	64.5	21%	0.214	33%	0.334	C	S	.	.			trans	-83.2	-173.4	175.5	70.7	12.7	0	0	0	112	G327 T332 D359 G360 E361 V363	G327-D357 WeakPolarHBondContact O-CA 3.42Å; T332-D357 WeakPolarHBondContact CB-O 3.35Å; T332-D357 WeakPolarHBondContact CG2-O 3.15Å; T332-D357 PolarHBondContact OG1-O 3.02Å; D357-D359 PolarHBondContact O-N 3.34Å; D357-D359 WeakPolarHBondContact OD1-CA 3.33Å; D357-D359 PolarHBondContact OD1-N 3.49Å; D357-G360 PolarHBondContact O-N 3.02Å; D357-G360 PolarHBondContact OD1-N 3.33Å; D357-E361 PolarHBondContact N-O 3.31Å; D357-E361 PolarHBondContact OD1-N 2.99Å; D357-V363 HydrophobicContact CB-CG2 4.21Å
358	K	78.3	Confident	78.9	Confident	147 Å²	147	59.3 Å²	59.3	64%	0.639	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-26	177.6	69.2	174.7	-177.1	61.7	0	113.7	G360	K358-G360 VanDerWaalsContact C-N 3.33Å
359	D	76.6	Confident	78.8	Confident	110 Å²	110	58.5 Å²	58.5	59%	0.588	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	-2.9	-177.4	-59.7	-49.4	0	0	0	111.1	D357 E361	D357-D359 PolarHBondContact O-N 3.34Å; D357-D359 WeakPolarHBondContact OD1-CA 3.33Å; D357-D359 PolarHBondContact OD1-N 3.49Å; D359-E361 VanDerWaalsContact C-N 3.32Å
360	G	68.7	Low	79	Confident	30 Å²	30	58.1 Å²	58.1	31%	0.309	31%	0.31	S	S	.	.	S	Bend	trans	84	8.2	180	0	0	0	0	0	113.8	K356 D357 K358	K356-G360 WeakPolarHBondContact CD-O 3.34Å; D357-G360 PolarHBondContact O-N 3.02Å; D357-G360 PolarHBondContact OD1-N 3.33Å; K358-G360 VanDerWaalsContact C-N 3.33Å
361	E	75.4	Confident	79.1	Confident	131 Å²	131	57.6 Å²	57.6	61%	0.612	30%	0.301	S	S	*	.	P	Polyproline II helix	trans	-79.2	153.7	176.2	-69.2	-63.4	144	0	0	110.7	K356 D357 D359 V363	K356-E361 CarbonylContact C-O 3.6Å; K356-E361 WeakPolarHBondContact CA-O 3.36Å; K356-E361 WeakPolarHBondContact CB-O 3.34Å; D357-E361 PolarHBondContact N-O 3.31Å; D357-E361 PolarHBondContact OD1-N 2.99Å; D359-E361 VanDerWaalsContact C-N 3.32Å; E361-V363 PolarHBondContact O-N 3.32Å
362	L	77.1	Confident	79	Confident	98 Å²	98	57.6 Å²	57.6	51%	0.513	30%	0.301	S	S	.	.	B	Isolated β-bridge	trans	-72	125.4	-179.1	-63.6	175.4	0	0	0	110.2	T354 K356	T354-L362 HydrophobicContact CG2-CD2 3.35Å; K356-L362 HydrophobicContact CG-CD2 4.11Å
363	V	77.1	Confident	79	Confident	15 Å²	15	57.6 Å²	57.6	9%	0.091	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-70.8	132.8	171	-179	0	0	0	0	107.8	A328 T355 D357 E361 S365 G392	A328-V363 HydrophobicContact CB-CG2 4.17Å; T355-V363 PolarHBondContact O-N 3Å; T355-V363 VanDerWaalsContact O-N 3.14Å; D357-V363 HydrophobicContact CB-CG2 4.21Å; E361-V363 PolarHBondContact O-N 3.32Å; V363-S365 WeakPolarHBondContact CG1-O 3.25Å; V363-G392 WeakPolarHBondContact O-CA 3.23Å
364	K	70.2	Confident	79	Confident	187 Å²	187	57.7 Å²	57.7	81%	0.813	30%	0.298	S	S	*	.			trans	-102.4	1.7	-175.9	-59.7	179	-176.2	174.6	0	113
365	S	63.3	Low	79	Confident	49 Å²	49	57.4 Å²	57.4	34%	0.343	30%	0.299	S	S	.	.			trans	-114.3	139.9	178.5	52	0	0	0	0	110.9	V363	V363-S365 WeakPolarHBondContact CG1-O 3.25Å
366	G	65.9	Low	78.8	Confident	4 Å²	4	58.6 Å²	58.6	4%	0.041	31%	0.307	C	S	.	.			trans	-81.9	-162	170.5	0	0	0	0	0	113.6	T326 Y394	T326-G366 WeakPolarHBondContact CG2-O 3.01Å; G366-Y394 WeakPolarHBondContact CA-OH 3.44Å
367	N	73.6	Confident	78.2	Confident	74 Å²	74	60.3 Å²	60.3	40%	0.396	33%	0.332	S	S	.	.			trans	70.4	25.4	-179.5	-49.3	-61.8	0	0	0	115.2	I324 D388 Y394	I324-N367 HydrophobicContact CG2-CB 4.07Å; N367-D388 PolarHBondContact N-OD2 3.49Å; N367-Y394 PolarHBondContact N-OH 3.5Å
368	A	79.5	Confident	77.6	Confident	8 Å²	8	65.3 Å²	65.3	7%	0.066	36%	0.359	C	S	.	.			trans	-79	135	167.8	0	0	0	0	0	109.4	T326 A328 L370 Y394 L412 Y413	T326-A368 HydrophobicContact CG2-CB 4.47Å; A328-A368 HydrophobicContact CB-CB 4Å; A368-L370 PolarHBondContact O-N 2.95Å; A368-Y394 WeakPolarHBondContact CA-OH 3.37Å; A368-Y394 HydrophobicContact CB-CE2 4.37Å; A368-Y394 WeakPolarHBondContact CB-OH 3.2Å; A368-Y394 PolarHBondContact N-OH 3.5Å; A368-Y394 WeakPolarHBondContact O-CE1 3.39Å; A368-L412 HydrophobicContact CB-CD1 3.8Å; A368-Y413 WeakPolarHBondContact CA-OH 3.24Å; A368-Y413 HydrophobicContact CB-CE2 4.18Å
369	V	81.6	Confident	76.8	Confident	89 Å²	89	61.2 Å²	61.2	54%	0.539	36%	0.358	S	S	.	.			trans	-77.1	98.6	-178.3	-178.7	0	0	0	0	108.1	Y413	V369-Y413 HydrophobicContact CB-CD1 3.87Å; V369-Y413 HydrophobicContact CB-CE1 3.82Å; V369-Y413 HydrophobicContact CG2-CD1 4.21Å; V369-Y413 HydrophobicContact CG2-CE1 3.76Å; V369-Y413 PolarHBondContact O-N 2.96Å
370	L	86.1	Confident	76.5	Confident	18 Å²	18	60.3 Å²	60.3	9%	0.094	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	122.7	177.5	-177.6	72.5	0	0	0	109.4	V353 A368 V386 Y394 V396 L411 L412 V417	V353-L370 HydrophobicContact CB-CD2 3.86Å; V353-L370 HydrophobicContact CG1-CD1 4.28Å; V353-L370 HydrophobicContact CG1-CD2 3.98Å; V353-L370 HydrophobicContact CG2-CD2 3.97Å; A368-L370 PolarHBondContact O-N 2.95Å; L370-V386 HydrophobicContact CB-CG1 4.25Å; L370-V386 HydrophobicContact CD2-CG1 3.92Å; L370-V386 HydrophobicContact CG-CG1 4.37Å; L370-Y394 HydrophobicContact CB-CD1 4.42Å; L370-Y394 HydrophobicContact CD2-CD1 4.35Å; L370-Y394 HydrophobicContact CD2-CD2 4.42Å; L370-Y394 HydrophobicContact CD2-CG 3.88Å; L370-V396 HydrophobicContact CD2-CG2 4.05Å; L370-L411 CarbonylContact C-O 3.5Å; L370-L411 WeakPolarHBondContact CA-O 3.29Å; L370-L412 HydrophobicContact CB-CD1 4.04Å; L370-L412 HydrophobicContact CD1-CB 4.27Å; L370-L412 HydrophobicContact CD1-CD1 3.95Å; L370-V417 HydrophobicContact CD1-CG2 4.14Å
371	K	87.9	Confident	76.5	Confident	68 Å²	68	62.8 Å²	62.8	30%	0.296	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	136.8	174.7	-163.6	-177.1	-170.5	-163.4	0	109.7	E373 E383 L411	K371-E373 HydrophobicContact CD-CG 4.44Å; K371-E373 WeakPolarHBondContact CD-OE1 3.41Å; K371-E373 WeakPolarHBondContact CE-OE1 3.25Å; K371-E373 HydrophobicContact CG-CG 4.42Å; K371-E373 IonicContact NZ-OE1 3.42Å; K371-E373 PolarHBondContact NZ-OE1 3.43Å; K371-E383 WeakPolarHBondContact CE-OE1 3.36Å; K371-E383 IonicContact NZ-OE1 3.77Å; K371-E383 PolarHBondContact NZ-OE1 3.32Å; K371-L411 HydrophobicContact CB-CB 4.3Å; K371-L411 PolarHBondContact N-O 2.92Å; K371-L411 PolarHBondContact O-N 3.34Å
372	A	88.1	Confident	76.5	Confident	2 Å²	2	59.9 Å²	59.9	2%	0.017	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	121.2	-179.2	0	0	0	0	0	110.3	A384 V386 V396 F408 S409 L410	A372-A384 HydrophobicContact CB-CB 3.84Å; A372-A384 PolarHBondContact O-N 2.93Å; A372-V386 HydrophobicContact CB-CG2 4.04Å; A372-V396 HydrophobicContact CB-CG1 3.52Å; A372-F408 HydrophobicContact CB-CE2 4.14Å; A372-F408 HydrophobicContact CB-CZ 4.2Å; A372-S409 WeakPolarHBondContact CA-O 3.29Å; A372-L410 HydrophobicContact CB-CD2 3.6Å
373	E	88.7	Confident	76.6	Confident	51 Å²	51	62 Å²	62	24%	0.238	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	132.9	-175.3	-63.3	-179.5	174.7	0	0	110.5	K371 F408 S409	K371-E373 HydrophobicContact CD-CG 4.44Å; K371-E373 WeakPolarHBondContact CD-OE1 3.41Å; K371-E373 WeakPolarHBondContact CE-OE1 3.25Å; K371-E373 HydrophobicContact CG-CG 4.42Å; K371-E373 IonicContact NZ-OE1 3.42Å; K371-E373 PolarHBondContact NZ-OE1 3.43Å; E373-F408 WeakPolarHBondContact O-CD2 3.48Å; E373-S409 PolarHBondContact N-O 3.37Å; E373-S409 PolarHBondContact O-N 3.38Å
374	I	87.7	Confident	76.8	Confident	2 Å²	2	62 Å²	62	1%	0.01	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	120	174.2	-57.7	157.9	0	0	0	108.4	C381 T382 A384 Y398 L400 F406 T407 F408	I374-C381 CarbonylContact O-C 3.54Å; I374-C381 VanDerWaalsContact O-CA 3.29Å; I374-C381 WeakPolarHBondContact O-CA 3.29Å; I374-T382 PolarHBondContact N-O 3.19Å; I374-T382 PolarHBondContact O-N 3.02Å; I374-T382 PolarHBondContact O-OG1 3.29Å; I374-A384 HydrophobicContact CD1-CB 4.41Å; I374-Y398 VanDerWaalsContact CD1-CB 3.5Å; I374-Y398 HydrophobicContact CD1-CD1 4.12Å; I374-Y398 HydrophobicContact CD1-CD2 3.52Å; I374-Y398 HydrophobicContact CD1-CE2 4.28Å; I374-Y398 HydrophobicContact CD1-CG 3.44Å; I374-Y398 VanDerWaalsContact CD1-CG 3.44Å; I374-L400 HydrophobicContact CD1-CD2 4.28Å; I374-L400 HydrophobicContact CG2-CD2 4.04Å; I374-F406 HydrophobicContact CG2-CB 3.9Å; I374-F406 HydrophobicContact CG2-CD1 3.98Å; I374-F406 HydrophobicContact CG2-CG 4.22Å; I374-T407 CarbonylContact C-O 3.6Å; I374-T407 WeakPolarHBondContact CA-O 3.35Å; I374-F408 HydrophobicContact CB-CD2 4.37Å; I374-F408 HydrophobicContact CD1-CD2 4.25Å; I374-F408 HydrophobicContact CD1-CE2 4.29Å; I374-F408 HydrophobicContact CG1-CD2 3.29Å; I374-F408 HydrophobicContact CG1-CE2 3.69Å; I374-F408 HydrophobicContact CG1-CG 4.35Å
375	A	86.8	Confident	77.5	Confident	26 Å²	26	59.9 Å²	59.9	22%	0.215	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	129.1	176.5	0	0	0	0	0	111.3	V380 F406 T407	A375-V380 WeakPolarHBondContact CA-O 3.42Å; A375-F406 CarbonylContact O-C 3.48Å; A375-F406 WeakPolarHBondContact O-CA 3.48Å; A375-T407 PolarHBondContact N-O 2.86Å; A375-T407 PolarHBondContact O-N 2.8Å
376	S	80.1	Confident	78.6	Confident	25 Å²	25	60 Å²	60	18%	0.175	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	161.2	167.6	-176.5	0	0	0	0	111.4	D378 G379 V380	S376-D378 PolarHBondContact O-N 3.28Å; S376-D378 VanDerWaalsContact O-N 3.12Å; S376-G379 PolarHBondContact O-N 3.43Å; S376-V380 PolarHBondContact N-O 3.21Å
377	A	70	Confident	79.6	Confident	93 Å²	93	63.7 Å²	63.7	77%	0.769	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-23.1	170	0	0	0	0	0	113.5	G379	A377-G379 VanDerWaalsContact C-N 3.34Å
378	D	66.8	Low	80.1	Confident	145 Å²	145	62.1 Å²	62.1	78%	0.775	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	2.7	176.4	-56.4	-44.9	0	0	0	113.9	S376	S376-D378 PolarHBondContact O-N 3.28Å; S376-D378 VanDerWaalsContact O-N 3.12Å
379	G	62.3	Low	80.1	Confident	60 Å²	60	64.6 Å²	64.6	62%	0.619	39%	0.385	S	S	*	.			trans	82.3	6.4	179	0	0	0	0	0	115.6	S376 A377 C381	S376-G379 PolarHBondContact O-N 3.43Å; A377-G379 VanDerWaalsContact C-N 3.34Å; G379-C381 PolarHBondContact O-N 3.38Å
380	V	69	Low	79.7	Confident	92 Å²	92	65.6 Å²	65.6	56%	0.558	38%	0.382	S	S	*	.			trans	-74.4	117.5	173.7	-179.4	0	0	0	0	109.5	A375 S376	A375-V380 WeakPolarHBondContact CA-O 3.42Å; S376-V380 PolarHBondContact N-O 3.21Å
381	C	69.3	Low	79.3	Confident	82 Å²	82	68.8 Å²	68.8	55%	0.554	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.2	125.5	174.1	-72.5	0	0	0	0	111.1	I374 G379	I374-C381 CarbonylContact O-C 3.54Å; I374-C381 VanDerWaalsContact O-CA 3.29Å; I374-C381 WeakPolarHBondContact O-CA 3.29Å; G379-C381 PolarHBondContact O-N 3.38Å
382	T	76.4	Confident	78.4	Confident	69 Å²	69	65.6 Å²	65.6	42%	0.423	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	127.4	168.6	52.8	0	0	0	0	109.5	I374	I374-T382 PolarHBondContact N-O 3.19Å; I374-T382 PolarHBondContact O-N 3.02Å; I374-T382 PolarHBondContact O-OG1 3.29Å
383	E	77.3	Confident	78.3	Confident	144 Å²	144	66.9 Å²	66.9	67%	0.673	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.6	139.3	172.4	-69.1	-171.9	156.4	0	0	110.3	K371	K371-E383 WeakPolarHBondContact CE-OE1 3.36Å; K371-E383 IonicContact NZ-OE1 3.77Å; K371-E383 PolarHBondContact NZ-OE1 3.32Å
384	A	82.3	Confident	78.1	Confident	14 Å²	14	64.6 Å²	64.6	12%	0.116	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-97	148.5	176.2	0	0	0	0	0	110.9	A372 I374 V396 F408	A372-A384 HydrophobicContact CB-CB 3.84Å; A372-A384 PolarHBondContact O-N 2.93Å; I374-A384 HydrophobicContact CD1-CB 4.41Å; A384-V396 HydrophobicContact CB-CG1 3.61Å; A384-F408 HydrophobicContact CB-CE2 4.4Å
385	E	84.4	Confident	78.2	Confident	142 Å²	142	68.4 Å²	68.4	66%	0.664	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.1	127.4	179.9	-68.2	177.5	-179.3	0	0	109.5	V396 G397	E385-V396 CarbonylContact O-C 3.59Å; E385-V396 VanDerWaalsContact O-CA 3.26Å; E385-V396 WeakPolarHBondContact O-CA 3.47Å; E385-G397 PolarHBondContact N-O 3.41Å; E385-G397 PolarHBondContact O-N 3.42Å
386	V	87.4	Confident	78.3	Confident	52 Å²	52	67.1 Å²	67.1	32%	0.315	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	120.1	179.7	-176.4	0	0	0	0	109.4	L370 A372 Y394 E395 V396	L370-V386 HydrophobicContact CB-CG1 4.25Å; L370-V386 HydrophobicContact CD2-CG1 3.92Å; L370-V386 HydrophobicContact CG-CG1 4.37Å; A372-V386 HydrophobicContact CB-CG2 4.04Å; V386-Y394 HydrophobicContact CG1-CD1 4.18Å; V386-E395 CarbonylContact C-O 3.53Å; V386-E395 WeakPolarHBondContact CA-O 3.47Å; V386-V396 HydrophobicContact CG1-CG2 4.34Å; V386-V396 HydrophobicContact CG2-CG1 4.27Å; V386-V396 HydrophobicContact CG2-CG2 4.08Å
387	V	86.4	Confident	78.6	Confident	82 Å²	82	66.3 Å²	66.3	50%	0.497	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	121.3	176.4	-178	0	0	0	0	108.7	Y394 E395	V387-Y394 CarbonylContact O-C 3.49Å; V387-Y394 VanDerWaalsContact O-CA 3.27Å; V387-Y394 WeakPolarHBondContact O-CA 3.28Å; V387-E395 HydrophobicContact CB-CB 4.31Å; V387-E395 PolarHBondContact N-O 3.49Å; V387-E395 PolarHBondContact O-N 3.37Å
388	D	83.6	Confident	79.4	Confident	41 Å²	41	62.3 Å²	62.3	22%	0.219	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	117.8	175.5	179.6	11.3	0	0	0	110.9	N367 K390 Y394	N367-D388 PolarHBondContact N-OD2 3.49Å; D388-K390 PolarHBondContact O-N 2.79Å; D388-K390 WeakPolarHBondContact OD1-CA 3.18Å; D388-K390 PolarHBondContact OD1-N 3.04Å; D388-Y394 HydrophobicContact CB-CD1 3.83Å; D388-Y394 HydrophobicContact CB-CE1 3.73Å; D388-Y394 VanDerWaalsContact CG-CE1 3.46Å
389	N	79.5	Confident	80.3	Confident	59 Å²	59	58.7 Å²	58.7	32%	0.316	34%	0.336	S	S	.	.			trans	-80.1	4.9	177.3	-67.2	-26.8	0	0	0	112.9	N391 T393 E395	N389-N391 PolarHBondContact O-N 2.75Å; N389-T393 WeakPolarHBondContact CB-O 3.49Å; N389-T393 PolarHBondContact N-O 2.85Å; N389-T393 PolarHBondContact ND2-OG1 3.15Å; N389-E395 PolarHBondContact ND2-OE1 3.01Å; N389-E395 VanDerWaalsContact ND2-OE1 3.17Å
390	K	74.5	Confident	81.2	Confident	110 Å²	110	56.1 Å²	56.1	48%	0.478	31%	0.308	S	S	.	.	S	Bend	trans	58.1	16	175.9	-55.6	-170.8	-177.2	179.4	0	115.6	D388 N473	D388-K390 PolarHBondContact O-N 2.79Å; D388-K390 WeakPolarHBondContact OD1-CA 3.18Å; D388-K390 PolarHBondContact OD1-N 3.04Å; K390-N473 WeakPolarHBondContact CB-ND2 3.28Å; K390-N473 VanDerWaalsContact CD-ND2 3.31Å; K390-N473 WeakPolarHBondContact CD-ND2 3.46Å
391	N	76.4	Confident	81.7	Confident	85 Å²	85	62.9 Å²	62.9	46%	0.455	32%	0.324	S	S	.	.	S	Bend	trans	-122.1	12.6	-178.6	65.5	1.8	0	0	0	112.6	N389 T393	N389-N391 PolarHBondContact O-N 2.75Å; N391-T393 WeakPolarHBondContact OD1-CB 3.32Å; N391-T393 PolarHBondContact OD1-N 3.17Å; N391-T393 PolarHBondContact OD1-OG1 3.41Å
392	G	70.6	Confident	82.1	Confident	1 Å²	1	62 Å²	62	1%	0.01	32%	0.318	C	S	.	.	S	Bend	trans	86.1	6.4	-172.9	0	0	0	0	0	114.7	T355 V363	T355-G392 PolarHBondContact N-O 3.35Å; T355-G392 PolarHBondContact OG1-O 2.9Å; V363-G392 WeakPolarHBondContact O-CA 3.23Å
393	T	84.4	Confident	82.3	Confident	30 Å²	30	63.2 Å²	63.2	18%	0.184	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	145.2	169.3	68.9	0	0	0	0	110.8	V353 T354 N389 N391	V353-T393 CarbonylContact O-C 3.56Å; V353-T393 VanDerWaalsContact O-CA 3.31Å; V353-T393 WeakPolarHBondContact O-CA 3.42Å; T354-T393 HydrophobicContact CG2-CG2 4.35Å; N389-T393 WeakPolarHBondContact CB-O 3.49Å; N389-T393 PolarHBondContact N-O 2.85Å; N389-T393 PolarHBondContact ND2-OG1 3.15Å; N391-T393 WeakPolarHBondContact OD1-CB 3.32Å; N391-T393 PolarHBondContact OD1-N 3.17Å; N391-T393 PolarHBondContact OD1-OG1 3.41Å
394	Y	86.1	Confident	82.5	Confident	3 Å²	3	58 Å²	58	1%	0.012	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	134.5	-179.2	-57.3	-101.3	0	0	0	108.1	T352 V353 T355 G366 N367 A368 L370 V386 V387 D388	T352-Y394 CarbonylContact C-O 3.5Å; T352-Y394 WeakPolarHBondContact CA-O 3.09Å; V353-Y394 PolarHBondContact N-O 2.92Å; V353-Y394 PolarHBondContact O-N 3.05Å; T355-Y394 HydrophobicContact CG2-CD2 3.89Å; T355-Y394 HydrophobicContact CG2-CE2 3.44Å; T355-Y394 VanDerWaalsContact CG2-CE2 3.44Å; G366-Y394 WeakPolarHBondContact CA-OH 3.44Å; N367-Y394 PolarHBondContact N-OH 3.5Å; A368-Y394 WeakPolarHBondContact CA-OH 3.37Å; A368-Y394 HydrophobicContact CB-CE2 4.37Å; A368-Y394 WeakPolarHBondContact CB-OH 3.2Å; A368-Y394 PolarHBondContact N-OH 3.5Å; A368-Y394 WeakPolarHBondContact O-CE1 3.39Å; L370-Y394 HydrophobicContact CB-CD1 4.42Å; L370-Y394 HydrophobicContact CD2-CD1 4.35Å; L370-Y394 HydrophobicContact CD2-CD2 4.42Å; L370-Y394 HydrophobicContact CD2-CG 3.88Å; V386-Y394 HydrophobicContact CG1-CD1 4.18Å; V387-Y394 CarbonylContact O-C 3.49Å; V387-Y394 VanDerWaalsContact O-CA 3.27Å; V387-Y394 WeakPolarHBondContact O-CA 3.28Å; D388-Y394 HydrophobicContact CB-CD1 3.83Å; D388-Y394 HydrophobicContact CB-CE1 3.73Å; D388-Y394 VanDerWaalsContact CG-CE1 3.46Å
395	E	87.8	Confident	82.5	Confident	81 Å²	81	62 Å²	62	38%	0.379	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	125.7	171.8	-76.6	176.9	-155.7	0	0	109.2	I351 V386 V387 N389	I351-E395 CarbonylContact O-C 3.59Å; I351-E395 WeakPolarHBondContact O-CA 3.49Å; V386-E395 CarbonylContact C-O 3.53Å; V386-E395 WeakPolarHBondContact CA-O 3.47Å; V387-E395 HydrophobicContact CB-CB 4.31Å; V387-E395 PolarHBondContact N-O 3.49Å; V387-E395 PolarHBondContact O-N 3.37Å; N389-E395 PolarHBondContact ND2-OE1 3.01Å; N389-E395 VanDerWaalsContact ND2-OE1 3.17Å
396	V	89.8	Confident	82.7	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	114.8	177	-173.7	0	0	0	0	108.4	T350 I351 V353 L370 A372 A384 E385 V386 F408 L410	T350-V396 WeakPolarHBondContact CA-O 3.31Å; I351-V396 HydrophobicContact CD1-CB 4.02Å; I351-V396 HydrophobicContact CG1-CB 3.64Å; I351-V396 HydrophobicContact CG1-CG1 4.47Å; I351-V396 HydrophobicContact CG1-CG2 4.41Å; I351-V396 WeakPolarHBondContact CG1-O 3.41Å; I351-V396 PolarHBondContact N-O 2.88Å; I351-V396 PolarHBondContact O-N 2.99Å; V353-V396 HydrophobicContact CG2-CG2 3.95Å; L370-V396 HydrophobicContact CD2-CG2 4.05Å; A372-V396 HydrophobicContact CB-CG1 3.52Å; A384-V396 HydrophobicContact CB-CG1 3.61Å; E385-V396 CarbonylContact O-C 3.59Å; E385-V396 VanDerWaalsContact O-CA 3.26Å; E385-V396 WeakPolarHBondContact O-CA 3.47Å; V386-V396 HydrophobicContact CG1-CG2 4.34Å; V386-V396 HydrophobicContact CG2-CG1 4.27Å; V386-V396 HydrophobicContact CG2-CG2 4.08Å; V396-F408 HydrophobicContact CG1-CZ 4.05Å; V396-L410 HydrophobicContact CG2-CD2 4.26Å
397	G	87	Confident	82.6	Confident	7 Å²	7	56.2 Å²	56.2	7%	0.072	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	134.9	-179.9	0	0	0	0	0	111.4	T349 E385	T349-G397 WeakPolarHBondContact O-CA 3.46Å; E385-G397 PolarHBondContact N-O 3.41Å; E385-G397 PolarHBondContact O-N 3.42Å
398	Y	86.9	Confident	82.7	Confident	10 Å²	10	52.3 Å²	52.3	4%	0.039	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	162.3	174.8	68.6	-93.5	0	0	0	112.5	G339 A343 T349 I374 L400 L424	G339-Y398 PolarHBondContact O-OH 2.53Å; A343-Y398 HydrophobicContact CB-CE2 4.06Å; T349-Y398 PolarHBondContact N-O 3.03Å; T349-Y398 PolarHBondContact O-N 3.23Å; I374-Y398 VanDerWaalsContact CD1-CB 3.5Å; I374-Y398 HydrophobicContact CD1-CD1 4.12Å; I374-Y398 HydrophobicContact CD1-CD2 3.52Å; I374-Y398 HydrophobicContact CD1-CE2 4.28Å; I374-Y398 HydrophobicContact CD1-CG 3.44Å; I374-Y398 VanDerWaalsContact CD1-CG 3.44Å; Y398-L400 HydrophobicContact CD2-CD2 4.19Å; Y398-L400 HydrophobicContact CD2-CG 4.05Å; Y398-L400 HydrophobicContact CE2-CD1 4.13Å; Y398-L400 HydrophobicContact CE2-CD2 4.39Å; Y398-L400 HydrophobicContact CE2-CG 3.95Å; Y398-L424 HydrophobicContact CE2-CD2 3.76Å; Y398-L424 VanDerWaalsContact OH-CD1 3.3Å; Y398-L424 WeakPolarHBondContact OH-CD1 3.42Å; Y398-L424 WeakPolarHBondContact OH-CD2 3.48Å
399	S	84	Confident	82.9	Confident	68 Å²	68	51.8 Å²	51.8	48%	0.476	27%	0.27	S	S	.	.			trans	-136.8	131.5	175	61.2	0	0	0	0	110.8
400	L	83.2	Confident	83.4	Confident	7 Å²	7	49 Å²	49	4%	0.037	26%	0.255	C	S	.	.			trans	-101.5	137.4	-179.8	-60.8	178.7	0	0	0	110.7	A343 G346 I374 Y398 F406 L424 A426	A343-L400 HydrophobicContact CB-CD1 3.93Å; G346-L400 PolarHBondContact N-O 2.6Å; I374-L400 HydrophobicContact CD1-CD2 4.28Å; I374-L400 HydrophobicContact CG2-CD2 4.04Å; Y398-L400 HydrophobicContact CD2-CD2 4.19Å; Y398-L400 HydrophobicContact CD2-CG 4.05Å; Y398-L400 HydrophobicContact CE2-CD1 4.13Å; Y398-L400 HydrophobicContact CE2-CD2 4.39Å; Y398-L400 HydrophobicContact CE2-CG 3.95Å; L400-F406 HydrophobicContact CD1-CD2 3.91Å; L400-F406 HydrophobicContact CD1-CE2 4.06Å; L400-F406 HydrophobicContact CD1-CG 4.44Å; L400-F406 HydrophobicContact CD2-CD1 4.45Å; L400-F406 HydrophobicContact CD2-CE1 4.47Å; L400-L424 HydrophobicContact CD1-CD2 3.85Å; L400-L424 HydrophobicContact CD1-CG 4.4Å; L400-A426 HydrophobicContact CB-CB 4.5Å; L400-A426 HydrophobicContact CD1-CB 3.68Å
401	R	78.6	Confident	84	Confident	234 Å²	234	45.2 Å²	45.2	88%	0.883	24%	0.24	S	C	*	.			trans	-100.3	-16.8	-176.6	-61.2	-172.6	-176.2	-155.6	1.5	114
402	S	77.9	Confident	84.4	Confident	62 Å²	62	41.3 Å²	41.3	43%	0.434	22%	0.219	S	C	.	.	S	Bend	trans	-130.1	149.9	-179.4	49.4	0	0	0	0	111.4	F406	S402-F406 WeakPolarHBondContact O-CE2 3.39Å; S402-F406 WeakPolarHBondContact O-CZ 3.31Å
403	E	80	Confident	84.9	Confident	95 Å²	95	45.2 Å²	45.2	44%	0.444	23%	0.234	S	C	.	.			trans	-71.2	147.4	166.5	-82.1	134.5	-109.1	0	0	111	V345 K428	V345-E403 HydrophobicContact CG2-CG 3.91Å; E403-K428 HydrophobicContact CG-CG 4.07Å; E403-K428 WeakPolarHBondContact OE1-CD 3.43Å; E403-K428 WeakPolarHBondContact OE1-CE 3.32Å; E403-K428 WeakPolarHBondContact OE1-CG 3.48Å; E403-K428 IonicContact OE1-NZ 3.96Å; E403-K428 WeakPolarHBondContact OE2-CE 3.35Å
404	G	81.5	Confident	84.7	Confident	34 Å²	34	50.1 Å²	50.1	35%	0.351	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	152.4	-173.8	176.4	0	0	0	0	0	112.8	A426	G404-A426 PolarHBondContact O-N 2.84Å
405	E	83.4	Confident	84.4	Confident	100 Å²	100	53.3 Å²	53.3	47%	0.467	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	128.2	171.8	-168.1	169.6	-165.9	0	0	109.4	R423	E405-R423 IonicContact OE1-CZ 3.93Å; E405-R423 IonicContact OE1-NE 3.44Å; E405-R423 PolarHBondContact OE1-NE 3.48Å; E405-R423 IonicContact OE1-NH2 3.61Å; E405-R423 PolarHBondContact OE1-NH2 2.98Å; E405-R423 IonicContact OE2-NH2 3.95Å; E405-R423 PolarHBondContact OE2-NH2 2.76Å
406	F	86.9	Confident	84.3	Confident	11 Å²	11	52.9 Å²	52.9	5%	0.048	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	151.7	-178.8	-63.1	-92.5	0	0	0	109.9	I374 A375 L400 S402 L424 A426	I374-F406 HydrophobicContact CG2-CB 3.9Å; I374-F406 HydrophobicContact CG2-CD1 3.98Å; I374-F406 HydrophobicContact CG2-CG 4.22Å; A375-F406 CarbonylContact O-C 3.48Å; A375-F406 WeakPolarHBondContact O-CA 3.48Å; L400-F406 HydrophobicContact CD1-CD2 3.91Å; L400-F406 HydrophobicContact CD1-CE2 4.06Å; L400-F406 HydrophobicContact CD1-CG 4.44Å; L400-F406 HydrophobicContact CD2-CD1 4.45Å; L400-F406 HydrophobicContact CD2-CE1 4.47Å; S402-F406 WeakPolarHBondContact O-CE2 3.39Å; S402-F406 WeakPolarHBondContact O-CZ 3.31Å; F406-L424 HydrophobicContact CB-CB 4.25Å; F406-L424 HydrophobicContact CB-CD2 4.38Å; F406-L424 PolarHBondContact N-O 3.31Å; F406-L424 PolarHBondContact O-N 3.35Å; F406-A426 HydrophobicContact CD2-CB 4.09Å; F406-A426 HydrophobicContact CE2-CB 3.69Å
407	T	87	Confident	84.2	Confident	61 Å²	61	53 Å²	53	37%	0.374	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	123.6	172.8	-54.9	0	0	0	0	108.5	I374 A375 P421	I374-T407 CarbonylContact C-O 3.6Å; I374-T407 WeakPolarHBondContact CA-O 3.35Å; A375-T407 PolarHBondContact N-O 2.86Å; A375-T407 PolarHBondContact O-N 2.8Å; T407-P421 HydrophobicContact CG2-CB 3.56Å; T407-P421 HydrophobicContact CG2-CG 4.25Å
408	F	88.4	Confident	84.1	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	111.9	-178	-177.5	-121.6	0	0	0	111.4	L340 I351 A372 E373 I374 A384 V396 L410 P421 F422	L340-F408 HydrophobicContact CD2-CD1 3.91Å; L340-F408 HydrophobicContact CD2-CE1 3.89Å; I351-F408 HydrophobicContact CD1-CD1 4.35Å; I351-F408 HydrophobicContact CD1-CE1 3.22Å; I351-F408 HydrophobicContact CD1-CZ 3.6Å; A372-F408 HydrophobicContact CB-CE2 4.14Å; A372-F408 HydrophobicContact CB-CZ 4.2Å; E373-F408 WeakPolarHBondContact O-CD2 3.48Å; I374-F408 HydrophobicContact CB-CD2 4.37Å; I374-F408 HydrophobicContact CD1-CD2 4.25Å; I374-F408 HydrophobicContact CD1-CE2 4.29Å; I374-F408 HydrophobicContact CG1-CD2 3.29Å; I374-F408 HydrophobicContact CG1-CE2 3.69Å; I374-F408 HydrophobicContact CG1-CG 4.35Å; A384-F408 HydrophobicContact CB-CE2 4.4Å; V396-F408 HydrophobicContact CG1-CZ 4.05Å; F408-L410 HydrophobicContact CD1-CG 4.35Å; F408-L410 HydrophobicContact CE1-CD1 3.85Å; F408-L410 HydrophobicContact CE1-CD2 3.78Å; F408-L410 HydrophobicContact CE1-CG 3.64Å; F408-L410 HydrophobicContact CE2-CD2 4.43Å; F408-L410 HydrophobicContact CZ-CD1 4.5Å; F408-L410 HydrophobicContact CZ-CD2 3.59Å; F408-L410 HydrophobicContact CZ-CG 3.97Å; F408-P421 WeakPolarHBondContact O-CA 3.39Å; F408-F422 HydrophobicContact CB-CB 4.4Å; F408-F422 HydrophobicContact CD1-CD2 4.3Å; F408-F422 PolarHBondContact N-O 3.17Å; F408-F422 PolarHBondContact O-N 2.94Å
409	S	87.9	Confident	83.7	Confident	30 Å²	30	62.7 Å²	62.7	21%	0.21	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	119.5	-174.9	-64.4	0	0	0	0	110.6	A372 E373	A372-S409 WeakPolarHBondContact CA-O 3.29Å; E373-S409 PolarHBondContact N-O 3.37Å; E373-S409 PolarHBondContact O-N 3.38Å
410	L	88.3	Confident	83.8	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	122.6	170	-69.6	173.6	0	0	0	109.7	A335 L340 I351 V353 A372 V396 F408 P416 V417 S420 F422	A335-L410 HydrophobicContact CB-CD1 3.43Å; A335-L410 VanDerWaalsContact CB-CD1 3.43Å; L340-L410 HydrophobicContact CD2-CD1 4.46Å; I351-L410 HydrophobicContact CD1-CD1 4.12Å; V353-L410 HydrophobicContact CG2-CD1 3.68Å; V353-L410 HydrophobicContact CG2-CD2 4.26Å; A372-L410 HydrophobicContact CB-CD2 3.6Å; V396-L410 HydrophobicContact CG2-CD2 4.26Å; F408-L410 HydrophobicContact CD1-CG 4.35Å; F408-L410 HydrophobicContact CE1-CD1 3.85Å; F408-L410 HydrophobicContact CE1-CD2 3.78Å; F408-L410 HydrophobicContact CE1-CG 3.64Å; F408-L410 HydrophobicContact CE2-CD2 4.43Å; F408-L410 HydrophobicContact CZ-CD1 4.5Å; F408-L410 HydrophobicContact CZ-CD2 3.59Å; F408-L410 HydrophobicContact CZ-CG 3.97Å; L410-P416 WeakPolarHBondContact O-CA 3.43Å; L410-V417 HydrophobicContact CB-CB 4.06Å; L410-V417 HydrophobicContact CB-CG2 4.01Å; L410-V417 PolarHBondContact O-N 3.07Å; L410-S420 PolarHBondContact N-OG 2.9Å; L410-S420 WeakPolarHBondContact O-CB 3.33Å; L410-S420 PolarHBondContact O-OG 2.98Å; L410-S420 VanDerWaalsContact O-OG 3.07Å; L410-F422 HydrophobicContact CD1-CE2 4.03Å
411	L	87.3	Confident	83.9	Confident	31 Å²	31	64 Å²	64	16%	0.162	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	118.9	-175.5	-65.8	156.3	0	0	0	109.4	L370 K371 Q415	L370-L411 CarbonylContact C-O 3.5Å; L370-L411 WeakPolarHBondContact CA-O 3.29Å; K371-L411 HydrophobicContact CB-CB 4.3Å; K371-L411 PolarHBondContact N-O 2.92Å; K371-L411 PolarHBondContact O-N 3.34Å; L411-Q415 CarbonylContact C-O 3.52Å; L411-Q415 WeakPolarHBondContact CA-O 3.49Å
412	L	84.8	Confident	84.3	Confident	2 Å²	2	54.7 Å²	54.7	1%	0.01	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	117	172.9	-169.9	78	0	0	0	108.6	A328 T355 A368 L370 E414 Q415 V417	A328-L412 HydrophobicContact CB-CD2 3.88Å; T355-L412 HydrophobicContact CG2-CD1 4.09Å; T355-L412 HydrophobicContact CG2-CD2 4.18Å; A368-L412 HydrophobicContact CB-CD1 3.8Å; L370-L412 HydrophobicContact CB-CD1 4.04Å; L370-L412 HydrophobicContact CD1-CB 4.27Å; L370-L412 HydrophobicContact CD1-CD1 3.95Å; L412-E414 VanDerWaalsContact C-N 3.29Å; L412-E414 PolarHBondContact O-N 3.2Å; L412-Q415 PolarHBondContact N-O 3.02Å; L412-Q415 WeakPolarHBondContact O-CB 3.36Å; L412-Q415 PolarHBondContact O-N 3.41Å; L412-V417 HydrophobicContact CB-CG2 4.02Å
413	Y	81.6	Confident	84.7	Confident	83 Å²	83	60.3 Å²	60.3	33%	0.325	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.7	48	-172.3	-60.3	-67.9	0	0	0	112.8	T326 A368 V369 Q415	T326-Y413 PolarHBondContact OG1-OH 2.74Å; A368-Y413 WeakPolarHBondContact CA-OH 3.24Å; A368-Y413 HydrophobicContact CB-CE2 4.18Å; V369-Y413 HydrophobicContact CB-CD1 3.87Å; V369-Y413 HydrophobicContact CB-CE1 3.82Å; V369-Y413 HydrophobicContact CG2-CD1 4.21Å; V369-Y413 HydrophobicContact CG2-CE1 3.76Å; V369-Y413 PolarHBondContact O-N 2.96Å; Y413-Q415 PolarHBondContact O-N 3.46Å; Y413-Q415 VanDerWaalsContact O-N 3.13Å
414	E	79.8	Confident	85	Confident	134 Å²	134	55.8 Å²	55.8	63%	0.626	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.6	11.4	-176.5	-54.2	-58.1	128.3	0	0	115	L412	L412-E414 VanDerWaalsContact C-N 3.29Å; L412-E414 PolarHBondContact O-N 3.2Å
415	Q	80.7	Confident	85.2	Confident	70 Å²	70	61.9 Å²	61.9	33%	0.327	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	138.2	175	-63.8	-164.4	-6.1	0	0	111.9	L411 L412 Y413 V417	L411-Q415 CarbonylContact C-O 3.52Å; L411-Q415 WeakPolarHBondContact CA-O 3.49Å; L412-Q415 PolarHBondContact N-O 3.02Å; L412-Q415 WeakPolarHBondContact O-CB 3.36Å; L412-Q415 PolarHBondContact O-N 3.41Å; Y413-Q415 PolarHBondContact O-N 3.46Å; Y413-Q415 VanDerWaalsContact O-N 3.13Å; Q415-V417 PolarHBondContact O-N 2.94Å
416	P	85.3	Confident	85.2	Confident	71 Å²	71	57.3 Å²	57.3	46%	0.461	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	136.8	-178	26	-33.4	0	0	0	111.9	G330 L410	G330-P416 CarbonylContact C-O 3.59Å; L410-P416 WeakPolarHBondContact O-CA 3.43Å
417	V	87.9	Confident	85	Confident	2 Å²	2	58.7 Å²	58.7	1%	0.012	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-70.1	155.1	172	-179.8	0	0	0	0	110.1	G330 S333 L370 L410 L412 Q415 G419 S420	G330-V417 VanDerWaalsContact O-CA 3.3Å; G330-V417 WeakPolarHBondContact O-CA 3.48Å; S333-V417 WeakPolarHBondContact O-CG1 3.27Å; L370-V417 HydrophobicContact CD1-CG2 4.14Å; L410-V417 HydrophobicContact CB-CB 4.06Å; L410-V417 HydrophobicContact CB-CG2 4.01Å; L410-V417 PolarHBondContact O-N 3.07Å; L412-V417 HydrophobicContact CB-CG2 4.02Å; Q415-V417 PolarHBondContact O-N 2.94Å; V417-G419 PolarHBondContact O-N 2.97Å; V417-G419 VanDerWaalsContact O-N 3.09Å; V417-S420 WeakPolarHBondContact O-CB 3.23Å; V417-S420 PolarHBondContact O-N 2.85Å
418	R	84.4	Confident	84.5	Confident	170 Å²	170	60.4 Å²	60.4	64%	0.642	29%	0.292	S	S	*	.	B	Isolated β-bridge	trans	-55.3	119.6	-179.6	-169.2	178.6	175.4	177.2	-0.2	111.8	G330 S333	G330-R418 PolarHBondContact O-N 2.98Å; S333-R418 WeakPolarHBondContact O-CB 3.38Å; S333-R418 PolarHBondContact O-N 3.49Å
419	G	79.4	Confident	83.4	Confident	51 Å²	51	64.8 Å²	64.8	53%	0.526	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.6	-4.6	-178.8	0	0	0	0	0	114.7	V417 P421 F422	V417-G419 PolarHBondContact O-N 2.97Å; V417-G419 VanDerWaalsContact O-N 3.09Å; G419-P421 CarbonylContact O-C 3.5Å; G419-F422 WeakPolarHBondContact O-CD1 3.46Å; G419-F422 WeakPolarHBondContact O-CE1 3.37Å
420	S	85.3	Confident	81.9	Confident	20 Å²	20	67.9 Å²	67.9	14%	0.14	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-78.2	138.1	172	-173.7	0	0	0	0	110.6	L410 V417	L410-S420 PolarHBondContact N-OG 2.9Å; L410-S420 WeakPolarHBondContact O-CB 3.33Å; L410-S420 PolarHBondContact O-OG 2.98Å; L410-S420 VanDerWaalsContact O-OG 3.07Å; V417-S420 WeakPolarHBondContact O-CB 3.23Å; V417-S420 PolarHBondContact O-N 2.85Å
421	P	85.9	Confident	80.5	Confident	83 Å²	83	73.6 Å²	73.6	54%	0.539	37%	0.373	S	S	.	.	S	Bend	cis	-79.6	144.2	-1.2	31.5	-34.3	0	0	0	113.5	T407 F408 G419	T407-P421 HydrophobicContact CG2-CB 3.56Å; T407-P421 HydrophobicContact CG2-CG 4.25Å; F408-P421 WeakPolarHBondContact O-CA 3.39Å; G419-P421 CarbonylContact O-C 3.5Å
422	F	86.8	Confident	78.7	Confident	38 Å²	38	76.4 Å²	76.4	17%	0.167	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	144.1	177.8	-59.7	-87.2	0	0	0	111.4	A335 L340 F408 L410 G419	A335-F422 HydrophobicContact CB-CE2 4.27Å; A335-F422 HydrophobicContact CB-CZ 4.12Å; L340-F422 HydrophobicContact CD2-CD1 4.44Å; L340-F422 HydrophobicContact CD2-CD2 4Å; L340-F422 HydrophobicContact CD2-CE2 4.19Å; L340-F422 HydrophobicContact CD2-CG 4.14Å; L340-F422 HydrophobicContact CD2-CZ 4.48Å; F408-F422 HydrophobicContact CB-CB 4.4Å; F408-F422 HydrophobicContact CD1-CD2 4.3Å; F408-F422 PolarHBondContact N-O 3.17Å; F408-F422 PolarHBondContact O-N 2.94Å; L410-F422 HydrophobicContact CD1-CE2 4.03Å; G419-F422 WeakPolarHBondContact O-CD1 3.46Å; G419-F422 WeakPolarHBondContact O-CE1 3.37Å
423	R	86.6	Confident	76.8	Confident	180 Å²	180	84.2 Å²	84.2	68%	0.679	43%	0.432	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.8	118.2	172.5	-67.9	178.1	70.4	173.2	5.9	109.7	E405	E405-R423 IonicContact OE1-CZ 3.93Å; E405-R423 IonicContact OE1-NE 3.44Å; E405-R423 PolarHBondContact OE1-NE 3.48Å; E405-R423 IonicContact OE1-NH2 3.61Å; E405-R423 PolarHBondContact OE1-NH2 2.98Å; E405-R423 IonicContact OE2-NH2 3.95Å; E405-R423 PolarHBondContact OE2-NH2 2.76Å
424	L	85.6	Confident	74.7	Confident	0 Å²	0	89.5 Å²	89.5	0%	0	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	129.6	-174.4	178.3	65.3	0	0	0	110.4	A343 Y398 L400 F406	A343-L424 HydrophobicContact CB-CD1 4.1Å; Y398-L424 HydrophobicContact CE2-CD2 3.76Å; Y398-L424 VanDerWaalsContact OH-CD1 3.3Å; Y398-L424 WeakPolarHBondContact OH-CD1 3.42Å; Y398-L424 WeakPolarHBondContact OH-CD2 3.48Å; L400-L424 HydrophobicContact CD1-CD2 3.85Å; L400-L424 HydrophobicContact CD1-CG 4.4Å; F406-L424 HydrophobicContact CB-CB 4.25Å; F406-L424 HydrophobicContact CB-CD2 4.38Å; F406-L424 PolarHBondContact N-O 3.31Å; F406-L424 PolarHBondContact O-N 3.35Å
425	R	85.1	Confident	72.5	Confident	162 Å²	162	88.1 Å²	88.1	61%	0.611	47%	0.465	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.1	123.8	177.1	-170.7	178.3	-179.7	-173.8	-0.4	111.2	R341 H342 A343 V427	R341-R425 PolarHBondContact O-N 3.12Å; H342-R425 WeakPolarHBondContact CA-O 3.4Å; A343-R425 PolarHBondContact N-O 3.38Å; R425-V427 HydrophobicContact CG-CG1 4.36Å
426	A	83.9	Confident	70.6	Confident	5 Å²	5	90.6 Å²	90.6	4%	0.041	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	128.4	176.3	0	0	0	0	0	111.5	A343 V345 L400 G404 F406	A343-A426 VanDerWaalsContact O-CA 3.31Å; A343-A426 WeakPolarHBondContact O-CA 3.35Å; V345-A426 HydrophobicContact CG2-CB 3.94Å; L400-A426 HydrophobicContact CB-CB 4.5Å; L400-A426 HydrophobicContact CD1-CB 3.68Å; G404-A426 PolarHBondContact O-N 2.84Å; F406-A426 HydrophobicContact CD2-CB 4.09Å; F406-A426 HydrophobicContact CE2-CB 3.69Å
427	V	83.5	Confident	68.1	Low	39 Å²	39	96 Å²	96	24%	0.236	51%	0.506	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	154.4	-177	-64.9	0	0	0	0	112.2	A343 V344 V345 R425	A343-V427 PolarHBondContact O-N 3.47Å; V344-V427 WeakPolarHBondContact CA-O 3.35Å; V345-V427 PolarHBondContact N-O 3.02Å; R425-V427 HydrophobicContact CG-CG1 4.36Å
428	K	76.8	Confident	65.5	Low	98 Å²	98	103.8 Å²	103.8	43%	0.426	55%	0.548	S	S	.	.			trans	-70.8	150.2	174.7	-71.8	-169.3	179.8	173.5	0	111.7	E403 S430 D431	E403-K428 HydrophobicContact CG-CG 4.07Å; E403-K428 WeakPolarHBondContact OE1-CD 3.43Å; E403-K428 WeakPolarHBondContact OE1-CE 3.32Å; E403-K428 WeakPolarHBondContact OE1-CG 3.48Å; E403-K428 IonicContact OE1-NZ 3.96Å; E403-K428 WeakPolarHBondContact OE2-CE 3.35Å; K428-S430 PolarHBondContact O-N 3.27Å; K428-S430 VanDerWaalsContact O-N 3.09Å; K428-D431 PolarHBondContact O-N 2.92Å
429	P	65.3	Low	63.1	Low	91 Å²	91	102.3 Å²	102.3	59%	0.591	56%	0.557	S	S	*	*	G	3₁₀ helix	trans	-56	-25.9	173.5	-22.3	30.4	0	0	0	114.3	V344 D431	V344-P429 HydrophobicContact CG1-CB 4.28Å; V344-P429 HydrophobicContact CG1-CG 3.83Å; P429-D431 VanDerWaalsContact C-N 3.33Å; P429-D431 PolarHBondContact O-N 3.29Å
430	S	56.8	Low	60.8	Low	96 Å²	96	109.8 Å²	109.8	67%	0.671	58%	0.575	S	S	*	*	G	3₁₀ helix	trans	-75.8	-13.1	-177.6	43	0	0	0	0	115.1	K428	K428-S430 PolarHBondContact O-N 3.27Å; K428-S430 VanDerWaalsContact O-N 3.09Å
431	D	57.3	Low	58.4	Low	120 Å²	120	120.7 Å²	120.7	64%	0.642	61%	0.613	S	S	*	*	G	3₁₀ helix	trans	-106.5	8.6	-176.1	-66.4	-33.9	0	0	0	113.7	K428 P429 L433	K428-D431 PolarHBondContact O-N 2.92Å; P429-D431 VanDerWaalsContact C-N 3.33Å; P429-D431 PolarHBondContact O-N 3.29Å; D431-L433 PolarHBondContact O-N 3.46Å; D431-L433 VanDerWaalsContact O-N 3.16Å
432	V	50.8	Low	55.7	Low	90 Å²	90	128.1 Å²	128.1	55%	0.545	63%	0.631	S	S	.	*			trans	-78.5	101.3	177.2	-174.2	0	0	0	0	109.4	Q434	V432-Q434 PolarHBondContact O-N 3.17Å
433	L	43.3	Very low	52.9	Low	166 Å²	166	132.2 Å²	132.2	87%	0.869	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-56.5	125.6	168.5	-78.7	162	0	0	0	109.9	D431 S435	D431-L433 PolarHBondContact O-N 3.46Å; D431-L433 VanDerWaalsContact O-N 3.16Å; L433-S435 PolarHBondContact O-N 3.29Å
434	Q	39	Very low	50	Low	194 Å²	194	133 Å²	133	91%	0.907	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-58.9	124.5	175.4	-74.7	175.2	-24.6	0	0	111	V432	V432-Q434 PolarHBondContact O-N 3.17Å
435	S	33	Very low	47.3	Very low	104 Å²	104	138.6 Å²	138.6	73%	0.727	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-66.5	144	170.2	173.9	0	0	0	0	111.1	L433 E437	L433-S435 PolarHBondContact O-N 3.29Å; S435-E437 PolarHBondContact O-N 3.16Å
436	P	40.1	Very low	44.8	Very low	123 Å²	123	136.4 Å²	136.4	80%	0.799	71%	0.713	S	S	*	*	S	Bend	trans	-86.2	90	-171	34	-33.1	0	0	0	112.4
437	E	34.3	Very low	42.1	Very low	183 Å²	183	142 Å²	142	86%	0.855	75%	0.752	S	S	*	*			trans	-127.5	-3.6	162.7	-80.4	-131.4	142.2	0	0	115.7	S435	S435-E437 PolarHBondContact O-N 3.16Å
438	D	32.9	Very low	39.4	Very low	167 Å²	167	144.2 Å²	144.2	89%	0.893	78%	0.782	S	S	*	*	S	Bend	trans	-112.1	28.9	-170.8	-88.4	-42.7	0	0	0	117.3
439	V	33.6	Very low	37	Very low	138 Å²	138	143.6 Å²	143.6	84%	0.836	80%	0.804	S	S	*	*			trans	-139.4	89.6	170.5	-169.9	0	0	0	0	112.3
440	K	31.4	Very low	35.2	Very low	208 Å²	208	143.5 Å²	143.5	90%	0.904	82%	0.819	S	S	*	*			trans	-166.5	70.1	146.4	-105.5	163.5	-169	-178.7	0	112.8
441	R	34.6	Very low	33.8	Very low	250 Å²	250	142.5 Å²	142.5	94%	0.943	82%	0.824	S	S	*	*			trans	-118.2	77.4	147.6	-84.2	-169.5	-174.6	177.5	4.5	109.8
442	R	28.1	Very low	32.5	Very low	238 Å²	238	146.1 Å²	146.1	90%	0.898	84%	0.836	S	S	*	*			trans	179.6	137.4	141.7	-120.3	172.6	-176.2	165.2	1.7	112.7
443	V	28.8	Very low	31.5	Very low	124 Å²	124	148.2 Å²	148.2	75%	0.752	85%	0.849	S	S	*	*			trans	97.7	102.8	159.5	-166.3	0	0	0	0	118.5
444	K	26.7	Very low	31	Very low	198 Å²	198	151.8 Å²	151.8	86%	0.861	85%	0.851	S	S	*	*			trans	39.9	125.6	136	-62.1	-177.1	175.8	-179.5	0	121
445	S	28.2	Very low	30.6	Very low	116 Å²	116	151.5 Å²	151.5	81%	0.811	85%	0.85	S	S	*	*			trans	-53.8	151	158.3	-37.9	0	0	0	0	112.8
446	P	32.1	Very low	30.3	Very low	117 Å²	117	156.2 Å²	156.2	76%	0.76	86%	0.857	S	S	*	*				-142.5	147.9	94.3	31.7	-13.2	0	0	0	116.1
447	S	27.3	Very low	29.6	Very low	123 Å²	123	155 Å²	155	86%	0.86	86%	0.857	S	S	*	*			trans	35.6	122.7	136.7	-33.4	0	0	0	0	122
448	G	26.9	Very low	29.3	Very low	85 Å²	85	152.9 Å²	152.9	88%	0.876	86%	0.857	S	S	*	*				116.2	127.3	129.4	0	0	0	0	0	117.7
449	G	26.3	Very low	29.1	Very low	85 Å²	85	156.1 Å²	156.1	88%	0.876	86%	0.856	S	S	*	*			trans	120.3	96	155.7	0	0	0	0	0	115.1
450	G	28.2	Very low	28.9	Very low	88 Å²	88	160.8 Å²	160.8	91%	0.907	86%	0.859	S	S	*	*			trans	-71	161.7	177	0	0	0	0	0	114.5
451	G	27.2	Very low	28.8	Very low	75 Å²	75	157 Å²	157	77%	0.773	86%	0.855	S	S	*	*			trans	-174.8	90.5	171.5	0	0	0	0	0	110.6	V453	G451-V453 PolarHBondContact O-N 3.02Å
452	H	30.3	Very low	28.4	Very low	196 Å²	196	150.5 Å²	150.5	91%	0.907	85%	0.848	S	S	*	*			trans	-62.6	126.1	172.4	-86.3	-71.8	0	0	0	111.3
453	V	30.2	Very low	28.4	Very low	135 Å²	135	145.1 Å²	145.1	82%	0.818	85%	0.847	S	S	*	*			trans	-129.8	112.8	153.7	-179.3	0	0	0	0	108.6	G451 Q455	G451-V453 PolarHBondContact O-N 3.02Å; V453-Q455 PolarHBondContact O-N 3.17Å
454	R	31	Very low	28.4	Very low	241 Å²	241	147.2 Å²	147.2	91%	0.909	85%	0.851	S	S	*	*			trans	-66.1	120.5	172.1	-81.7	171.1	157.5	169.5	-6.2	109.5
455	Q	31.3	Very low	28.5	Very low	188 Å²	188	148.1 Å²	148.1	88%	0.879	85%	0.85	S	S	*	*			trans	-105.2	123.5	155.5	-84.5	-174	-13.2	0	0	109.8	V453 A457	V453-Q455 PolarHBondContact O-N 3.17Å; Q455-A457 PolarHBondContact O-N 2.87Å
456	K	26.5	Very low	28.9	Very low	203 Å²	203	147.3 Å²	147.3	88%	0.883	85%	0.845	S	S	*	*			trans	-63.3	118.3	179.7	-75.7	173	172.3	175	0	109.6	V458	K456-V458 PolarHBondContact O-N 3.17Å
457	A	26.2	Very low	28.6	Very low	96 Å²	96	147.9 Å²	147.9	79%	0.793	85%	0.846	S	S	*	*			trans	-63.1	117.1	163.7	0	0	0	0	0	109.4	Q455 R459	Q455-A457 PolarHBondContact O-N 2.87Å; A457-R459 PolarHBondContact O-N 2.75Å
458	V	28.3	Very low	29.1	Very low	140 Å²	140	147.7 Å²	147.7	85%	0.848	84%	0.84	S	S	*	*			trans	-70.1	114.9	167.3	175.5	0	0	0	0	107.3	K456 R460	K456-V458 PolarHBondContact O-N 3.17Å; V458-R460 PolarHBondContact O-N 3.3Å
459	R	27.1	Very low	29.2	Very low	234 Å²	234	153.5 Å²	153.5	88%	0.883	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-60	122.6	174.5	-70.1	175.3	171.1	176.9	-4.5	109.4	A457	A457-R459 PolarHBondContact O-N 2.75Å
460	R	31.1	Very low	30	Very low	237 Å²	237	157.7 Å²	157.7	89%	0.894	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-69.1	133.9	161.6	-73.1	-179.1	178.2	167.9	-1.3	108.5	V458	V458-R460 PolarHBondContact O-N 3.3Å
461	P	27.8	Very low	30	Very low	128 Å²	128	163.2 Å²	163.2	83%	0.831	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-72.9	147.2	173.5	24.7	-23.7	0	0	0	111.1
462	S	26.2	Very low	30.1	Very low	113 Å²	113	166.2 Å²	166.2	79%	0.79	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-66.1	132.2	-175.8	-34.2	0	0	0	0	112.1	M464	S462-M464 PolarHBondContact O-N 2.8Å
463	S	28.2	Very low	30	Very low	125 Å²	125	160.2 Å²	160.2	87%	0.874	80%	0.802	S	S	*	*			trans	-74	109.4	172	56.3	0	0	0	0	110.6
464	M	28.9	Very low	30.3	Very low	169 Å²	169	160 Å²	160	83%	0.833	80%	0.804	S	S	*	*			trans	-100.2	124.5	168.2	-72.2	-125.2	-53.8	0	0	110.4	S462	S462-M464 PolarHBondContact O-N 2.8Å
465	Y	29.9	Very low	30.6	Very low	217 Å²	217	153.4 Å²	153.4	85%	0.851	79%	0.786	S	S	*	*			trans	50.5	104.4	155.5	-91.6	-94.5	0	0	0	120.5
466	S	36.3	Very low	31.2	Very low	99 Å²	99	152.3 Å²	152.3	69%	0.692	78%	0.781	S	S	*	*				8.1	121.9	126.2	163	0	0	0	0	117.8
467	T	25.6	Very low	32.4	Very low	128 Å²	128	147.2 Å²	147.2	79%	0.785	76%	0.763	S	S	*	*				-160.3	115.9	124.2	40.8	0	0	0	0	111.2
468	T	37.3	Very low	34.8	Very low	119 Å²	119	144.7 Å²	144.7	73%	0.73	74%	0.735	S	S	*	*			trans	16.5	122.8	140.6	50.3	0	0	0	0	119.5
469	K	28.6	Very low	37.6	Very low	208 Å²	208	139.7 Å²	139.7	90%	0.904	70%	0.703	S	S	*	*				178.8	118.3	117.7	-94.1	165.3	-173.4	-175.1	0	111.6
470	K	43	Very low	40.5	Very low	172 Å²	172	131.8 Å²	131.8	75%	0.748	68%	0.678	S	S	*	*			trans	-69.3	153.6	175.4	-68.9	174.6	167.9	-173.2	0	111.6
471	K	29.7	Very low	43.3	Very low	204 Å²	204	122.7 Å²	122.7	89%	0.887	64%	0.644	S	S	*	*			trans	-146.3	126.8	146.4	-114.3	-177.4	-179.9	-172.7	0	110.8
472	E	29.3	Very low	46.5	Very low	139 Å²	139	121.8 Å²	121.8	65%	0.65	62%	0.624	S	S	*	*			trans	-89.7	141.7	-166.2	-71.5	146.9	170.2	0	0	111.3
473	N	28	Very low	49.7	Very low	69 Å²	69	117.5 Å²	117.5	37%	0.369	59%	0.593	S	S	.	*			trans	-86.5	141.4	157.8	-75.8	-49.8	0	0	0	107.9	K390 I475	K390-N473 WeakPolarHBondContact CB-ND2 3.28Å; K390-N473 VanDerWaalsContact CD-ND2 3.31Å; K390-N473 WeakPolarHBondContact CD-ND2 3.46Å; N473-I475 PolarHBondContact O-N 2.83Å
474	P	36.3	Very low	52.7	Low	131 Å²	131	112.3 Å²	112.3	85%	0.851	56%	0.559	S	S	*	*			trans	-72.9	94.2	177.4	29.8	-30.2	0	0	0	108.4
475	I	37.1	Very low	55.8	Low	103 Å²	103	108 Å²	108	53%	0.528	54%	0.543	S	S	.	.			trans	-80.5	126.6	162.6	-55.9	166.1	0	0	0	104.4	N473 D477 N735	N473-I475 PolarHBondContact O-N 2.83Å; I475-D477 PolarHBondContact O-N 2.81Å; I475-N735 HydrophobicContact CB-CB 4.34Å; I475-N735 WeakPolarHBondContact CB-ND2 3.5Å; I475-N735 HydrophobicContact CG2-CB 3.67Å; I475-N735 WeakPolarHBondContact CG2-ND2 3.28Å; I475-N735 PolarHBondContact O-ND2 3.31Å
476	E	44.5	Very low	58.8	Low	164 Å²	164	106.4 Å²	106.4	77%	0.766	54%	0.535	S	S	*	.			trans	-39.3	131.1	174.9	-65.1	-179.6	162.8	0	0	109.9	E478 N735	E476-E478 PolarHBondContact O-N 2.62Å; E476-N735 PolarHBondContact O-ND2 3Å
477	D	51.8	Low	61.5	Low	96 Å²	96	102.4 Å²	102.4	51%	0.513	51%	0.509	S	S	.	.			trans	-65	106.7	-176.9	-169.6	-1	0	0	0	108.9	I475 L479 A738	I475-D477 PolarHBondContact O-N 2.81Å; D477-L479 VanDerWaalsContact C-N 3.25Å; D477-L479 VanDerWaalsContact OD1-CB 3.22Å; D477-L479 WeakPolarHBondContact OD1-CB 3.41Å; D477-L479 PolarHBondContact OD1-N 2.77Å; D477-A738 HydrophobicContact CB-CB 4.43Å; D477-A738 WeakPolarHBondContact OD1-CB 3.22Å; D477-A738 WeakPolarHBondContact OD2-CB 3.46Å
478	E	75.9	Confident	64.6	Low	43 Å²	43	104.5 Å²	104.5	20%	0.201	50%	0.502	C	S	.	.			trans	-79.8	-10.6	177.5	-70.4	-179.5	173	0	0	111	E476 I480 I734 N735 Y768 R769	E476-E478 PolarHBondContact O-N 2.62Å; E478-I480 PolarHBondContact O-N 2.93Å; E478-I734 WeakPolarHBondContact OE2-CG2 3.31Å; E478-N735 HydrophobicContact CB-CB 4.24Å; E478-N735 HydrophobicContact CG-CB 3.99Å; E478-N735 PolarHBondContact OE2-N 3.02Å; E478-Y768 HydrophobicContact CB-CD1 4.47Å; E478-Y768 CarbonylContact O-C 3.54Å; E478-Y768 WeakPolarHBondContact O-CA 3.28Å; E478-R769 HydrophobicContact CB-CB 4.34Å; E478-R769 PolarHBondContact O-N 2.64Å
479	L	87	Confident	67.2	Low	35 Å²	35	104.1 Å²	104.1	18%	0.183	50%	0.496	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	118.2	177.2	-176.4	69.5	0	0	0	110.3	D477 D739 K766 Y768	D477-L479 VanDerWaalsContact C-N 3.25Å; D477-L479 VanDerWaalsContact OD1-CB 3.22Å; D477-L479 WeakPolarHBondContact OD1-CB 3.41Å; D477-L479 PolarHBondContact OD1-N 2.77Å; L479-D739 HydrophobicContact CD2-CB 3.68Å; L479-K766 HydrophobicContact CD1-CB 3.85Å; L479-K766 HydrophobicContact CD1-CD 4.39Å; L479-K766 HydrophobicContact CD1-CG 4.29Å; L479-Y768 HydrophobicContact CB-CD1 4.12Å; L479-Y768 HydrophobicContact CB-CE1 3.96Å; L479-Y768 HydrophobicContact CD1-CD1 4.08Å; L479-Y768 HydrophobicContact CD1-CE1 3.67Å; L479-Y768 HydrophobicContact CD1-CE2 4.38Å; L479-Y768 HydrophobicContact CG-CE1 4.4Å
480	I	87.5	Confident	70.1	Confident	69 Å²	69	101.8 Å²	101.8	35%	0.354	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	-53.9	177	-51.1	-177.4	0	0	0	109.5	E478 H754 V767 R769	E478-I480 PolarHBondContact O-N 2.93Å; I480-H754 HydrophobicContact CD1-CB 4.02Å; I480-H754 VanDerWaalsContact CD1-CD2 3.41Å; I480-H754 WeakPolarHBondContact CD1-CD2 3.39Å; I480-H754 VanDerWaalsContact CD1-CE1 3.45Å; I480-H754 WeakPolarHBondContact CD1-CE1 3.45Å; I480-H754 WeakPolarHBondContact CD1-ND1 3.3Å; I480-H754 WeakPolarHBondContact CD1-NE2 3.31Å; I480-V767 WeakPolarHBondContact CB-O 3.3Å; I480-V767 HydrophobicContact CD1-CG1 4.24Å; I480-V767 PolarHBondContact N-O 3.39Å; I480-R769 HydrophobicContact CD1-CB 4.25Å; I480-R769 HydrophobicContact CG1-CB 4.23Å
481	Y	90.7	Very high	72.3	Confident	45 Å²	45	94.3 Å²	94.3	18%	0.176	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.7	164.2	177.7	65.4	-97.5	0	0	0	111.5	V483 I507 N522 G524 F765 V767	Y481-V483 HydrophobicContact CD2-CG2 3.72Å; Y481-V483 HydrophobicContact CE2-CG2 3.71Å; Y481-I507 WeakPolarHBondContact OH-CD1 2.69Å; Y481-N522 WeakPolarHBondContact CE1-O 3.5Å; Y481-N522 VanDerWaalsContact CZ-O 3.3Å; Y481-N522 VanDerWaalsContact OH-C 3.31Å; Y481-N522 PolarHBondContact OH-O 3.28Å; Y481-G524 PolarHBondContact OH-N 3Å; Y481-F765 AromaticContact CE2-CE2 3.98Å; Y481-F765 HydrophobicContact CE2-CE2 3.98Å; Y481-V767 HydrophobicContact CD1-CB 4.35Å; Y481-V767 HydrophobicContact CD2-CG2 4.38Å; Y481-V767 HydrophobicContact CE1-CB 3.93Å; Y481-V767 HydrophobicContact CE1-CG1 4.22Å; Y481-V767 HydrophobicContact CE1-CG2 4.06Å; Y481-V767 HydrophobicContact CE2-CB 4.18Å; Y481-V767 HydrophobicContact CE2-CG2 3.64Å; Y481-V767 VanDerWaalsContact CZ-CG2 3.44Å; Y481-V767 PolarHBondContact O-N 3.34Å; Y481-V767 WeakPolarHBondContact OH-CG2 3.21Å
482	R	93.8	Very high	75.4	Confident	109 Å²	109	87 Å²	87	41%	0.411	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	137.8	173.9	172.8	-176.4	178.8	-169.4	3	109.6	D739 N762 C764 K766	R482-D739 WeakPolarHBondContact CD-OD2 3.36Å; R482-D739 IonicContact NH1-OD2 3.07Å; R482-N762 PolarHBondContact NH2-O 3.41Å; R482-C764 HydrophobicContact CG-CB 3.91Å; R482-C764 VanDerWaalsContact NE-CB 3.34Å; R482-C764 PolarHBondContact NE-SG 3.05Å; R482-K766 HydrophobicContact CB-CG 4.32Å; R482-K766 HydrophobicContact CG-CG 4.17Å
483	V	94.3	Very high	78.5	Confident	23 Å²	23	80.3 Å²	80.3	14%	0.139	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	126	172.5	179.3	0	0	0	0	110.4	Y481 F520 G524 C764 F765	Y481-V483 HydrophobicContact CD2-CG2 3.72Å; Y481-V483 HydrophobicContact CE2-CG2 3.71Å; V483-F520 HydrophobicContact CG1-CD1 3.98Å; V483-F520 HydrophobicContact CG1-CE1 3.64Å; V483-F520 HydrophobicContact CG1-CZ 4.31Å; V483-G524 WeakPolarHBondContact CG2-O 3.46Å; V483-C764 WeakPolarHBondContact O-CA 3.34Å; V483-C764 VanDerWaalsContact O-CB 3.29Å; V483-C764 WeakPolarHBondContact O-CB 3.39Å; V483-F765 HydrophobicContact CB-CD1 4.06Å; V483-F765 HydrophobicContact CB-CE1 3.46Å; V483-F765 VanDerWaalsContact CB-CE1 3.46Å; V483-F765 HydrophobicContact CB-CE2 4.2Å; V483-F765 HydrophobicContact CB-CZ 3.54Å; V483-F765 HydrophobicContact CG1-CD1 4.46Å; V483-F765 HydrophobicContact CG1-CE1 3.66Å; V483-F765 HydrophobicContact CG1-CZ 4.02Å; V483-F765 HydrophobicContact CG2-CE1 4.2Å; V483-F765 HydrophobicContact CG2-CE2 4.26Å; V483-F765 HydrophobicContact CG2-CZ 3.75Å; V483-F765 PolarHBondContact N-O 3.42Å; V483-F765 PolarHBondContact O-N 3.42Å
484	G	92	Very high	81.5	Confident	16 Å²	16	78.4 Å²	78.4	17%	0.165	39%	0.386	C	S	.	.			trans	111.5	156.4	165.6	0	0	0	0	0	115.3	G491 H763 C764	G484-G491 WeakPolarHBondContact CA-O 3.41Å; G484-H763 CarbonylContact C-O 3.56Å; G484-C764 WeakPolarHBondContact O-CB 3.45Å
485	T	92.6	Very high	84.2	Confident	80 Å²	80	73.9 Å²	73.9	49%	0.491	36%	0.355	S	S	.	.			trans	-136.5	168.8	178.7	51.5	0	0	0	0	108.4	G487 E492 F493 H763	T485-G487 PolarHBondContact O-N 2.96Å; T485-E492 CarbonylContact O-C 3.49Å; T485-E492 WeakPolarHBondContact O-CA 3.19Å; T485-F493 PolarHBondContact O-N 3.18Å; T485-H763 CarbonylContact C-O 3.57Å
486	R	94.6	Very high	86.9	Confident	183 Å²	183	69 Å²	69	69%	0.691	33%	0.329	S	S	*	.	B	Isolated β-bridge	trans	-65.3	118.7	175.9	-171.7	178.5	178.6	150.2	-7.2	110.5	F493 H763	R486-F493 VanDerWaalsContact CA-O 3.28Å; R486-F493 WeakPolarHBondContact CA-O 3.29Å; R486-H763 HydrophobicContact CB-CB 4.04Å
487	G	91.6	Very high	89.3	Confident	14 Å²	14	61.7 Å²	61.7	14%	0.144	30%	0.296	C	S	.	.	S	Bend	trans	169.7	-160	174.1	0	0	0	0	0	114.4	T485 E492 F493 T494 N514	T485-G487 PolarHBondContact O-N 2.96Å; G487-E492 WeakPolarHBondContact CA-OE2 3.33Å; G487-F493 PolarHBondContact N-O 3.47Å; G487-F493 CarbonylContact O-C 3.59Å; G487-F493 VanDerWaalsContact O-C 3.28Å; G487-T494 PolarHBondContact O-N 3.31Å; G487-T494 PolarHBondContact O-OG1 2.85Å; G487-N514 PolarHBondContact O-ND2 2.79Å
488	R	90.9	Very high	91.3	Very high	172 Å²	172	57.1 Å²	57.1	65%	0.649	27%	0.271	S	S	*	.	S	Bend	trans	-130.2	-4.7	-174.3	-59.7	-158.3	175.8	163.3	3.1	113.3	E492 N514 R529	R488-E492 PolarHBondContact N-OE2 3.35Å; R488-N514 WeakPolarHBondContact CG-OD1 3.42Å; R488-R529 VanDerWaalsContact O-CZ 3.27Å; R488-R529 PolarHBondContact O-NH1 2.95Å; R488-R529 PolarHBondContact O-NH2 3.4Å; R488-R529 VanDerWaalsContact O-NH2 3.08Å
489	D	91.8	Very high	92.3	Very high	111 Å²	111	55.5 Å²	55.5	59%	0.594	26%	0.264	S	S	*	.	S	Bend	trans	-81.9	-175.5	-179.3	-67.1	-35.1	0	0	0	111.7	G491 E492	D489-G491 PolarHBondContact O-N 3.33Å; D489-E492 HydrophobicContact CB-CG 4.18Å; D489-E492 WeakPolarHBondContact CB-OE2 3.45Å; D489-E492 PolarHBondContact N-OE2 2.71Å; D489-E492 PolarHBondContact O-N 3.19Å
490	K	90.8	Very high	92.7	Very high	160 Å²	160	54.4 Å²	54.4	70%	0.696	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	123.9	-178.5	-62.3	175.3	-176.6	175.8	0	109.2	E492 F526	K490-E492 VanDerWaalsContact C-N 3.27Å; K490-F526 HydrophobicContact CB-CD1 4.29Å; K490-F526 HydrophobicContact CB-CD2 4.27Å; K490-F526 HydrophobicContact CB-CE1 4.07Å; K490-F526 HydrophobicContact CB-CE2 4.03Å; K490-F526 HydrophobicContact CB-CG 4.39Å; K490-F526 HydrophobicContact CB-CZ 3.92Å; K490-F526 HydrophobicContact CD-CD1 4.45Å; K490-F526 HydrophobicContact CD-CE1 3.87Å; K490-F526 HydrophobicContact CD-CZ 4.21Å; K490-F526 HydrophobicContact CG-CE1 4.04Å; K490-F526 HydrophobicContact CG-CE2 4.43Å; K490-F526 HydrophobicContact CG-CZ 3.88Å
491	G	88.8	Confident	93	Very high	14 Å²	14	52 Å²	52	14%	0.144	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	84	-3.6	-177.1	0	0	0	0	0	114.4	G484 D489	G484-G491 WeakPolarHBondContact CA-O 3.41Å; D489-G491 PolarHBondContact O-N 3.33Å
492	E	93.9	Very high	93	Very high	50 Å²	50	50.4 Å²	50.4	23%	0.234	25%	0.245	C	C	.	.			trans	-99.4	150.5	175.7	-55.7	-172.6	146.9	0	0	111.2	T485 G487 R488 D489 K490 Q518	T485-E492 CarbonylContact O-C 3.49Å; T485-E492 WeakPolarHBondContact O-CA 3.19Å; G487-E492 WeakPolarHBondContact CA-OE2 3.33Å; R488-E492 PolarHBondContact N-OE2 3.35Å; D489-E492 HydrophobicContact CB-CG 4.18Å; D489-E492 WeakPolarHBondContact CB-OE2 3.45Å; D489-E492 PolarHBondContact N-OE2 2.71Å; D489-E492 PolarHBondContact O-N 3.19Å; K490-E492 VanDerWaalsContact C-N 3.27Å; E492-Q518 PolarHBondContact O-NE2 2.76Å
493	F	95.1	Very high	92.6	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.26	C	S	.	.	B	Isolated β-bridge	trans	-127.6	142.5	-178.8	-55.2	-80	0	0	0	111.6	T485 R486 G487 L496 V509 D511 Q518 F520 F765	T485-F493 PolarHBondContact O-N 3.18Å; R486-F493 VanDerWaalsContact CA-O 3.28Å; R486-F493 WeakPolarHBondContact CA-O 3.29Å; G487-F493 PolarHBondContact N-O 3.47Å; G487-F493 CarbonylContact O-C 3.59Å; G487-F493 VanDerWaalsContact O-C 3.28Å; F493-L496 HydrophobicContact CB-CB 4.42Å; F493-L496 HydrophobicContact CB-CD2 3.86Å; F493-L496 HydrophobicContact CD1-CB 4.1Å; F493-L496 HydrophobicContact CG-CB 4.34Å; F493-L496 HydrophobicContact CG-CD2 4.16Å; F493-V509 HydrophobicContact CD1-CG1 4.34Å; F493-V509 HydrophobicContact CE1-CB 4.1Å; F493-V509 HydrophobicContact CE1-CG1 3.76Å; F493-V509 HydrophobicContact CZ-CB 4.49Å; F493-V509 HydrophobicContact CZ-CG1 4.31Å; F493-D511 WeakPolarHBondContact CA-OD2 3.43Å; F493-D511 HydrophobicContact CD1-CB 4.14Å; F493-Q518 HydrophobicContact CE1-CB 4.27Å; F493-Q518 HydrophobicContact CE1-CG 4.44Å; F493-F520 HydrophobicContact CE1-CE2 4.19Å; F493-F520 HydrophobicContact CE1-CZ 4.29Å; F493-F520 HydrophobicContact CE2-CZ 4.29Å; F493-F520 AromaticContact CZ-CE2 3.61Å; F493-F520 HydrophobicContact CZ-CE2 3.61Å; F493-F520 AromaticContact CZ-CZ 3.52Å; F493-F520 HydrophobicContact CZ-CZ 3.52Å; F493-F765 AromaticContact CE2-CD1 3.9Å; F493-F765 HydrophobicContact CE2-CD1 3.9Å; F493-F765 HydrophobicContact CE2-CE1 4.29Å; F493-F765 AromaticContact CZ-CD1 3.83Å; F493-F765 HydrophobicContact CZ-CD1 3.83Å; F493-F765 HydrophobicContact CZ-CE1 4.07Å
494	T	91.5	Very high	92.2	Very high	29 Å²	29	53.1 Å²	53.1	18%	0.178	28%	0.275	C	S	.	.	S	Bend	trans	-100.1	-39.4	168.4	-67.5	0	0	0	0	111	G487 D511 N513 N514 H763	G487-T494 PolarHBondContact O-N 3.31Å; G487-T494 PolarHBondContact O-OG1 2.85Å; T494-D511 PolarHBondContact N-OD1 3.45Å; T494-D511 PolarHBondContact N-OD2 3.43Å; T494-N513 HydrophobicContact CG2-CB 3.64Å; T494-N514 PolarHBondContact N-ND2 2.94Å; T494-N514 PolarHBondContact OG1-ND2 2.91Å; T494-N514 PolarHBondContact OG1-OD1 2.82Å; T494-H763 PolarHBondContact O-CE1 3.17Å; T494-H763 VanDerWaalsContact O-CE1 3.26Å; T494-H763 PolarHBondContact O-ND1 2.8Å
495	N	91.3	Very high	92	Very high	35 Å²	35	53.1 Å²	53.1	19%	0.187	28%	0.275	C	S	.	.	S	Bend	trans	-159.2	86.2	174	-179	27.1	0	0	0	110	D511 S512 N513 S760	N495-D511 PolarHBondContact N-OD1 3.15Å; N495-D511 VanDerWaalsContact N-OD1 3.14Å; N495-S512 WeakPolarHBondContact O-CB 3.42Å; N495-S512 PolarHBondContact O-N 2.96Å; N495-N513 HydrophobicContact CB-CB 3.74Å; N495-N513 WeakPolarHBondContact CB-ND2 3.42Å; N495-N513 PolarHBondContact ND2-OD1 3.33Å; N495-S760 PolarHBondContact OD1-OG 2.82Å
496	L	94.6	Very high	92	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	141	172.5	69.3	159.1	0	0	0	111.3	F493 V509 A510 A758 S760 C764 F765	F493-L496 HydrophobicContact CB-CB 4.42Å; F493-L496 HydrophobicContact CB-CD2 3.86Å; F493-L496 HydrophobicContact CD1-CB 4.1Å; F493-L496 HydrophobicContact CG-CB 4.34Å; F493-L496 HydrophobicContact CG-CD2 4.16Å; L496-V509 HydrophobicContact CB-CG1 3.73Å; L496-V509 HydrophobicContact CD1-CG1 3.85Å; L496-V509 HydrophobicContact CG-CG1 4.48Å; L496-A510 WeakPolarHBondContact CA-O 3.42Å; L496-A758 HydrophobicContact CD1-CB 3.57Å; L496-A758 HydrophobicContact CG-CB 3.96Å; L496-S760 WeakPolarHBondContact O-CB 3.36Å; L496-C764 WeakPolarHBondContact CD1-O 3.32Å; L496-F765 HydrophobicContact CD1-CB 3.82Å
497	Q	94.3	Very high	92	Very high	12 Å²	12	44.4 Å²	44.4	6%	0.056	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	-79.4	177.3	-78.2	-168.1	64.3	0	0	111.8	A510 S512 Q745 G746 A758	Q497-A510 PolarHBondContact N-O 2.89Å; Q497-S512 WeakPolarHBondContact CG-OG 3.21Å; Q497-S512 PolarHBondContact NE2-OG 3.46Å; Q497-Q745 HydrophobicContact CG-CG 4.44Å; Q497-Q745 VanDerWaalsContact O-CB 3.29Å; Q497-Q745 WeakPolarHBondContact O-CB 3.29Å; Q497-G746 WeakPolarHBondContact O-CA 3.44Å; Q497-G746 PolarHBondContact O-N 3.49Å; Q497-A758 VanDerWaalsContact O-CB 3.25Å; Q497-A758 WeakPolarHBondContact O-CB 3.41Å
498	G	94.2	Very high	92.3	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	143	-179.9	0	0	0	0	0	111.5	A510 T544	G498-A510 PolarHBondContact O-N 2.86Å; G498-T544 WeakPolarHBondContact CA-O 3.49Å; G498-T544 PolarHBondContact N-O 3.24Å
499	I	96.9	Very high	92.6	Very high	9 Å²	9	35.6 Å²	35.6	5%	0.046	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	141.9	169.9	-171.1	162.7	0	0	0	107.6	I507 V508 V509 G746 L747 A748 A756 A758 F765	I499-I507 HydrophobicContact CD1-CG2 3.7Å; I499-I507 HydrophobicContact CG1-CG2 3.76Å; I499-V508 CarbonylContact C-O 3.58Å; I499-V508 WeakPolarHBondContact CA-O 3.41Å; I499-V509 HydrophobicContact CD1-CG2 4.02Å; I499-V509 HydrophobicContact CG1-CG2 4.03Å; I499-G746 VanDerWaalsContact CG2-O 3.29Å; I499-G746 WeakPolarHBondContact CG2-O 3.18Å; I499-L747 VanDerWaalsContact CG2-CA 3.47Å; I499-A748 HydrophobicContact CG2-CB 4.28Å; I499-A756 HydrophobicContact CD1-CB 3.73Å; I499-A756 HydrophobicContact CG1-CB 4.47Å; I499-A758 HydrophobicContact CB-CB 4.38Å; I499-A758 HydrophobicContact CG2-CB 4.35Å; I499-F765 HydrophobicContact CD1-CB 3.88Å; I499-F765 HydrophobicContact CD1-CD2 4.05Å; I499-F765 HydrophobicContact CD1-CG 4.06Å
500	S	96.4	Very high	92.9	Very high	12 Å²	12	30.3 Å²	30.3	8%	0.084	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	145.2	172.8	-171.9	0	0	0	0	108.3	I507 V508 V546 T547 V548	S500-I507 CarbonylContact O-C 3.59Å; S500-V508 PolarHBondContact N-O 2.95Å; S500-V508 PolarHBondContact O-N 3.48Å; S500-V546 WeakPolarHBondContact CB-O 3.43Å; S500-T547 WeakPolarHBondContact OG-CA 3.45Å; S500-V548 PolarHBondContact OG-N 3.19Å
501	A	94	Very high	93.1	Very high	19 Å²	19	22.7 Å²	22.7	16%	0.157	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	154.2	166.7	0	0	0	0	0	109.8	R506 A748 L749 T750	A501-R506 CarbonylContact C-O 3.28Å; A501-R506 VanDerWaalsContact CA-O 3.31Å; A501-R506 WeakPolarHBondContact CA-O 3.13Å; A501-A748 HydrophobicContact CB-CB 4.41Å; A501-L749 VanDerWaalsContact CB-O 3.27Å; A501-L749 WeakPolarHBondContact CB-O 3.35Å; A501-T750 HydrophobicContact CB-CG2 4.39Å
502	S	90.7	Very high	93.3	Very high	11 Å²	11	22.1 Å²	22.1	8%	0.077	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	149.9	-179.6	171.3	0	0	0	0	109.3	N504 G505 R506	S502-N504 WeakPolarHBondContact CB-OD1 3.43Å; S502-N504 PolarHBondContact O-N 2.78Å; S502-N504 VanDerWaalsContact O-N 3.11Å; S502-N504 PolarHBondContact OG-N 2.84Å; S502-N504 PolarHBondContact OG-OD1 3.04Å; S502-G505 PolarHBondContact O-N 2.84Å; S502-R506 PolarHBondContact N-O 3.16Å
503	S	85.4	Confident	93.1	Very high	105 Å²	105	23.6 Å²	23.6	73%	0.734	14%	0.138	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61	-20	178	54.8	0	0	0	0	113.6	G505	S503-G505 PolarHBondContact O-N 2.83Å
504	N	84.6	Confident	93	Very high	83 Å²	83	24.4 Å²	24.4	44%	0.444	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85	17	175.2	66.7	8.2	0	0	0	114.4	S502 R506	S502-N504 WeakPolarHBondContact CB-OD1 3.43Å; S502-N504 PolarHBondContact O-N 2.78Å; S502-N504 VanDerWaalsContact O-N 3.11Å; S502-N504 PolarHBondContact OG-N 2.84Å; S502-N504 PolarHBondContact OG-OD1 3.04Å; N504-R506 WeakPolarHBondContact OD1-CB 3.22Å; N504-R506 VanDerWaalsContact OD1-CG 3.32Å; N504-R506 WeakPolarHBondContact OD1-CG 2.93Å
505	G	87.2	Confident	93.2	Very high	17 Å²	17	24.6 Å²	24.6	18%	0.175	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.4	32.2	176.3	0	0	0	0	0	114.4	S502 S503 S521 N522	S502-G505 PolarHBondContact O-N 2.84Å; S503-G505 PolarHBondContact O-N 2.83Å; G505-S521 WeakPolarHBondContact O-CA 3.2Å; G505-N522 VanDerWaalsContact CA-OD1 3.31Å; G505-N522 WeakPolarHBondContact CA-OD1 3.11Å; G505-N522 PolarHBondContact O-N 3.42Å; G505-N522 VanDerWaalsContact O-N 3.14Å; G505-N522 PolarHBondContact O-OD1 3.06Å
506	R	92.9	Very high	93.4	Very high	79 Å²	79	23 Å²	23	30%	0.298	13%	0.133	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	134.9	175.7	-64.9	180	-176.7	-170.3	2.1	111.2	A501 S502 N504 V519 F520 S569	A501-R506 CarbonylContact C-O 3.28Å; A501-R506 VanDerWaalsContact CA-O 3.31Å; A501-R506 WeakPolarHBondContact CA-O 3.13Å; S502-R506 PolarHBondContact N-O 3.16Å; N504-R506 WeakPolarHBondContact OD1-CB 3.22Å; N504-R506 VanDerWaalsContact OD1-CG 3.32Å; N504-R506 WeakPolarHBondContact OD1-CG 2.93Å; R506-V519 HydrophobicContact CB-CG1 4.13Å; R506-V519 HydrophobicContact CG-CG1 4.37Å; R506-F520 CarbonylContact C-O 3.41Å; R506-F520 VanDerWaalsContact CA-O 3.3Å; R506-F520 WeakPolarHBondContact CA-O 3.37Å; R506-S569 PolarHBondContact NH1-O 3.47Å
507	I	96.3	Very high	93.5	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	121.8	170.7	-58.2	175.8	0	0	0	108.1	Y481 I499 S500 V509 V519 F520 T750 A756 F765 V767	Y481-I507 WeakPolarHBondContact OH-CD1 2.69Å; I499-I507 HydrophobicContact CD1-CG2 3.7Å; I499-I507 HydrophobicContact CG1-CG2 3.76Å; S500-I507 CarbonylContact O-C 3.59Å; I507-V509 HydrophobicContact CG2-CG2 4.12Å; I507-V519 CarbonylContact O-C 3.49Å; I507-V519 WeakPolarHBondContact O-CA 3.35Å; I507-F520 HydrophobicContact CB-CB 4.4Å; I507-F520 PolarHBondContact N-O 3.39Å; I507-F520 PolarHBondContact O-N 2.94Å; I507-T750 HydrophobicContact CD1-CG2 3.98Å; I507-T750 HydrophobicContact CG1-CG2 4.3Å; I507-A756 HydrophobicContact CD1-CB 4.43Å; I507-F765 HydrophobicContact CD1-CE2 4.13Å; I507-F765 HydrophobicContact CG2-CE2 4.28Å; I507-V767 HydrophobicContact CD1-CG2 4.32Å
508	V	97.1	Very high	93.6	Very high	2 Å²	2	22.4 Å²	22.4	1%	0.012	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	124.5	-178.4	-173.3	0	0	0	0	108.9	I499 S500 I517 V519 V546 V548 I554	I499-V508 CarbonylContact C-O 3.58Å; I499-V508 WeakPolarHBondContact CA-O 3.41Å; S500-V508 PolarHBondContact N-O 2.95Å; S500-V508 PolarHBondContact O-N 3.48Å; V508-I517 HydrophobicContact CG1-CG2 3.31Å; V508-V519 HydrophobicContact CG1-CG2 4.31Å; V508-V519 HydrophobicContact CG2-CG1 4.26Å; V508-V519 HydrophobicContact CG2-CG2 4.28Å; V508-V546 HydrophobicContact CB-CG2 4.34Å; V508-V546 HydrophobicContact CG1-CG1 4.5Å; V508-V546 HydrophobicContact CG1-CG2 3.59Å; V508-V546 WeakPolarHBondContact O-CG1 3.47Å; V508-V548 HydrophobicContact CB-CG2 4.3Å; V508-V548 HydrophobicContact CG2-CG2 3.67Å; V508-I554 HydrophobicContact CG1-CD1 4.35Å; V508-I554 HydrophobicContact CG1-CG2 3.87Å; V508-I554 HydrophobicContact CG2-CD1 4.37Å
509	V	97.4	Very high	93.7	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	130	-174.9	-173.4	0	0	0	0	109.9	F493 L496 I499 I507 I517 Q518 F520 F765	F493-V509 HydrophobicContact CD1-CG1 4.34Å; F493-V509 HydrophobicContact CE1-CB 4.1Å; F493-V509 HydrophobicContact CE1-CG1 3.76Å; F493-V509 HydrophobicContact CZ-CB 4.49Å; F493-V509 HydrophobicContact CZ-CG1 4.31Å; L496-V509 HydrophobicContact CB-CG1 3.73Å; L496-V509 HydrophobicContact CD1-CG1 3.85Å; L496-V509 HydrophobicContact CG-CG1 4.48Å; I499-V509 HydrophobicContact CD1-CG2 4.02Å; I499-V509 HydrophobicContact CG1-CG2 4.03Å; I507-V509 HydrophobicContact CG2-CG2 4.12Å; V509-I517 WeakPolarHBondContact O-CA 3.3Å; V509-Q518 PolarHBondContact N-O 2.79Å; V509-Q518 PolarHBondContact O-N 3.07Å; V509-F520 HydrophobicContact CG2-CD2 4.24Å; V509-F520 HydrophobicContact CG2-CE2 4.25Å; V509-F765 HydrophobicContact CG2-CD1 3.95Å; V509-F765 HydrophobicContact CG2-CE1 4.21Å; V509-F765 HydrophobicContact CG2-CG 4.42Å
510	A	97.1	Very high	93.7	Very high	0 Å²	0	22 Å²	22	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	110.2	173	0	0	0	0	0	110.6	L496 Q497 G498 S512 I517 P543 T544 V546	L496-A510 WeakPolarHBondContact CA-O 3.42Å; Q497-A510 PolarHBondContact N-O 2.89Å; G498-A510 PolarHBondContact O-N 2.86Å; A510-S512 PolarHBondContact O-N 2.67Å; A510-I517 HydrophobicContact CB-CD1 3.81Å; A510-P543 HydrophobicContact CB-CB 4.32Å; A510-T544 WeakPolarHBondContact CB-O 3.47Å; A510-V546 HydrophobicContact CB-CB 4.23Å; A510-V546 HydrophobicContact CB-CG1 4.12Å
511	D	95.2	Very high	93.5	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	93.2	173.8	-168.7	-12.9	0	0	0	109.9	F493 T494 N495 N513 N514 Q515 C516	F493-D511 WeakPolarHBondContact CA-OD2 3.43Å; F493-D511 HydrophobicContact CD1-CB 4.14Å; T494-D511 PolarHBondContact N-OD1 3.45Å; T494-D511 PolarHBondContact N-OD2 3.43Å; N495-D511 PolarHBondContact N-OD1 3.15Å; N495-D511 VanDerWaalsContact N-OD1 3.14Å; D511-N513 PolarHBondContact O-N 3.06Å; D511-N514 HydrophobicContact CB-CB 4.21Å; D511-N514 PolarHBondContact O-N 3.44Å; D511-N514 PolarHBondContact OD1-N 3.03Å; D511-N514 WeakPolarHBondContact OD2-CB 3.4Å; D511-N514 PolarHBondContact OD2-ND2 3.3Å; D511-Q515 PolarHBondContact O-N 2.65Å; D511-C516 PolarHBondContact N-O 2.8Å; D511-C516 PolarHBondContact O-N 2.71Å
512	S	92.5	Very high	93.4	Very high	2 Å²	2	21.7 Å²	21.7	1%	0.014	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-43.3	-170.9	-58.9	0	0	0	0	113	N495 Q497 A510 Q515 P543	N495-S512 WeakPolarHBondContact O-CB 3.42Å; N495-S512 PolarHBondContact O-N 2.96Å; Q497-S512 WeakPolarHBondContact CG-OG 3.21Å; Q497-S512 PolarHBondContact NE2-OG 3.46Å; A510-S512 PolarHBondContact O-N 2.67Å; S512-Q515 PolarHBondContact O-N 2.98Å; S512-P543 VanDerWaalsContact CA-O 3.32Å; S512-P543 WeakPolarHBondContact CA-O 2.99Å; S512-P543 VanDerWaalsContact CB-O 3.31Å; S512-P543 WeakPolarHBondContact CB-O 3.19Å; S512-P543 PolarHBondContact OG-O 3.15Å
513	N	91.1	Very high	93.3	Very high	81 Å²	81	26.9 Å²	26.9	43%	0.433	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-27.4	-175	-78.2	6.7	0	0	0	112.4	T494 N495 D511 Q515	T494-N513 HydrophobicContact CG2-CB 3.64Å; N495-N513 HydrophobicContact CB-CB 3.74Å; N495-N513 WeakPolarHBondContact CB-ND2 3.42Å; N495-N513 PolarHBondContact ND2-OD1 3.33Å; D511-N513 PolarHBondContact O-N 3.06Å; N513-Q515 VanDerWaalsContact C-N 3.26Å
514	N	92.9	Very high	93.6	Very high	17 Å²	17	22.4 Å²	22.4	9%	0.091	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-0.2	171.5	-68.7	-23.5	0	0	0	113.2	G487 R488 T494 D511 C516	G487-N514 PolarHBondContact O-ND2 2.79Å; R488-N514 WeakPolarHBondContact CG-OD1 3.42Å; T494-N514 PolarHBondContact N-ND2 2.94Å; T494-N514 PolarHBondContact OG1-ND2 2.91Å; T494-N514 PolarHBondContact OG1-OD1 2.82Å; D511-N514 HydrophobicContact CB-CB 4.21Å; D511-N514 PolarHBondContact O-N 3.44Å; D511-N514 PolarHBondContact OD1-N 3.03Å; D511-N514 WeakPolarHBondContact OD2-CB 3.4Å; D511-N514 PolarHBondContact OD2-ND2 3.3Å; N514-C516 PolarHBondContact O-N 2.96Å
515	Q	94.4	Very high	94	Very high	33 Å²	33	24.1 Å²	24.1	15%	0.154	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	53	36.8	177.3	-65.1	127.1	22.9	0	0	113.2	D511 S512 N513 R533 Q541	D511-Q515 PolarHBondContact O-N 2.65Å; S512-Q515 PolarHBondContact O-N 2.98Å; N513-Q515 VanDerWaalsContact C-N 3.26Å; Q515-R533 HydrophobicContact CB-CB 4.48Å; Q515-R533 HydrophobicContact CG-CG 4.47Å; Q515-R533 VanDerWaalsContact OE1-CB 3.23Å; Q515-Q541 VanDerWaalsContact CG-O 3.22Å; Q515-Q541 WeakPolarHBondContact CG-O 3.22Å
516	C	95.4	Very high	94.3	Very high	1 Å²	1	26.6 Å²	26.6	1%	0.007	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	162.4	-176	68.3	0	0	0	0	111.3	D511 N514 R529 F530	D511-C516 PolarHBondContact N-O 2.8Å; D511-C516 PolarHBondContact O-N 2.71Å; N514-C516 PolarHBondContact O-N 2.96Å; C516-R529 HydrophobicContact CB-CG 4.26Å; C516-R529 PolarHBondContact SG-NE 3.48Å; C516-F530 WeakPolarHBondContact CA-O 3.31Å; C516-F530 WeakPolarHBondContact CB-O 3.49Å
517	I	97.1	Very high	94.4	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	134.2	169.5	-53.7	-55.3	0	0	0	107.9	V508 V509 A510 R529 F530 L540 P543 V556	V508-I517 HydrophobicContact CG1-CG2 3.31Å; V509-I517 WeakPolarHBondContact O-CA 3.3Å; A510-I517 HydrophobicContact CB-CD1 3.81Å; I517-R529 WeakPolarHBondContact O-CA 3.24Å; I517-F530 HydrophobicContact CB-CD1 4.42Å; I517-F530 HydrophobicContact CB-CD2 4.45Å; I517-F530 HydrophobicContact CB-CE1 3.91Å; I517-F530 HydrophobicContact CB-CE2 3.94Å; I517-F530 HydrophobicContact CB-CZ 3.65Å; I517-F530 HydrophobicContact CG1-CE2 4Å; I517-F530 HydrophobicContact CG1-CZ 4.05Å; I517-F530 HydrophobicContact CG2-CE1 3.9Å; I517-F530 HydrophobicContact CG2-CZ 3.76Å; I517-F530 PolarHBondContact N-O 2.93Å; I517-F530 PolarHBondContact O-N 2.99Å; I517-L540 HydrophobicContact CD1-CD1 4.35Å; I517-L540 HydrophobicContact CG1-CD1 3.96Å; I517-P543 HydrophobicContact CD1-CB 3.94Å; I517-P543 HydrophobicContact CD1-CG 4.46Å; I517-V556 HydrophobicContact CD1-CG1 3.92Å; I517-V556 HydrophobicContact CD1-CG2 3.88Å; I517-V556 HydrophobicContact CG1-CG2 3.88Å
518	Q	96.7	Very high	94.3	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	139	174.4	-60.7	-165.3	60.5	0	0	109.3	E492 F493 V509 F520 R529	E492-Q518 PolarHBondContact O-NE2 2.76Å; F493-Q518 HydrophobicContact CE1-CB 4.27Å; F493-Q518 HydrophobicContact CE1-CG 4.44Å; V509-Q518 PolarHBondContact N-O 2.79Å; V509-Q518 PolarHBondContact O-N 3.07Å; Q518-F520 HydrophobicContact CB-CE2 3.54Å; Q518-F520 HydrophobicContact CB-CZ 3.95Å; Q518-R529 HydrophobicContact CG-CB 4.28Å; Q518-R529 HydrophobicContact CG-CG 4.03Å
519	V	96.5	Very high	94.2	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	133.3	-176.5	-174.5	0	0	0	0	109.1	R506 I507 V508 K527 M528 F530 I554	R506-V519 HydrophobicContact CB-CG1 4.13Å; R506-V519 HydrophobicContact CG-CG1 4.37Å; I507-V519 CarbonylContact O-C 3.49Å; I507-V519 WeakPolarHBondContact O-CA 3.35Å; V508-V519 HydrophobicContact CG1-CG2 4.31Å; V508-V519 HydrophobicContact CG2-CG1 4.26Å; V508-V519 HydrophobicContact CG2-CG2 4.28Å; V519-K527 HydrophobicContact CG1-CB 4.46Å; V519-K527 WeakPolarHBondContact O-CA 3.3Å; V519-K527 WeakPolarHBondContact O-CB 3.21Å; V519-K527 PolarHBondContact O-N 3.32Å; V519-M528 HydrophobicContact CB-CG 3.64Å; V519-M528 HydrophobicContact CG1-CG 4.42Å; V519-M528 HydrophobicContact CG2-CG 3.67Å; V519-M528 HydrophobicContact CG2-SD 4.31Å; V519-M528 PolarHBondContact N-O 3.39Å; V519-M528 PolarHBondContact O-N 3.02Å; V519-F530 HydrophobicContact CG2-CE1 4.12Å; V519-I554 HydrophobicContact CG2-CD1 4.25Å
520	F	96.4	Very high	94.1	Very high	1 Å²	1	36.1 Å²	36.1	0%	0.004	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	162.6	-177.9	-57.6	-96.4	0	0	0	110.4	V483 F493 R506 I507 V509 Q518 Q525 F526 F765	V483-F520 HydrophobicContact CG1-CD1 3.98Å; V483-F520 HydrophobicContact CG1-CE1 3.64Å; V483-F520 HydrophobicContact CG1-CZ 4.31Å; F493-F520 HydrophobicContact CE1-CE2 4.19Å; F493-F520 HydrophobicContact CE1-CZ 4.29Å; F493-F520 HydrophobicContact CE2-CZ 4.29Å; F493-F520 AromaticContact CZ-CE2 3.61Å; F493-F520 HydrophobicContact CZ-CE2 3.61Å; F493-F520 AromaticContact CZ-CZ 3.52Å; F493-F520 HydrophobicContact CZ-CZ 3.52Å; R506-F520 CarbonylContact C-O 3.41Å; R506-F520 VanDerWaalsContact CA-O 3.3Å; R506-F520 WeakPolarHBondContact CA-O 3.37Å; I507-F520 HydrophobicContact CB-CB 4.4Å; I507-F520 PolarHBondContact N-O 3.39Å; I507-F520 PolarHBondContact O-N 2.94Å; V509-F520 HydrophobicContact CG2-CD2 4.24Å; V509-F520 HydrophobicContact CG2-CE2 4.25Å; Q518-F520 HydrophobicContact CB-CE2 3.54Å; Q518-F520 HydrophobicContact CB-CZ 3.95Å; F520-Q525 CarbonylContact C-O 3.48Å; F520-Q525 WeakPolarHBondContact CA-O 3.39Å; F520-F526 HydrophobicContact CD1-CB 4.11Å; F520-F526 HydrophobicContact CD1-CD2 4.47Å; F520-F526 HydrophobicContact CE1-CB 3.98Å; F520-F526 AromaticContact CE1-CD2 3.85Å; F520-F526 HydrophobicContact CE1-CD2 3.85Å; F520-F526 HydrophobicContact CE1-CG 4.42Å; F520-F526 HydrophobicContact CZ-CD2 4.04Å; F520-F765 HydrophobicContact CB-CZ 4.16Å; F520-F765 HydrophobicContact CD1-CE1 4.18Å; F520-F765 HydrophobicContact CD1-CZ 4.29Å; F520-F765 AromaticContact CD2-CE1 3.7Å; F520-F765 HydrophobicContact CD2-CE1 3.7Å; F520-F765 HydrophobicContact CD2-CZ 4.06Å; F520-F765 HydrophobicContact CE1-CE1 4.28Å; F520-F765 AromaticContact CE2-CE1 3.82Å; F520-F765 HydrophobicContact CE2-CE1 3.82Å; F520-F765 AromaticContact CG-CE1 3.91Å; F520-F765 HydrophobicContact CG-CE1 3.91Å; F520-F765 AromaticContact CG-CZ 3.91Å; F520-F765 HydrophobicContact CG-CZ 3.91Å; F520-F765 HydrophobicContact CZ-CE1 4.12Å
521	S	93.6	Very high	93.7	Very high	9 Å²	9	37.5 Å²	37.5	6%	0.063	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	169.3	163	58.5	0	0	0	0	111.7	G505 D523 G524 Q525	G505-S521 WeakPolarHBondContact O-CA 3.2Å; S521-D523 PolarHBondContact O-N 3.26Å; S521-D523 PolarHBondContact OG-N 3.04Å; S521-G524 PolarHBondContact O-N 3.26Å; S521-Q525 PolarHBondContact N-O 2.92Å; S521-Q525 WeakPolarHBondContact OG-CB 3.09Å; S521-Q525 PolarHBondContact OG-N 3.44Å
522	N	91.2	Very high	93.5	Very high	14 Å²	14	42 Å²	42	8%	0.075	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-16.1	169.8	-72.4	4.4	0	0	0	114.6	Y481 G505 G524 S751 D752	Y481-N522 WeakPolarHBondContact CE1-O 3.5Å; Y481-N522 VanDerWaalsContact CZ-O 3.3Å; Y481-N522 VanDerWaalsContact OH-C 3.31Å; Y481-N522 PolarHBondContact OH-O 3.28Å; G505-N522 VanDerWaalsContact CA-OD1 3.31Å; G505-N522 WeakPolarHBondContact CA-OD1 3.11Å; G505-N522 PolarHBondContact O-N 3.42Å; G505-N522 VanDerWaalsContact O-N 3.14Å; G505-N522 PolarHBondContact O-OD1 3.06Å; N522-G524 VanDerWaalsContact C-N 3.3Å; N522-S751 PolarHBondContact ND2-OG 3.08Å; N522-D752 WeakPolarHBondContact CB-OD2 3.27Å; N522-D752 VanDerWaalsContact ND2-CG 3.26Å; N522-D752 PolarHBondContact ND2-OD1 3.45Å; N522-D752 PolarHBondContact ND2-OD2 2.9Å
523	D	88.6	Confident	93.5	Very high	121 Å²	121	49.8 Å²	49.8	65%	0.647	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.2	5.6	172.7	-44.4	-61.6	0	0	0	112.4	S521 Q525	S521-D523 PolarHBondContact O-N 3.26Å; S521-D523 PolarHBondContact OG-N 3.04Å; D523-Q525 PolarHBondContact O-N 2.93Å
524	G	90.6	Very high	93.5	Very high	11 Å²	11	46.5 Å²	46.5	11%	0.113	23%	0.23	C	C	.	.			trans	81.5	6.2	-179.9	0	0	0	0	0	115.6	Y481 V483 S521 N522	Y481-G524 PolarHBondContact OH-N 3Å; V483-G524 WeakPolarHBondContact CG2-O 3.46Å; S521-G524 PolarHBondContact O-N 3.26Å; N522-G524 VanDerWaalsContact C-N 3.3Å
525	Q	93	Very high	93.5	Very high	119 Å²	119	53.1 Å²	53.1	56%	0.556	25%	0.254	S	S	*	.			trans	-75.4	131.6	178	-60.7	-177.3	-0.8	0	0	111.4	F520 S521 D523 K527	F520-Q525 CarbonylContact C-O 3.48Å; F520-Q525 WeakPolarHBondContact CA-O 3.39Å; S521-Q525 PolarHBondContact N-O 2.92Å; S521-Q525 WeakPolarHBondContact OG-CB 3.09Å; S521-Q525 PolarHBondContact OG-N 3.44Å; D523-Q525 PolarHBondContact O-N 2.93Å; Q525-K527 PolarHBondContact O-N 3.24Å
526	F	95.2	Very high	93.5	Very high	68 Å²	68	54.7 Å²	54.7	30%	0.298	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	130.4	175.2	177.6	-90.7	0	0	0	111.4	K490 F520 R529	K490-F526 HydrophobicContact CB-CD1 4.29Å; K490-F526 HydrophobicContact CB-CD2 4.27Å; K490-F526 HydrophobicContact CB-CE1 4.07Å; K490-F526 HydrophobicContact CB-CE2 4.03Å; K490-F526 HydrophobicContact CB-CG 4.39Å; K490-F526 HydrophobicContact CB-CZ 3.92Å; K490-F526 HydrophobicContact CD-CD1 4.45Å; K490-F526 HydrophobicContact CD-CE1 3.87Å; K490-F526 HydrophobicContact CD-CZ 4.21Å; K490-F526 HydrophobicContact CG-CE1 4.04Å; K490-F526 HydrophobicContact CG-CE2 4.43Å; K490-F526 HydrophobicContact CG-CZ 3.88Å; F520-F526 HydrophobicContact CD1-CB 4.11Å; F520-F526 HydrophobicContact CD1-CD2 4.47Å; F520-F526 HydrophobicContact CE1-CB 3.98Å; F520-F526 AromaticContact CE1-CD2 3.85Å; F520-F526 HydrophobicContact CE1-CD2 3.85Å; F520-F526 HydrophobicContact CE1-CG 4.42Å; F520-F526 HydrophobicContact CZ-CD2 4.04Å; F526-R529 HydrophobicContact CE2-CB 3.92Å; F526-R529 HydrophobicContact CZ-CB 3.64Å
527	K	93.7	Very high	93.2	Very high	114 Å²	114	58 Å²	58	50%	0.496	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	-54.8	178.1	-64.2	-64.6	-177.3	-174.1	0	112.1	V519 Q525	V519-K527 HydrophobicContact CG1-CB 4.46Å; V519-K527 WeakPolarHBondContact O-CA 3.3Å; V519-K527 WeakPolarHBondContact O-CB 3.21Å; V519-K527 PolarHBondContact O-N 3.32Å; Q525-K527 PolarHBondContact O-N 3.24Å
528	M	94.8	Very high	92.7	Very high	49 Å²	49	58.9 Å²	58.9	24%	0.241	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.3	162.6	-177.7	65.5	174.1	78.3	0	0	112.3	V519 F530	V519-M528 HydrophobicContact CB-CG 3.64Å; V519-M528 HydrophobicContact CG1-CG 4.42Å; V519-M528 HydrophobicContact CG2-CG 3.67Å; V519-M528 HydrophobicContact CG2-SD 4.31Å; V519-M528 PolarHBondContact N-O 3.39Å; V519-M528 PolarHBondContact O-N 3.02Å; M528-F530 HydrophobicContact SD-CD1 4.41Å
529	R	94.7	Very high	92.5	Very high	93 Å²	93	61.6 Å²	61.6	35%	0.351	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	136.5	172.6	172.7	179	178.8	-171	5.6	109.1	R488 C516 I517 Q518 F526	R488-R529 VanDerWaalsContact O-CZ 3.27Å; R488-R529 PolarHBondContact O-NH1 2.95Å; R488-R529 PolarHBondContact O-NH2 3.4Å; R488-R529 VanDerWaalsContact O-NH2 3.08Å; C516-R529 HydrophobicContact CB-CG 4.26Å; C516-R529 PolarHBondContact SG-NE 3.48Å; I517-R529 WeakPolarHBondContact O-CA 3.24Å; Q518-R529 HydrophobicContact CG-CB 4.28Å; Q518-R529 HydrophobicContact CG-CG 4.03Å; F526-R529 HydrophobicContact CE2-CB 3.92Å; F526-R529 HydrophobicContact CZ-CB 3.64Å
530	F	94.8	Very high	92.4	Very high	25 Å²	25	61.6 Å²	61.6	11%	0.11	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	166.9	176.3	65.5	-88.4	0	0	0	110.8	C516 I517 V519 M528 I554 F567	C516-F530 WeakPolarHBondContact CA-O 3.31Å; C516-F530 WeakPolarHBondContact CB-O 3.49Å; I517-F530 HydrophobicContact CB-CD1 4.42Å; I517-F530 HydrophobicContact CB-CD2 4.45Å; I517-F530 HydrophobicContact CB-CE1 3.91Å; I517-F530 HydrophobicContact CB-CE2 3.94Å; I517-F530 HydrophobicContact CB-CZ 3.65Å; I517-F530 HydrophobicContact CG1-CE2 4Å; I517-F530 HydrophobicContact CG1-CZ 4.05Å; I517-F530 HydrophobicContact CG2-CE1 3.9Å; I517-F530 HydrophobicContact CG2-CZ 3.76Å; I517-F530 PolarHBondContact N-O 2.93Å; I517-F530 PolarHBondContact O-N 2.99Å; V519-F530 HydrophobicContact CG2-CE1 4.12Å; M528-F530 HydrophobicContact SD-CD1 4.41Å; F530-I554 HydrophobicContact CE1-CD1 3.71Å; F530-I554 HydrophobicContact CZ-CB 4.38Å; F530-I554 HydrophobicContact CZ-CD1 3.7Å; F530-I554 HydrophobicContact CZ-CG2 4.2Å; F530-F567 HydrophobicContact CD2-CD1 4.07Å; F530-F567 HydrophobicContact CD2-CE1 4.32Å; F530-F567 HydrophobicContact CD2-CG 4.38Å; F530-F567 HydrophobicContact CE2-CB 3.96Å; F530-F567 AromaticContact CE2-CD1 3.78Å; F530-F567 HydrophobicContact CE2-CD1 3.78Å; F530-F567 AromaticContact CE2-CD2 3.95Å; F530-F567 HydrophobicContact CE2-CD2 3.95Å; F530-F567 HydrophobicContact CE2-CE1 4.24Å; F530-F567 HydrophobicContact CE2-CE2 4.36Å; F530-F567 AromaticContact CE2-CG 3.63Å; F530-F567 HydrophobicContact CE2-CG 3.63Å; F530-F567 HydrophobicContact CZ-CB 4.29Å; F530-F567 HydrophobicContact CZ-CG 4.4Å
531	G	90.1	Very high	92.3	Very high	30 Å²	30	62.9 Å²	62.9	31%	0.309	32%	0.317	S	S	.	.			trans	116.4	128.6	-175.1	0	0	0	0	0	111.2
532	V	90.2	Very high	92.3	Very high	93 Å²	93	65.8 Å²	65.8	56%	0.564	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.1	135.2	177.1	178	0	0	0	0	107.7	G534 Q539 L540	V532-G534 PolarHBondContact O-N 3.14Å; V532-Q539 HydrophobicContact CB-CG 4.35Å; V532-Q539 HydrophobicContact CG1-CG 4.47Å; V532-Q539 CarbonylContact O-C 3.24Å; V532-Q539 WeakPolarHBondContact O-CA 3.38Å; V532-Q539 VanDerWaalsContact O-CB 3.25Å; V532-Q539 WeakPolarHBondContact O-CB 3.27Å; V532-L540 PolarHBondContact O-N 3.16Å
533	R	93	Very high	92.5	Very high	167 Å²	167	65.1 Å²	65.1	63%	0.63	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-57.7	129.5	176.6	-178.4	-178.4	-178.8	156.6	-5.9	110.9	Q515 L540	Q515-R533 HydrophobicContact CB-CB 4.48Å; Q515-R533 HydrophobicContact CG-CG 4.47Å; Q515-R533 VanDerWaalsContact OE1-CB 3.23Å; R533-L540 VanDerWaalsContact CA-O 3.32Å; R533-L540 WeakPolarHBondContact CA-O 3.22Å
534	G	91.7	Very high	92.8	Very high	12 Å²	12	59.4 Å²	59.4	12%	0.124	29%	0.293	C	S	.	.	S	Bend	trans	154	-166.9	164.9	0	0	0	0	0	114.2	V532 Q539 L540 N561	V532-G534 PolarHBondContact O-N 3.14Å; G534-Q539 VanDerWaalsContact CA-OE1 3.24Å; G534-L540 PolarHBondContact N-O 3.13Å; G534-L540 CarbonylContact O-C 3.57Å; G534-N561 PolarHBondContact O-ND2 3.27Å
535	R	92.9	Very high	93	Very high	156 Å²	156	58.9 Å²	58.9	59%	0.589	29%	0.287	S	S	*	.	S	Bend	trans	-119.3	6.7	-170.7	-58.1	-176.8	178.2	-96.1	1.7	113.2	Q539 N561 W563	R535-Q539 VanDerWaalsContact N-OE1 3.15Å; R535-N561 WeakPolarHBondContact CA-OD1 3.36Å; R535-N561 WeakPolarHBondContact CG-OD1 3.36Å; R535-W563 WeakPolarHBondContact O-CH2 3.28Å
536	S	93.1	Very high	93.2	Very high	65 Å²	65	53.6 Å²	53.6	46%	0.455	26%	0.263	S	S	.	.	S	Bend	trans	-88.3	160.6	175.6	-62.5	0	0	0	0	111	G538 Q539	S536-G538 PolarHBondContact O-N 3.37Å; S536-Q539 VanDerWaalsContact N-OE1 3.07Å; S536-Q539 WeakPolarHBondContact O-CB 3.11Å; S536-Q539 PolarHBondContact O-N 3.09Å
537	P	89.2	Confident	93.3	Very high	72 Å²	72	51.1 Å²	51.1	47%	0.468	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.3	133.8	171.5	-24.7	34.3	0	0	0	111.7	Q539 F573 K576	P537-Q539 VanDerWaalsContact C-N 3.27Å; P537-Q539 PolarHBondContact O-N 3.19Å; P537-F573 HydrophobicContact CB-CD1 4.46Å; P537-F573 HydrophobicContact CB-CE1 3.61Å; P537-F573 HydrophobicContact CB-CZ 3.65Å; P537-K576 HydrophobicContact CB-CD 4.46Å; P537-K576 HydrophobicContact CG-CD 4.27Å
538	G	86	Confident	93.3	Very high	17 Å²	17	46.6 Å²	46.6	18%	0.175	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.9	-11.8	-174.8	0	0	0	0	0	115.7	S536 F573	S536-G538 PolarHBondContact O-N 3.37Å; G538-F573 VanDerWaalsContact N-CD2 3.35Å
539	Q	93.9	Very high	93.2	Very high	57 Å²	57	45.5 Å²	45.5	27%	0.266	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	155.5	171.6	-64	177.9	-20.4	0	0	111.3	V532 G534 R535 S536 P537	V532-Q539 HydrophobicContact CB-CG 4.35Å; V532-Q539 HydrophobicContact CG1-CG 4.47Å; V532-Q539 CarbonylContact O-C 3.24Å; V532-Q539 WeakPolarHBondContact O-CA 3.38Å; V532-Q539 VanDerWaalsContact O-CB 3.25Å; V532-Q539 WeakPolarHBondContact O-CB 3.27Å; G534-Q539 VanDerWaalsContact CA-OE1 3.24Å; R535-Q539 VanDerWaalsContact N-OE1 3.15Å; S536-Q539 VanDerWaalsContact N-OE1 3.07Å; S536-Q539 WeakPolarHBondContact O-CB 3.11Å; S536-Q539 PolarHBondContact O-N 3.09Å; P537-Q539 VanDerWaalsContact C-N 3.27Å; P537-Q539 PolarHBondContact O-N 3.19Å
540	L	94.6	Very high	92.9	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	138.8	-178.6	-62.3	175.1	0	0	0	110.3	I517 V532 R533 G534 P543 V556 D558 F567	I517-L540 HydrophobicContact CD1-CD1 4.35Å; I517-L540 HydrophobicContact CG1-CD1 3.96Å; V532-L540 PolarHBondContact O-N 3.16Å; R533-L540 VanDerWaalsContact CA-O 3.32Å; R533-L540 WeakPolarHBondContact CA-O 3.22Å; G534-L540 PolarHBondContact N-O 3.13Å; G534-L540 CarbonylContact O-C 3.57Å; L540-P543 HydrophobicContact CB-CG 4.39Å; L540-P543 HydrophobicContact CD1-CB 4.33Å; L540-P543 HydrophobicContact CD1-CG 4.32Å; L540-V556 HydrophobicContact CD2-CG1 4.07Å; L540-D558 VanDerWaalsContact CA-OD2 3.28Å; L540-D558 WeakPolarHBondContact CA-OD2 3.31Å; L540-F567 HydrophobicContact CD2-CE2 4.13Å; L540-F567 HydrophobicContact CD2-CZ 4.09Å; L540-F567 HydrophobicContact CG-CZ 4.35Å
541	Q	93.5	Very high	92.6	Very high	28 Å²	28	53 Å²	53	13%	0.131	28%	0.276	C	S	.	.	S	Bend	trans	-115	-45.5	178.3	-174.6	57	57.3	0	0	112	Q515 D558 D560 N561	Q515-Q541 VanDerWaalsContact CG-O 3.22Å; Q515-Q541 WeakPolarHBondContact CG-O 3.22Å; Q541-D558 PolarHBondContact N-OD2 3.26Å; Q541-D560 HydrophobicContact CB-CB 4.06Å; Q541-D560 HydrophobicContact CG-CB 3.6Å; Q541-N561 WeakPolarHBondContact CB-ND2 3.3Å; Q541-N561 WeakPolarHBondContact CB-OD1 3.48Å; Q541-N561 PolarHBondContact N-ND2 3.28Å
542	R	93.8	Very high	92.6	Very high	71 Å²	71	52 Å²	52	27%	0.268	27%	0.266	S	S	.	.			trans	-149.2	75.7	172.5	-163	171.4	89.2	137.6	5.3	109.9	T544 D558 Y559 D560	R542-T544 HydrophobicContact CG-CG2 4.42Å; R542-T544 PolarHBondContact O-N 2.87Å; R542-D558 PolarHBondContact N-OD1 3.13Å; R542-Y559 VanDerWaalsContact CZ-CD1 3.46Å; R542-Y559 VanDerWaalsContact NH2-CZ 3.3Å; R542-Y559 PolarHBondContact O-N 3.19Å; R542-D560 HydrophobicContact CB-CB 3.9Å; R542-D560 WeakPolarHBondContact CB-OD2 3.31Å; R542-D560 IonicContact NE-OD1 2.65Å
543	P	96.3	Very high	92.8	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	124.6	177.4	27.7	-32.6	0	0	0	109	A510 S512 I517 L540 V556	A510-P543 HydrophobicContact CB-CB 4.32Å; S512-P543 VanDerWaalsContact CA-O 3.32Å; S512-P543 WeakPolarHBondContact CA-O 2.99Å; S512-P543 VanDerWaalsContact CB-O 3.31Å; S512-P543 WeakPolarHBondContact CB-O 3.19Å; S512-P543 PolarHBondContact OG-O 3.15Å; I517-P543 HydrophobicContact CD1-CB 3.94Å; I517-P543 HydrophobicContact CD1-CG 4.46Å; L540-P543 HydrophobicContact CB-CG 4.39Å; L540-P543 HydrophobicContact CD1-CB 4.33Å; L540-P543 HydrophobicContact CD1-CG 4.32Å; P543-V556 HydrophobicContact CB-CG1 3.61Å
544	T	94.8	Very high	92.9	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	-80.2	-175.1	48.9	0	0	0	0	110.2	G498 A510 R542 A557 Y559 P585 K586	G498-T544 WeakPolarHBondContact CA-O 3.49Å; G498-T544 PolarHBondContact N-O 3.24Å; A510-T544 WeakPolarHBondContact CB-O 3.47Å; R542-T544 HydrophobicContact CG-CG2 4.42Å; R542-T544 PolarHBondContact O-N 2.87Å; T544-A557 PolarHBondContact N-O 3.44Å; T544-A557 PolarHBondContact OG1-O 3.01Å; T544-Y559 HydrophobicContact CG2-CG 4.41Å; T544-P585 PolarHBondContact OG1-O 3.11Å; T544-K586 WeakPolarHBondContact OG1-CA 3.49Å; T544-K586 PolarHBondContact OG1-O 2.96Å
545	G	94.8	Very high	93.2	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	144.3	173.2	0	0	0	0	0	111.8	A557 K586	G545-A557 PolarHBondContact O-N 3.03Å; G545-K586 WeakPolarHBondContact CA-O 3.44Å; G545-K586 PolarHBondContact N-O 3.06Å
546	V	97.1	Very high	93.4	Very high	8 Å²	8	32.9 Å²	32.9	5%	0.048	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	144.2	171.9	62.6	0	0	0	0	108.3	S500 V508 A510 I554 I555 V556	S500-V546 WeakPolarHBondContact CB-O 3.43Å; V508-V546 HydrophobicContact CB-CG2 4.34Å; V508-V546 HydrophobicContact CG1-CG1 4.5Å; V508-V546 HydrophobicContact CG1-CG2 3.59Å; V508-V546 WeakPolarHBondContact O-CG1 3.47Å; A510-V546 HydrophobicContact CB-CB 4.23Å; A510-V546 HydrophobicContact CB-CG1 4.12Å; V546-I554 HydrophobicContact CG2-CG2 3.65Å; V546-I555 CarbonylContact C-O 3.58Å; V546-I555 WeakPolarHBondContact CA-O 3.36Å; V546-V556 HydrophobicContact CG2-CG2 4.18Å
547	T	96.4	Very high	93.5	Very high	16 Å²	16	29.8 Å²	29.8	10%	0.098	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	159.1	173.4	-170	0	0	0	0	109.3	S500 I555 V588 V590	S500-T547 WeakPolarHBondContact OG-CA 3.45Å; T547-I555 HydrophobicContact CG2-CB 3.8Å; T547-I555 HydrophobicContact CG2-CD1 4.26Å; T547-I555 HydrophobicContact CG2-CG2 4.23Å; T547-I555 PolarHBondContact N-O 2.65Å; T547-I555 PolarHBondContact O-N 3.26Å; T547-V588 HydrophobicContact CG2-CB 4.37Å; T547-V588 HydrophobicContact CG2-CG1 3.85Å; T547-V588 HydrophobicContact CG2-CG2 3.92Å; T547-V590 HydrophobicContact CG2-CG2 3.66Å
548	V	94.8	Very high	93.8	Very high	20 Å²	20	26.4 Å²	26.4	12%	0.121	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	129.3	177.4	-173.8	0	0	0	0	108.1	S500 V508 D553 I554	S500-V548 PolarHBondContact OG-N 3.19Å; V508-V548 HydrophobicContact CB-CG2 4.3Å; V508-V548 HydrophobicContact CG2-CG2 3.67Å; V548-D553 WeakPolarHBondContact CA-O 3.4Å; V548-I554 HydrophobicContact CG2-CG1 4.49Å
549	D	92	Very high	94.2	Very high	26 Å²	26	26.8 Å²	26.8	14%	0.139	13%	0.134	C	C	.	.			trans	-80.3	176.4	176.9	87.6	-17.8	0	0	0	112	N551 G552 D553 I555 V590	D549-N551 PolarHBondContact O-N 3.38Å; D549-N551 WeakPolarHBondContact OD1-CA 3.34Å; D549-N551 WeakPolarHBondContact OD1-CB 3.35Å; D549-N551 PolarHBondContact OD1-N 2.99Å; D549-N551 PolarHBondContact OD2-ND2 3.46Å; D549-G552 PolarHBondContact O-N 3.13Å; D549-G552 VanDerWaalsContact O-N 3.07Å; D549-G552 PolarHBondContact OD1-N 2.8Å; D549-D553 PolarHBondContact N-O 3.47Å; D549-D553 WeakPolarHBondContact OD1-CA 3.29Å; D549-D553 WeakPolarHBondContact OD1-CB 3.14Å; D549-D553 PolarHBondContact OD1-N 2.9Å; D549-I555 HydrophobicContact CB-CD1 4Å; D549-V590 HydrophobicContact CB-CG1 4.34Å; D549-V590 HydrophobicContact CB-CG2 4.34Å
550	M	87.6	Confident	94.1	Very high	143 Å²	143	26.7 Å²	26.7	70%	0.704	14%	0.135	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-21.3	178.2	-65.9	179.4	172.1	0	0	114	G552 K592	M550-G552 VanDerWaalsContact C-N 3.3Å; M550-K592 HydrophobicContact CE-CB 4.02Å
551	N	88.6	Confident	94.1	Very high	132 Å²	132	27.3 Å²	27.3	71%	0.706	14%	0.139	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-6.3	176.6	-53.9	-56.7	0	0	0	112.2	D549	D549-N551 PolarHBondContact O-N 3.38Å; D549-N551 WeakPolarHBondContact OD1-CA 3.34Å; D549-N551 WeakPolarHBondContact OD1-CB 3.35Å; D549-N551 PolarHBondContact OD1-N 2.99Å; D549-N551 PolarHBondContact OD2-ND2 3.46Å
552	G	89.8	Confident	94.1	Very high	9 Å²	9	31.7 Å²	31.7	9%	0.093	15%	0.154	C	C	.	.			trans	82.8	8.7	-174.4	0	0	0	0	0	114.2	D549 M550 S569	D549-G552 PolarHBondContact O-N 3.13Å; D549-G552 VanDerWaalsContact O-N 3.07Å; D549-G552 PolarHBondContact OD1-N 2.8Å; M550-G552 VanDerWaalsContact C-N 3.3Å; G552-S569 WeakPolarHBondContact O-CA 3.49Å; G552-S569 WeakPolarHBondContact O-CB 3.39Å
553	D	94.3	Very high	94.2	Very high	20 Å²	20	29.7 Å²	29.7	11%	0.107	15%	0.147	C	C	.	.			trans	-68.1	138.2	171	-70.7	-26.7	0	0	0	109.8	V548 D549 I566 F567 S568 K574	V548-D553 WeakPolarHBondContact CA-O 3.4Å; D549-D553 PolarHBondContact N-O 3.47Å; D549-D553 WeakPolarHBondContact OD1-CA 3.29Å; D549-D553 WeakPolarHBondContact OD1-CB 3.14Å; D549-D553 PolarHBondContact OD1-N 2.9Å; D553-I566 HydrophobicContact CB-CG2 4.14Å; D553-F567 CarbonylContact C-O 3.42Å; D553-F567 VanDerWaalsContact CA-O 3.27Å; D553-F567 WeakPolarHBondContact CA-O 3.48Å; D553-F567 WeakPolarHBondContact CB-O 3.47Å; D553-S568 WeakPolarHBondContact OD1-CA 3.43Å; D553-K574 WeakPolarHBondContact OD1-CD 3.37Å; D553-K574 IonicContact OD1-NZ 2.88Å; D553-K574 PolarHBondContact OD1-NZ 3.09Å; D553-K574 IonicContact OD2-NZ 2.6Å; D553-K574 PolarHBondContact OD2-NZ 3.2Å
554	I	96.4	Very high	94.2	Very high	4 Å²	4	29.7 Å²	29.7	2%	0.021	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	116.6	-179.3	-57.6	170.7	0	0	0	108.6	V508 V519 F530 V546 V548 V556 F567	V508-I554 HydrophobicContact CG1-CD1 4.35Å; V508-I554 HydrophobicContact CG1-CG2 3.87Å; V508-I554 HydrophobicContact CG2-CD1 4.37Å; V519-I554 HydrophobicContact CG2-CD1 4.25Å; F530-I554 HydrophobicContact CE1-CD1 3.71Å; F530-I554 HydrophobicContact CZ-CB 4.38Å; F530-I554 HydrophobicContact CZ-CD1 3.7Å; F530-I554 HydrophobicContact CZ-CG2 4.2Å; V546-I554 HydrophobicContact CG2-CG2 3.65Å; V548-I554 HydrophobicContact CG2-CG1 4.49Å; I554-V556 HydrophobicContact CG2-CG2 3.98Å; I554-F567 HydrophobicContact CB-CB 4.39Å; I554-F567 PolarHBondContact N-O 3Å; I554-F567 PolarHBondContact O-N 3.47Å
555	I	96.9	Very high	94.3	Very high	3 Å²	3	29.7 Å²	29.7	2%	0.015	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	123.9	-178	-61.3	159.2	0	0	0	108.5	V546 T547 D549 I564 I566 V588 V590 I596	V546-I555 CarbonylContact C-O 3.58Å; V546-I555 WeakPolarHBondContact CA-O 3.36Å; T547-I555 HydrophobicContact CG2-CB 3.8Å; T547-I555 HydrophobicContact CG2-CD1 4.26Å; T547-I555 HydrophobicContact CG2-CG2 4.23Å; T547-I555 PolarHBondContact N-O 2.65Å; T547-I555 PolarHBondContact O-N 3.26Å; D549-I555 HydrophobicContact CB-CD1 4Å; I555-I564 HydrophobicContact CG2-CG2 3.29Å; I555-I566 HydrophobicContact CG1-CG1 4.34Å; I555-I566 HydrophobicContact CG1-CG2 4.27Å; I555-V588 HydrophobicContact CG2-CG2 3.84Å; I555-V590 HydrophobicContact CD1-CG2 3.45Å; I555-V590 VanDerWaalsContact CD1-CG2 3.45Å; I555-I596 HydrophobicContact CD1-CD1 3.92Å; I555-I596 HydrophobicContact CD1-CG1 3.97Å; I555-I596 HydrophobicContact CG1-CD1 4.44Å; I555-I596 HydrophobicContact CG2-CD1 4.48Å; I555-I596 HydrophobicContact CG2-CG2 4.02Å
556	V	97.2	Very high	94.3	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	122.1	-171.7	-177.7	0	0	0	0	110.4	I517 L540 P543 V546 I554 D558 I564 S565 F567	I517-V556 HydrophobicContact CD1-CG1 3.92Å; I517-V556 HydrophobicContact CD1-CG2 3.88Å; I517-V556 HydrophobicContact CG1-CG2 3.88Å; L540-V556 HydrophobicContact CD2-CG1 4.07Å; P543-V556 HydrophobicContact CB-CG1 3.61Å; V546-V556 HydrophobicContact CG2-CG2 4.18Å; I554-V556 HydrophobicContact CG2-CG2 3.98Å; V556-D558 PolarHBondContact O-N 2.99Å; V556-I564 CarbonylContact O-C 3.59Å; V556-I564 VanDerWaalsContact O-CA 3.3Å; V556-I564 WeakPolarHBondContact O-CA 3.29Å; V556-S565 PolarHBondContact N-O 2.85Å; V556-S565 PolarHBondContact O-N 3.23Å; V556-F567 HydrophobicContact CB-CE2 4.31Å; V556-F567 HydrophobicContact CG2-CD2 3.99Å; V556-F567 HydrophobicContact CG2-CE2 4.05Å
557	A	96.5	Very high	94.3	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	110.8	170	0	0	0	0	0	110.3	T544 G545 P585 V588	T544-A557 PolarHBondContact N-O 3.44Å; T544-A557 PolarHBondContact OG1-O 3.01Å; G545-A557 PolarHBondContact O-N 3.03Å; A557-P585 HydrophobicContact CB-CB 4.08Å; A557-V588 HydrophobicContact CB-CB 4.22Å; A557-V588 HydrophobicContact CB-CG1 4.15Å
558	D	95.1	Very high	94.2	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	105.9	176.8	-167.4	-30	0	0	0	110.6	L540 Q541 R542 V556 D560 N561 R562 W563 P585	L540-D558 VanDerWaalsContact CA-OD2 3.28Å; L540-D558 WeakPolarHBondContact CA-OD2 3.31Å; Q541-D558 PolarHBondContact N-OD2 3.26Å; R542-D558 PolarHBondContact N-OD1 3.13Å; V556-D558 PolarHBondContact O-N 2.99Å; D558-D560 PolarHBondContact O-N 2.99Å; D558-D560 PolarHBondContact OD1-N 2.97Å; D558-N561 HydrophobicContact CB-CB 4.02Å; D558-N561 PolarHBondContact OD1-N 3.47Å; D558-N561 PolarHBondContact OD2-ND2 3.39Å; D558-R562 WeakPolarHBondContact O-CA 3.26Å; D558-R562 PolarHBondContact O-N 3.3Å; D558-W563 PolarHBondContact N-O 2.93Å; D558-P585 WeakPolarHBondContact O-CG 3.44Å
559	Y	93.4	Very high	94.1	Very high	25 Å²	25	31.5 Å²	31.5	10%	0.098	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-39.2	-171	-175	-81.2	0	0	0	112.9	R542 T544 P585 K586 N601 K602	R542-Y559 VanDerWaalsContact CZ-CD1 3.46Å; R542-Y559 VanDerWaalsContact NH2-CZ 3.3Å; R542-Y559 PolarHBondContact O-N 3.19Å; T544-Y559 HydrophobicContact CG2-CG 4.41Å; Y559-P585 WeakPolarHBondContact CA-O 3.44Å; Y559-P585 WeakPolarHBondContact CD2-O 3.46Å; Y559-K586 HydrophobicContact CD2-CB 4.44Å; Y559-N601 HydrophobicContact CE2-CB 4.12Å; Y559-K602 VanDerWaalsContact CE1-CE 3.49Å; Y559-K602 WeakPolarHBondContact OH-CE 3.37Å
560	D	92.7	Very high	94.1	Very high	55 Å²	55	33.9 Å²	33.9	29%	0.294	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-30.1	-174.5	-81.4	-17.6	0	0	0	112.6	Q541 R542 D558 R562	Q541-D560 HydrophobicContact CB-CB 4.06Å; Q541-D560 HydrophobicContact CG-CB 3.6Å; R542-D560 HydrophobicContact CB-CB 3.9Å; R542-D560 WeakPolarHBondContact CB-OD2 3.31Å; R542-D560 IonicContact NE-OD1 2.65Å; D558-D560 PolarHBondContact O-N 2.99Å; D558-D560 PolarHBondContact OD1-N 2.97Å; D560-R562 VanDerWaalsContact C-N 3.27Å
561	N	93.4	Very high	94.3	Very high	14 Å²	14	27.6 Å²	27.6	8%	0.075	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-16.6	169.8	-74.3	-26.5	0	0	0	112.8	G534 R535 Q541 D558 W563	G534-N561 PolarHBondContact O-ND2 3.27Å; R535-N561 WeakPolarHBondContact CA-OD1 3.36Å; R535-N561 WeakPolarHBondContact CG-OD1 3.36Å; Q541-N561 WeakPolarHBondContact CB-ND2 3.3Å; Q541-N561 WeakPolarHBondContact CB-OD1 3.48Å; Q541-N561 PolarHBondContact N-ND2 3.28Å; D558-N561 HydrophobicContact CB-CB 4.02Å; D558-N561 PolarHBondContact OD1-N 3.47Å; D558-N561 PolarHBondContact OD2-ND2 3.39Å; N561-W563 VanDerWaalsContact C-N 3.32Å; N561-W563 HydrophobicContact CB-CD2 4.06Å; N561-W563 HydrophobicContact CB-CG 4.44Å; N561-W563 HydrophobicContact CB-CZ2 3.88Å; N561-W563 PolarHBondContact O-N 3.35Å
562	R	94.9	Very high	94.6	Very high	119 Å²	119	28 Å²	28	45%	0.449	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.3	39.9	174.6	-39.5	179.1	-153.6	174.9	4.5	112.9	D558 D560 L582 M583	D558-R562 WeakPolarHBondContact O-CA 3.26Å; D558-R562 PolarHBondContact O-N 3.3Å; D560-R562 VanDerWaalsContact C-N 3.27Å; R562-L582 WeakPolarHBondContact CB-O 3.48Å; R562-L582 WeakPolarHBondContact O-CB 3.46Å; R562-M583 WeakPolarHBondContact CD-O 3.33Å; R562-M583 WeakPolarHBondContact CG-O 3.27Å
563	W	95.1	Very high	94.9	Very high	30 Å²	30	31 Å²	31	11%	0.114	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	173	171.5	57.4	55.2	0	0	0	109.7	R535 D558 N561 S565 K576 I577 A579	R535-W563 WeakPolarHBondContact O-CH2 3.28Å; D558-W563 PolarHBondContact N-O 2.93Å; N561-W563 VanDerWaalsContact C-N 3.32Å; N561-W563 HydrophobicContact CB-CD2 4.06Å; N561-W563 HydrophobicContact CB-CG 4.44Å; N561-W563 HydrophobicContact CB-CZ2 3.88Å; N561-W563 PolarHBondContact O-N 3.35Å; W563-S565 PolarHBondContact NE1-OG 2.96Å; W563-K576 HydrophobicContact CD2-CD 4.15Å; W563-K576 HydrophobicContact CE3-CD 4.26Å; W563-K576 HydrophobicContact CZ2-CD 4.49Å; W563-K576 HydrophobicContact CZ3-CD 4.49Å; W563-I577 WeakPolarHBondContact CB-O 3.31Å; W563-A579 HydrophobicContact CB-CB 4.19Å; W563-A579 HydrophobicContact CE3-CB 3.9Å
564	I	96.7	Very high	94.9	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	131	172	-59.2	159.9	0	0	0	107.4	I555 V556 K576 I577 L582 I596 A598 F609	I555-I564 HydrophobicContact CG2-CG2 3.29Å; V556-I564 CarbonylContact O-C 3.59Å; V556-I564 VanDerWaalsContact O-CA 3.3Å; V556-I564 WeakPolarHBondContact O-CA 3.29Å; I564-K576 CarbonylContact O-C 3.58Å; I564-K576 VanDerWaalsContact O-CA 3.28Å; I564-K576 WeakPolarHBondContact O-CA 3.4Å; I564-I577 HydrophobicContact CB-CD1 4.33Å; I564-I577 HydrophobicContact CB-CG1 3.72Å; I564-I577 HydrophobicContact CD1-CD1 4.23Å; I564-I577 HydrophobicContact CD1-CG1 4.21Å; I564-I577 HydrophobicContact CG2-CD1 4.41Å; I564-I577 HydrophobicContact CG2-CG1 4.19Å; I564-I577 PolarHBondContact N-O 3.01Å; I564-I577 PolarHBondContact O-N 3.36Å; I564-L582 HydrophobicContact CD1-CD1 3.81Å; I564-L582 HydrophobicContact CG1-CD1 3.78Å; I564-I596 HydrophobicContact CD1-CG2 4.17Å; I564-A598 HydrophobicContact CD1-CB 3.42Å; I564-A598 VanDerWaalsContact CD1-CB 3.42Å; I564-A598 HydrophobicContact CG1-CB 4.45Å; I564-F609 HydrophobicContact CD1-CD2 4.34Å; I564-F609 HydrophobicContact CD1-CE2 4.28Å
565	S	95.7	Very high	94.8	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	133.1	176	-64.6	0	0	0	0	109.2	V556 W563	V556-S565 PolarHBondContact N-O 2.85Å; V556-S565 PolarHBondContact O-N 3.23Å; W563-S565 PolarHBondContact NE1-OG 2.96Å
566	I	95.8	Very high	94.6	Very high	11 Å²	11	41.2 Å²	41.2	6%	0.056	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	122.6	176.3	-51.3	-176.7	0	0	0	107.9	D553 I555 K574 S575 I577 I596	D553-I566 HydrophobicContact CB-CG2 4.14Å; I555-I566 HydrophobicContact CG1-CG1 4.34Å; I555-I566 HydrophobicContact CG1-CG2 4.27Å; I566-K574 HydrophobicContact CG2-CD 4.48Å; I566-K574 PolarHBondContact O-N 2.95Å; I566-S575 PolarHBondContact N-O 3.02Å; I566-S575 PolarHBondContact O-N 3.38Å; I566-I577 HydrophobicContact CD1-CG2 4.3Å; I566-I596 HydrophobicContact CD1-CD1 3.73Å
567	F	96.4	Very high	94.5	Very high	4 Å²	4	41.6 Å²	41.6	2%	0.018	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	150.3	176.1	-60.9	-94	0	0	0	109.4	F530 L540 D553 I554 V556 K572 F573	F530-F567 HydrophobicContact CD2-CD1 4.07Å; F530-F567 HydrophobicContact CD2-CE1 4.32Å; F530-F567 HydrophobicContact CD2-CG 4.38Å; F530-F567 HydrophobicContact CE2-CB 3.96Å; F530-F567 AromaticContact CE2-CD1 3.78Å; F530-F567 HydrophobicContact CE2-CD1 3.78Å; F530-F567 AromaticContact CE2-CD2 3.95Å; F530-F567 HydrophobicContact CE2-CD2 3.95Å; F530-F567 HydrophobicContact CE2-CE1 4.24Å; F530-F567 HydrophobicContact CE2-CE2 4.36Å; F530-F567 AromaticContact CE2-CG 3.63Å; F530-F567 HydrophobicContact CE2-CG 3.63Å; F530-F567 HydrophobicContact CZ-CB 4.29Å; F530-F567 HydrophobicContact CZ-CG 4.4Å; L540-F567 HydrophobicContact CD2-CE2 4.13Å; L540-F567 HydrophobicContact CD2-CZ 4.09Å; L540-F567 HydrophobicContact CG-CZ 4.35Å; D553-F567 CarbonylContact C-O 3.42Å; D553-F567 VanDerWaalsContact CA-O 3.27Å; D553-F567 WeakPolarHBondContact CA-O 3.48Å; D553-F567 WeakPolarHBondContact CB-O 3.47Å; I554-F567 HydrophobicContact CB-CB 4.39Å; I554-F567 PolarHBondContact N-O 3Å; I554-F567 PolarHBondContact O-N 3.47Å; V556-F567 HydrophobicContact CB-CE2 4.31Å; V556-F567 HydrophobicContact CG2-CD2 3.99Å; V556-F567 HydrophobicContact CG2-CE2 4.05Å; F567-K572 CarbonylContact C-O 3.45Å; F567-K572 WeakPolarHBondContact CA-O 3.12Å; F567-F573 HydrophobicContact CD1-CB 4.07Å; F567-F573 HydrophobicContact CD1-CD2 4.5Å; F567-F573 HydrophobicContact CE1-CB 3.95Å; F567-F573 HydrophobicContact CE1-CD2 4.1Å; F567-F573 HydrophobicContact CZ-CD2 4.31Å
568	S	95	Very high	94.2	Very high	20 Å²	20	42 Å²	42	14%	0.14	21%	0.205	C	C	.	.			trans	-70.5	168.9	168.6	47.5	0	0	0	0	111.5	D553 D570 G571 K572	D553-S568 WeakPolarHBondContact OD1-CA 3.43Å; S568-D570 WeakPolarHBondContact CB-OD1 3.38Å; S568-D570 PolarHBondContact O-N 3.34Å; S568-D570 VanDerWaalsContact O-N 3.09Å; S568-D570 PolarHBondContact OG-OD1 2.93Å; S568-G571 PolarHBondContact O-N 2.75Å; S568-K572 PolarHBondContact N-O 3.37Å; S568-K572 WeakPolarHBondContact OG-CB 3.45Å; S568-K572 PolarHBondContact OG-N 3.43Å; S568-K572 PolarHBondContact OG-O 3.34Å; S568-K572 VanDerWaalsContact OG-O 3.11Å
569	S	92.4	Very high	93.9	Very high	47 Å²	47	44.3 Å²	44.3	33%	0.329	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-14.6	178.7	65.9	0	0	0	0	115	R506 G552	R506-S569 PolarHBondContact NH1-O 3.47Å; G552-S569 WeakPolarHBondContact O-CA 3.49Å; G552-S569 WeakPolarHBondContact O-CB 3.39Å
570	D	91.6	Very high	93.5	Very high	75 Å²	75	47 Å²	47	40%	0.401	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.6	5.1	172.2	68.5	-28.2	0	0	0	113.4	S568 K572	S568-D570 WeakPolarHBondContact CB-OD1 3.38Å; S568-D570 PolarHBondContact O-N 3.34Å; S568-D570 VanDerWaalsContact O-N 3.09Å; S568-D570 PolarHBondContact OG-OD1 2.93Å; D570-K572 VanDerWaalsContact OD2-CD 3.3Å; D570-K572 WeakPolarHBondContact OD2-CD 3.48Å; D570-K572 WeakPolarHBondContact OD2-CE 3.45Å; D570-K572 IonicContact OD2-NZ 2.72Å; D570-K572 PolarHBondContact OD2-NZ 3.18Å
571	G	92.7	Very high	93.4	Very high	12 Å²	12	51.2 Å²	51.2	12%	0.124	27%	0.272	C	S	.	.	S	Bend	trans	83.9	12.3	175.4	0	0	0	0	0	115.3	S568	S568-G571 PolarHBondContact O-N 2.75Å
572	K	94.4	Very high	93.3	Very high	139 Å²	139	50.7 Å²	50.7	60%	0.604	27%	0.269	S	S	*	.			trans	-81.6	138.5	174.2	-62.9	176.8	179.4	131.9	0	110.8	F567 S568 D570 K574	F567-K572 CarbonylContact C-O 3.45Å; F567-K572 WeakPolarHBondContact CA-O 3.12Å; S568-K572 PolarHBondContact N-O 3.37Å; S568-K572 WeakPolarHBondContact OG-CB 3.45Å; S568-K572 PolarHBondContact OG-N 3.43Å; S568-K572 PolarHBondContact OG-O 3.34Å; S568-K572 VanDerWaalsContact OG-O 3.11Å; D570-K572 VanDerWaalsContact OD2-CD 3.3Å; D570-K572 WeakPolarHBondContact OD2-CD 3.48Å; D570-K572 WeakPolarHBondContact OD2-CE 3.45Å; D570-K572 IonicContact OD2-NZ 2.72Å; D570-K572 PolarHBondContact OD2-NZ 3.18Å; K572-K574 PolarHBondContact O-N 3.49Å
573	F	95.6	Very high	93.1	Very high	72 Å²	72	49.1 Å²	49.1	32%	0.316	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	128.3	178.1	176.1	-104.8	0	0	0	111.1	P537 G538 F567 S575 K576	P537-F573 HydrophobicContact CB-CD1 4.46Å; P537-F573 HydrophobicContact CB-CE1 3.61Å; P537-F573 HydrophobicContact CB-CZ 3.65Å; G538-F573 VanDerWaalsContact N-CD2 3.35Å; F567-F573 HydrophobicContact CD1-CB 4.07Å; F567-F573 HydrophobicContact CD1-CD2 4.5Å; F567-F573 HydrophobicContact CE1-CB 3.95Å; F567-F573 HydrophobicContact CE1-CD2 4.1Å; F567-F573 HydrophobicContact CZ-CD2 4.31Å; F573-S575 VanDerWaalsContact CE2-C 3.47Å; F573-S575 WeakPolarHBondContact CE2-O 3.5Å; F573-S575 WeakPolarHBondContact CZ-O 3.39Å; F573-K576 HydrophobicContact CE2-CB 4.28Å; F573-K576 HydrophobicContact CZ-CB 4.06Å; F573-K576 HydrophobicContact CZ-CG 4.5Å
574	K	94.2	Very high	92.9	Very high	114 Å²	114	47.7 Å²	47.7	50%	0.496	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	-57.7	176.3	-62.1	178.6	78.7	172.8	0	111.1	D553 I566 K572	D553-K574 WeakPolarHBondContact OD1-CD 3.37Å; D553-K574 IonicContact OD1-NZ 2.88Å; D553-K574 PolarHBondContact OD1-NZ 3.09Å; D553-K574 IonicContact OD2-NZ 2.6Å; D553-K574 PolarHBondContact OD2-NZ 3.2Å; I566-K574 HydrophobicContact CG2-CD 4.48Å; I566-K574 PolarHBondContact O-N 2.95Å; K572-K574 PolarHBondContact O-N 3.49Å
575	S	94.4	Very high	92.8	Very high	44 Å²	44	47.7 Å²	47.7	31%	0.308	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.2	169	-173.7	68.5	0	0	0	0	112	I566 F573	I566-S575 PolarHBondContact N-O 3.02Å; I566-S575 PolarHBondContact O-N 3.38Å; F573-S575 VanDerWaalsContact CE2-C 3.47Å; F573-S575 WeakPolarHBondContact CE2-O 3.5Å; F573-S575 WeakPolarHBondContact CZ-O 3.39Å
576	K	93.7	Very high	92.7	Very high	84 Å²	84	49.1 Å²	49.1	37%	0.365	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	145	171.4	68.2	177.7	-175.3	177	0	110.3	P537 W563 I564 F573	P537-K576 HydrophobicContact CB-CD 4.46Å; P537-K576 HydrophobicContact CG-CD 4.27Å; W563-K576 HydrophobicContact CD2-CD 4.15Å; W563-K576 HydrophobicContact CE3-CD 4.26Å; W563-K576 HydrophobicContact CZ2-CD 4.49Å; W563-K576 HydrophobicContact CZ3-CD 4.49Å; I564-K576 CarbonylContact O-C 3.58Å; I564-K576 VanDerWaalsContact O-CA 3.28Å; I564-K576 WeakPolarHBondContact O-CA 3.4Å; F573-K576 HydrophobicContact CE2-CB 4.28Å; F573-K576 HydrophobicContact CZ-CB 4.06Å; F573-K576 HydrophobicContact CZ-CG 4.5Å
577	I	95.2	Very high	92.6	Very high	9 Å²	9	48.6 Å²	48.6	5%	0.046	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	159.5	-179.3	68.7	172.8	0	0	0	111.2	W563 I564 I566 A579 I596 F609 G613	W563-I577 WeakPolarHBondContact CB-O 3.31Å; I564-I577 HydrophobicContact CB-CD1 4.33Å; I564-I577 HydrophobicContact CB-CG1 3.72Å; I564-I577 HydrophobicContact CD1-CD1 4.23Å; I564-I577 HydrophobicContact CD1-CG1 4.21Å; I564-I577 HydrophobicContact CG2-CD1 4.41Å; I564-I577 HydrophobicContact CG2-CG1 4.19Å; I564-I577 PolarHBondContact N-O 3.01Å; I564-I577 PolarHBondContact O-N 3.36Å; I566-I577 HydrophobicContact CD1-CG2 4.3Å; I577-A579 PolarHBondContact O-N 3.41Å; I577-I596 HydrophobicContact CD1-CB 4.2Å; I577-I596 HydrophobicContact CD1-CD1 3.59Å; I577-I596 HydrophobicContact CD1-CG1 4.47Å; I577-I596 HydrophobicContact CD1-CG2 4.15Å; I577-F609 HydrophobicContact CD1-CB 3.98Å; I577-F609 HydrophobicContact CD1-CD2 4.32Å; I577-F609 HydrophobicContact CD1-CG 4.17Å; I577-G613 VanDerWaalsContact CG2-CA 3.42Å
578	G	89.8	Confident	92.6	Very high	8 Å²	8	48.9 Å²	48.9	8%	0.082	27%	0.268	C	S	.	.			trans	72.7	3.5	176.7	0	0	0	0	0	115.6	G580 R581 L582	G578-G580 PolarHBondContact O-N 3.32Å; G578-R581 PolarHBondContact O-N 2.99Å; G578-L582 PolarHBondContact O-N 2.96Å
579	A	89	Confident	92.7	Very high	48 Å²	48	48.2 Å²	48.2	40%	0.397	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	127.4	175.3	0	0	0	0	0	111.1	W563 I577 R581	W563-A579 HydrophobicContact CB-CB 4.19Å; W563-A579 HydrophobicContact CE3-CB 3.9Å; I577-A579 PolarHBondContact O-N 3.41Å; A579-R581 PolarHBondContact O-N 3.38Å
580	G	85.6	Confident	92.8	Very high	83 Å²	83	47.4 Å²	47.4	86%	0.856	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.7	-6.2	-176.6	0	0	0	0	0	115.1	G578	G578-G580 PolarHBondContact O-N 3.32Å
581	R	89.6	Confident	92.8	Very high	143 Å²	143	44.4 Å²	44.4	54%	0.54	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.9	-39	174.2	-61.3	-177.2	-178.1	-127.9	-0.5	112	G578 A579 L615	G578-R581 PolarHBondContact O-N 2.99Å; A579-R581 PolarHBondContact O-N 3.38Å; R581-L615 VanDerWaalsContact NH1-CD2 3.34Å
582	L	92.6	Very high	92.6	Very high	2 Å²	2	49.2 Å²	49.2	1%	0.01	26%	0.258	C	S	.	.			trans	-83.4	146	176.9	-61.1	169.4	0	0	0	110	R562 I564 G578 P585 D600 F607 F609	R562-L582 WeakPolarHBondContact CB-O 3.48Å; R562-L582 WeakPolarHBondContact O-CB 3.46Å; I564-L582 HydrophobicContact CD1-CD1 3.81Å; I564-L582 HydrophobicContact CG1-CD1 3.78Å; G578-L582 PolarHBondContact O-N 2.96Å; L582-P585 HydrophobicContact CB-CG 4.37Å; L582-P585 HydrophobicContact CD1-CB 4.14Å; L582-P585 HydrophobicContact CD1-CG 4.28Å; L582-D600 VanDerWaalsContact CA-OD2 3.31Å; L582-D600 WeakPolarHBondContact CA-OD2 3.35Å; L582-D600 HydrophobicContact CD2-CB 4.25Å; L582-F607 HydrophobicContact CD2-CB 4.32Å; L582-F607 HydrophobicContact CD2-CD2 3.53Å; L582-F607 HydrophobicContact CD2-CE2 3.85Å; L582-F607 HydrophobicContact CD2-CG 3.9Å; L582-F607 HydrophobicContact CD2-CZ 4.46Å; L582-F609 HydrophobicContact CD1-CE2 4.31Å; L582-F609 HydrophobicContact CD1-CZ 4.46Å; L582-F609 HydrophobicContact CD2-CE2 4.26Å; L582-F609 HydrophobicContact CD2-CZ 4.32Å; L582-F609 HydrophobicContact CG-CZ 4.34Å
583	M	90.7	Very high	92.4	Very high	86 Å²	86	47.5 Å²	47.5	42%	0.424	26%	0.256	S	S	.	.	S	Bend	trans	-116.7	-31.3	-178.6	-67.4	-60.2	-69.7	0	0	112.2	R562 D600 K602	R562-M583 WeakPolarHBondContact CD-O 3.33Å; R562-M583 WeakPolarHBondContact CG-O 3.27Å; M583-D600 PolarHBondContact N-OD2 3.33Å; M583-K602 HydrophobicContact CB-CB 3.89Å; M583-K602 WeakPolarHBondContact O-CD 3.34Å
584	G	90.3	Very high	92.1	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.252	C	S	.	.			trans	-167.6	70.3	177.9	0	0	0	0	0	111	K586 D600 N601	G584-K586 PolarHBondContact O-N 2.95Å; G584-D600 PolarHBondContact N-OD1 3.41Å; G584-D600 VanDerWaalsContact N-OD1 3.1Å; G584-D600 PolarHBondContact N-OD2 3.08Å; G584-N601 PolarHBondContact O-N 3.1Å
585	P	94.3	Very high	92.1	Very high	0 Å²	0	42 Å²	42	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	132	178.6	30	-34.3	0	0	0	109.3	T544 A557 D558 Y559 L582 V599	T544-P585 PolarHBondContact OG1-O 3.11Å; A557-P585 HydrophobicContact CB-CB 4.08Å; D558-P585 WeakPolarHBondContact O-CG 3.44Å; Y559-P585 WeakPolarHBondContact CA-O 3.44Å; Y559-P585 WeakPolarHBondContact CD2-O 3.46Å; L582-P585 HydrophobicContact CB-CG 4.37Å; L582-P585 HydrophobicContact CD1-CB 4.14Å; L582-P585 HydrophobicContact CD1-CG 4.28Å; P585-V599 CarbonylContact C-O 3.48Å; P585-V599 WeakPolarHBondContact CA-O 3.46Å
586	K	92.8	Very high	92.2	Very high	31 Å²	31	40 Å²	40	14%	0.135	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	-67.2	-175.2	-161.2	171	-161.8	178.4	0	111.3	T544 G545 Y559 G584 V599 N601 H654	T544-K586 WeakPolarHBondContact OG1-CA 3.49Å; T544-K586 PolarHBondContact OG1-O 2.96Å; G545-K586 WeakPolarHBondContact CA-O 3.44Å; G545-K586 PolarHBondContact N-O 3.06Å; Y559-K586 HydrophobicContact CD2-CB 4.44Å; G584-K586 PolarHBondContact O-N 2.95Å; K586-V599 PolarHBondContact N-O 2.99Å; K586-N601 HydrophobicContact CB-CB 4.16Å; K586-N601 HydrophobicContact CD-CB 4.27Å; K586-H654 WeakPolarHBondContact CE-CE1 3.49Å; K586-H654 WeakPolarHBondContact CE-NE2 3.34Å; K586-H654 PolarHBondContact NZ-CD2 2.83Å; K586-H654 PolarHBondContact NZ-CE1 3.24Å; K586-H654 VanDerWaalsContact NZ-CE1 3.34Å; K586-H654 PolarHBondContact NZ-NE2 3.27Å
587	G	94.1	Very high	92.3	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	146.5	172.4	0	0	0	0	0	112	A598 V599 H654	G587-A598 WeakPolarHBondContact O-CA 3.35Å; G587-V599 PolarHBondContact O-N 3.17Å; G587-H654 PolarHBondContact N-O 3.33Å
588	V	96.8	Very high	92.4	Very high	9 Å²	9	35.7 Å²	35.7	6%	0.055	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	139.8	170.3	63.1	0	0	0	0	109.7	T547 I555 A557 I596 I597	T547-V588 HydrophobicContact CG2-CB 4.37Å; T547-V588 HydrophobicContact CG2-CG1 3.85Å; T547-V588 HydrophobicContact CG2-CG2 3.92Å; I555-V588 HydrophobicContact CG2-CG2 3.84Å; A557-V588 HydrophobicContact CB-CB 4.22Å; A557-V588 HydrophobicContact CB-CG1 4.15Å; V588-I596 HydrophobicContact CG2-CG2 3.75Å; V588-I597 CarbonylContact C-O 3.45Å; V588-I597 VanDerWaalsContact CA-O 3.28Å; V588-I597 WeakPolarHBondContact CA-O 3.09Å
589	A	96.4	Very high	92.6	Very high	7 Å²	7	35.3 Å²	35.3	6%	0.058	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	164.4	174.9	0	0	0	0	0	109.7	I597 V656 V658	A589-I597 PolarHBondContact N-O 3.28Å; A589-I597 PolarHBondContact O-N 3.11Å; A589-V656 HydrophobicContact CB-CG1 3.88Å; A589-V656 HydrophobicContact CB-CG2 4.3Å; A589-V658 HydrophobicContact CB-CG2 4.02Å
590	V	94.8	Very high	92.7	Very high	29 Å²	29	33 Å²	33	18%	0.176	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	133.8	176.5	-175.5	0	0	0	0	108.8	T547 D549 I555 H595	T547-V590 HydrophobicContact CG2-CG2 3.66Å; D549-V590 HydrophobicContact CB-CG1 4.34Å; D549-V590 HydrophobicContact CB-CG2 4.34Å; I555-V590 HydrophobicContact CD1-CG2 3.45Å; I555-V590 VanDerWaalsContact CD1-CG2 3.45Å; V590-H595 VanDerWaalsContact CA-O 3.31Å; V590-H595 WeakPolarHBondContact CA-O 3.45Å
591	D	92.6	Very high	92.8	Very high	12 Å²	12	29.7 Å²	29.7	6%	0.064	15%	0.146	C	C	.	.			trans	-82.8	173.6	173.4	82	-4.1	0	0	0	111.7	N593 G594 H595 I597 V658	D591-N593 PolarHBondContact O-N 3.47Å; D591-N593 VanDerWaalsContact O-N 3.13Å; D591-N593 VanDerWaalsContact OD1-CA 3.31Å; D591-N593 WeakPolarHBondContact OD1-CA 3.45Å; D591-N593 WeakPolarHBondContact OD1-CB 3.23Å; D591-N593 PolarHBondContact OD1-N 3.26Å; D591-N593 PolarHBondContact OD2-ND2 2.91Å; D591-G594 PolarHBondContact O-N 3.35Å; D591-G594 VanDerWaalsContact O-N 3.07Å; D591-G594 PolarHBondContact OD1-N 3.46Å; D591-H595 PolarHBondContact N-O 3.21Å; D591-H595 WeakPolarHBondContact OD1-CB 3.29Å; D591-H595 IonicContact OD1-CG 3.71Å; D591-H595 PolarHBondContact OD1-N 3.34Å; D591-H595 IonicContact OD1-ND1 3.66Å; D591-H595 IonicContact OD2-CE1 3.96Å; D591-H595 IonicContact OD2-CG 3.53Å; D591-H595 IonicContact OD2-ND1 2.85Å; D591-H595 PolarHBondContact OD2-ND1 2.96Å; D591-I597 HydrophobicContact CB-CD1 4.36Å; D591-V658 HydrophobicContact CB-CG1 4.05Å
592	K	88.1	Confident	92.7	Very high	114 Å²	114	25.9 Å²	25.9	50%	0.496	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-14.7	179	74.8	-163.8	176.3	-173.4	0	115	M550 G594 N660 N662	M550-K592 HydrophobicContact CE-CB 4.02Å; K592-G594 VanDerWaalsContact C-N 3.35Å; K592-N660 PolarHBondContact NZ-O 3.03Å; K592-N660 VanDerWaalsContact NZ-O 3.11Å; K592-N662 VanDerWaalsContact CD-OD1 3.31Å; K592-N662 WeakPolarHBondContact CD-OD1 3.37Å; K592-N662 VanDerWaalsContact CE-ND2 3.31Å; K592-N662 WeakPolarHBondContact CE-ND2 3.43Å; K592-N662 WeakPolarHBondContact CE-OD1 3.45Å; K592-N662 VanDerWaalsContact CG-OD1 3.25Å; K592-N662 WeakPolarHBondContact CG-OD1 3.46Å
593	N	89.4	Confident	92.4	Very high	102 Å²	102	27 Å²	27	55%	0.545	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-0.8	178.2	-54.9	-47.8	0	0	0	111.8	D591 N662	D591-N593 PolarHBondContact O-N 3.47Å; D591-N593 VanDerWaalsContact O-N 3.13Å; D591-N593 VanDerWaalsContact OD1-CA 3.31Å; D591-N593 WeakPolarHBondContact OD1-CA 3.45Å; D591-N593 WeakPolarHBondContact OD1-CB 3.23Å; D591-N593 PolarHBondContact OD1-N 3.26Å; D591-N593 PolarHBondContact OD2-ND2 2.91Å; N593-N662 PolarHBondContact ND2-ND2 3.47Å; N593-N662 VanDerWaalsContact ND2-ND2 3.14Å
594	G	90.4	Very high	92.2	Very high	24 Å²	24	22.9 Å²	22.9	25%	0.247	12%	0.122	C	C	.	.			trans	78.8	16.4	-176	0	0	0	0	0	113.9	D591 K592	D591-G594 PolarHBondContact O-N 3.35Å; D591-G594 VanDerWaalsContact O-N 3.07Å; D591-G594 PolarHBondContact OD1-N 3.46Å; K592-G594 VanDerWaalsContact C-N 3.35Å
595	H	94.4	Very high	92.2	Very high	46 Å²	46	23.2 Å²	23.2	21%	0.213	13%	0.125	C	C	.	.			trans	-75.1	136.3	169.7	-57.6	133.5	0	0	0	110.6	V590 D591 I608 F609	V590-H595 VanDerWaalsContact CA-O 3.31Å; V590-H595 WeakPolarHBondContact CA-O 3.45Å; D591-H595 PolarHBondContact N-O 3.21Å; D591-H595 WeakPolarHBondContact OD1-CB 3.29Å; D591-H595 IonicContact OD1-CG 3.71Å; D591-H595 PolarHBondContact OD1-N 3.34Å; D591-H595 IonicContact OD1-ND1 3.66Å; D591-H595 IonicContact OD2-CE1 3.96Å; D591-H595 IonicContact OD2-CG 3.53Å; D591-H595 IonicContact OD2-ND1 2.85Å; D591-H595 PolarHBondContact OD2-ND1 2.96Å; H595-I608 HydrophobicContact CB-CG2 3.8Å; H595-F609 CarbonylContact C-O 3.57Å; H595-F609 VanDerWaalsContact CA-O 3.23Å; H595-F609 WeakPolarHBondContact CA-O 3.49Å; H595-F609 WeakPolarHBondContact CB-O 3.34Å
596	I	95.9	Very high	92.2	Very high	4 Å²	4	23.2 Å²	23.2	2%	0.021	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	113.4	179.6	-57.7	172.1	0	0	0	108.2	I555 I564 I566 I577 V588 F609	I555-I596 HydrophobicContact CD1-CD1 3.92Å; I555-I596 HydrophobicContact CD1-CG1 3.97Å; I555-I596 HydrophobicContact CG1-CD1 4.44Å; I555-I596 HydrophobicContact CG2-CD1 4.48Å; I555-I596 HydrophobicContact CG2-CG2 4.02Å; I564-I596 HydrophobicContact CD1-CG2 4.17Å; I566-I596 HydrophobicContact CD1-CD1 3.73Å; I577-I596 HydrophobicContact CD1-CB 4.2Å; I577-I596 HydrophobicContact CD1-CD1 3.59Å; I577-I596 HydrophobicContact CD1-CG1 4.47Å; I577-I596 HydrophobicContact CD1-CG2 4.15Å; V588-I596 HydrophobicContact CG2-CG2 3.75Å; I596-F609 HydrophobicContact CB-CB 4.42Å; I596-F609 PolarHBondContact N-O 3.39Å; I596-F609 PolarHBondContact O-N 2.82Å
597	I	96.4	Very high	92.3	Very high	2 Å²	2	22.1 Å²	22.1	1%	0.01	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	120.1	-179.3	-53	-174	0	0	0	108.2	V588 A589 D591 V606 F607 I608 V656 V658 I664	V588-I597 CarbonylContact C-O 3.45Å; V588-I597 VanDerWaalsContact CA-O 3.28Å; V588-I597 WeakPolarHBondContact CA-O 3.09Å; A589-I597 PolarHBondContact N-O 3.28Å; A589-I597 PolarHBondContact O-N 3.11Å; D591-I597 HydrophobicContact CB-CD1 4.36Å; I597-V606 HydrophobicContact CG2-CG1 3.48Å; I597-V606 VanDerWaalsContact CG2-CG1 3.48Å; I597-F607 CarbonylContact C-O 3.43Å; I597-F607 WeakPolarHBondContact CA-O 3.13Å; I597-I608 HydrophobicContact CD1-CD1 4.39Å; I597-I608 HydrophobicContact CG1-CG1 4.22Å; I597-I608 HydrophobicContact CG1-CG2 4.37Å; I597-I608 HydrophobicContact CG2-CG1 4.42Å; I597-V656 HydrophobicContact CG2-CG2 4.06Å; I597-V658 HydrophobicContact CD1-CG2 3.62Å; I597-I664 HydrophobicContact CD1-CD1 3.78Å; I597-I664 HydrophobicContact CD1-CG1 3.79Å; I597-I664 HydrophobicContact CG2-CG2 4.07Å
598	A	95.9	Very high	92.4	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	127	-176.2	0	0	0	0	0	111.3	I564 G587 V606 F607 F609	I564-A598 HydrophobicContact CD1-CB 3.42Å; I564-A598 VanDerWaalsContact CD1-CB 3.42Å; I564-A598 HydrophobicContact CG1-CB 4.45Å; G587-A598 WeakPolarHBondContact O-CA 3.35Å; A598-V606 WeakPolarHBondContact O-CA 3.44Å; A598-F607 PolarHBondContact N-O 3.34Å; A598-F607 PolarHBondContact O-N 3.37Å; A598-F609 HydrophobicContact CB-CE2 4.47Å
599	V	94.6	Very high	92.3	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	117	173.5	173.9	0	0	0	0	108.6	P585 K586 G587 V606 P653 V656 V666	P585-V599 CarbonylContact C-O 3.48Å; P585-V599 WeakPolarHBondContact CA-O 3.46Å; K586-V599 PolarHBondContact N-O 2.99Å; G587-V599 PolarHBondContact O-N 3.17Å; V599-V606 HydrophobicContact CG2-CG2 4.26Å; V599-P653 HydrophobicContact CG1-CB 3.45Å; V599-P653 VanDerWaalsContact CG1-CB 3.45Å; V599-P653 HydrophobicContact CG1-CG 3.48Å; V599-P653 VanDerWaalsContact CG1-CG 3.48Å; V599-V656 HydrophobicContact CG2-CB 3.5Å; V599-V656 HydrophobicContact CG2-CG1 3.63Å; V599-V656 HydrophobicContact CG2-CG2 4.43Å; V599-V666 HydrophobicContact CG2-CG1 4.07Å
600	D	92	Very high	92.1	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	108.6	173.6	-163.8	-58.3	0	0	0	110.4	L582 M583 G584 K602 A603 C604 C605 F607	L582-D600 VanDerWaalsContact CA-OD2 3.31Å; L582-D600 WeakPolarHBondContact CA-OD2 3.35Å; L582-D600 HydrophobicContact CD2-CB 4.25Å; M583-D600 PolarHBondContact N-OD2 3.33Å; G584-D600 PolarHBondContact N-OD1 3.41Å; G584-D600 VanDerWaalsContact N-OD1 3.1Å; G584-D600 PolarHBondContact N-OD2 3.08Å; D600-K602 PolarHBondContact OD1-N 3.02Å; D600-K602 VanDerWaalsContact OD1-N 3.12Å; D600-A603 HydrophobicContact CB-CB 3.92Å; D600-A603 WeakPolarHBondContact OD1-CB 3.45Å; D600-A603 PolarHBondContact OD1-N 3.38Å; D600-C604 WeakPolarHBondContact O-CA 3.32Å; D600-C604 PolarHBondContact O-N 2.75Å; D600-C605 PolarHBondContact N-O 3.28Å; D600-C605 PolarHBondContact O-N 3.03Å; D600-F607 HydrophobicContact CB-CD2 3.95Å; D600-F607 HydrophobicContact CB-CE2 3.67Å
601	N	87.8	Confident	91.8	Very high	12 Å²	12	27.2 Å²	27.2	6%	0.064	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-52.2	-177.9	178.9	-105	0	0	0	110.7	Y559 G584 K586 A603 C604 F651 S652 P653	Y559-N601 HydrophobicContact CE2-CB 4.12Å; G584-N601 PolarHBondContact O-N 3.1Å; K586-N601 HydrophobicContact CB-CB 4.16Å; K586-N601 HydrophobicContact CD-CB 4.27Å; N601-A603 PolarHBondContact O-N 3.19Å; N601-C604 PolarHBondContact O-N 3.49Å; N601-C604 VanDerWaalsContact O-N 3.13Å; N601-C604 PolarHBondContact O-SG 2.98Å; N601-F651 VanDerWaalsContact ND2-C 3.31Å; N601-F651 PolarHBondContact ND2-O 2.95Å; N601-F651 WeakPolarHBondContact O-CB 3.36Å; N601-S652 PolarHBondContact ND2-N 2.79Å; N601-P653 PolarHBondContact ND2-O 3.18Å
602	K	86.5	Confident	91.5	Very high	63 Å²	63	32 Å²	32	27%	0.274	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-36.1	-176.1	-69.6	-169.6	-166.4	155.6	0	112.6	Y559 M583 D600 C604 R622	Y559-K602 VanDerWaalsContact CE1-CE 3.49Å; Y559-K602 WeakPolarHBondContact OH-CE 3.37Å; M583-K602 HydrophobicContact CB-CB 3.89Å; M583-K602 WeakPolarHBondContact O-CD 3.34Å; D600-K602 PolarHBondContact OD1-N 3.02Å; D600-K602 VanDerWaalsContact OD1-N 3.12Å; K602-C604 VanDerWaalsContact C-N 3.32Å; K602-R622 PolarHBondContact O-NH2 2.92Å
603	A	86.1	Confident	91.5	Very high	26 Å²	26	27.6 Å²	27.6	22%	0.215	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-14.6	176.5	0	0	0	0	0	113	D600 N601 C605 F607	D600-A603 HydrophobicContact CB-CB 3.92Å; D600-A603 WeakPolarHBondContact OD1-CB 3.45Å; D600-A603 PolarHBondContact OD1-N 3.38Å; N601-A603 PolarHBondContact O-N 3.19Å; A603-C605 HydrophobicContact CB-CB 4.41Å; A603-C605 PolarHBondContact O-N 3.04Å; A603-C605 PolarHBondContact O-SG 3.42Å; A603-F607 HydrophobicContact CB-CE2 4.32Å
604	C	87.4	Confident	91.7	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.1	36.4	-176.2	-47	0	0	0	0	112.8	D600 N601 K602 G620 R622 F651 S652	D600-C604 WeakPolarHBondContact O-CA 3.32Å; D600-C604 PolarHBondContact O-N 2.75Å; N601-C604 PolarHBondContact O-N 3.49Å; N601-C604 VanDerWaalsContact O-N 3.13Å; N601-C604 PolarHBondContact O-SG 2.98Å; K602-C604 VanDerWaalsContact C-N 3.32Å; C604-G620 CarbonylContact O-C 3.54Å; C604-R622 HydrophobicContact CB-CG 3.77Å; C604-R622 PolarHBondContact SG-NE 2.78Å; C604-F651 VanDerWaalsContact SG-CD1 3.54Å; C604-S652 WeakPolarHBondContact CB-OG 3.37Å; C604-S652 WeakPolarHBondContact SG-CB 3.13Å
605	C	90.4	Very high	91.8	Very high	7 Å²	7	30.4 Å²	30.4	5%	0.047	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	158.2	-173.2	-60.5	0	0	0	0	110.4	D600 A603 F607 K618 F619 G620	D600-C605 PolarHBondContact N-O 3.28Å; D600-C605 PolarHBondContact O-N 3.03Å; A603-C605 HydrophobicContact CB-CB 4.41Å; A603-C605 PolarHBondContact O-N 3.04Å; A603-C605 PolarHBondContact O-SG 3.42Å; C605-F607 HydrophobicContact CB-CD2 4.42Å; C605-F607 HydrophobicContact CB-CE2 3.95Å; C605-K618 HydrophobicContact CB-CG 4.22Å; C605-K618 WeakPolarHBondContact SG-CE 3.19Å; C605-F619 CarbonylContact C-O 3.55Å; C605-F619 VanDerWaalsContact CA-O 3.31Å; C605-F619 WeakPolarHBondContact CA-O 3.1Å; C605-F619 WeakPolarHBondContact CB-O 3.18Å; C605-G620 PolarHBondContact SG-O 2.9Å
606	V	93.8	Very high	91.7	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	132.8	167.3	-173	0	0	0	0	108.1	I597 A598 V599 K618 F619 F629 V666	I597-V606 HydrophobicContact CG2-CG1 3.48Å; I597-V606 VanDerWaalsContact CG2-CG1 3.48Å; A598-V606 WeakPolarHBondContact O-CA 3.44Å; V599-V606 HydrophobicContact CG2-CG2 4.26Å; V606-K618 WeakPolarHBondContact O-CA 3.46Å; V606-F619 HydrophobicContact CB-CD1 4.42Å; V606-F619 HydrophobicContact CB-CD2 4.31Å; V606-F619 HydrophobicContact CB-CE1 3.92Å; V606-F619 HydrophobicContact CB-CE2 3.8Å; V606-F619 HydrophobicContact CB-CZ 3.59Å; V606-F619 HydrophobicContact CG1-CE1 3.97Å; V606-F619 HydrophobicContact CG1-CE2 4.35Å; V606-F619 HydrophobicContact CG1-CZ 3.68Å; V606-F619 HydrophobicContact CG2-CE2 3.94Å; V606-F619 HydrophobicContact CG2-CZ 4.12Å; V606-F619 PolarHBondContact N-O 3.31Å; V606-F619 PolarHBondContact O-N 3.22Å; V606-F619 VanDerWaalsContact O-N 3.08Å; V606-F629 HydrophobicContact CG2-CE2 4.12Å; V606-F629 HydrophobicContact CG2-CZ 4.14Å; V606-V666 HydrophobicContact CG2-CG2 4.12Å
607	F	95.1	Very high	91.5	Very high	8 Å²	8	33.5 Å²	33.5	4%	0.035	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	134	177.4	-67.9	-99.1	0	0	0	109.5	L582 I597 A598 D600 A603 C605 F609 L615 K618	L582-F607 HydrophobicContact CD2-CB 4.32Å; L582-F607 HydrophobicContact CD2-CD2 3.53Å; L582-F607 HydrophobicContact CD2-CE2 3.85Å; L582-F607 HydrophobicContact CD2-CG 3.9Å; L582-F607 HydrophobicContact CD2-CZ 4.46Å; I597-F607 CarbonylContact C-O 3.43Å; I597-F607 WeakPolarHBondContact CA-O 3.13Å; A598-F607 PolarHBondContact N-O 3.34Å; A598-F607 PolarHBondContact O-N 3.37Å; D600-F607 HydrophobicContact CB-CD2 3.95Å; D600-F607 HydrophobicContact CB-CE2 3.67Å; A603-F607 HydrophobicContact CB-CE2 4.32Å; C605-F607 HydrophobicContact CB-CD2 4.42Å; C605-F607 HydrophobicContact CB-CE2 3.95Å; F607-F609 HydrophobicContact CB-CD2 4.18Å; F607-F609 HydrophobicContact CB-CE2 3.43Å; F607-F609 VanDerWaalsContact CB-CE2 3.43Å; F607-F609 HydrophobicContact CB-CZ 3.81Å; F607-F609 HydrophobicContact CD1-CZ 4.15Å; F607-F609 HydrophobicContact CG-CE2 4.25Å; F607-F609 HydrophobicContact CG-CZ 4.22Å; F607-L615 HydrophobicContact CB-CD1 4.23Å; F607-L615 HydrophobicContact CD1-CD1 3.78Å; F607-K618 HydrophobicContact CD1-CB 4.17Å; F607-K618 HydrophobicContact CD1-CD 4.2Å; F607-K618 HydrophobicContact CD1-CG 3.91Å; F607-K618 HydrophobicContact CE1-CB 4.37Å; F607-K618 HydrophobicContact CE1-CD 3.57Å; F607-K618 HydrophobicContact CE1-CG 3.79Å; F607-K618 HydrophobicContact CG-CG 4.39Å; F607-K618 HydrophobicContact CZ-CD 3.85Å; F607-K618 HydrophobicContact CZ-CG 4.15Å
608	I	95.3	Very high	91.3	Very high	5 Å²	5	38.6 Å²	38.6	3%	0.026	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	119.6	172.6	-54.1	-169.8	0	0	0	108.4	H595 I597 L615 V616 T617 F619 I664	H595-I608 HydrophobicContact CB-CG2 3.8Å; I597-I608 HydrophobicContact CD1-CD1 4.39Å; I597-I608 HydrophobicContact CG1-CG1 4.22Å; I597-I608 HydrophobicContact CG1-CG2 4.37Å; I597-I608 HydrophobicContact CG2-CG1 4.42Å; I608-L615 WeakPolarHBondContact O-CD1 3.39Å; I608-V616 HydrophobicContact CB-CB 4.34Å; I608-V616 HydrophobicContact CG2-CB 4.12Å; I608-V616 HydrophobicContact CG2-CG2 4.36Å; I608-V616 WeakPolarHBondContact O-CB 3.33Å; I608-V616 PolarHBondContact O-N 3.41Å; I608-T617 HydrophobicContact CB-CG2 3.84Å; I608-T617 HydrophobicContact CD1-CG2 3.54Å; I608-T617 HydrophobicContact CG1-CG2 3.75Å; I608-T617 PolarHBondContact N-O 3.28Å; I608-F619 HydrophobicContact CD1-CE1 3.99Å; I608-F619 HydrophobicContact CG1-CE1 4.14Å; I608-I664 HydrophobicContact CD1-CD1 3.67Å
609	F	95.2	Very high	91	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	147.5	176.7	-60.6	-83.6	0	0	0	110.6	I564 I577 L582 H595 I596 A598 F607 K614 L615	I564-F609 HydrophobicContact CD1-CD2 4.34Å; I564-F609 HydrophobicContact CD1-CE2 4.28Å; I577-F609 HydrophobicContact CD1-CB 3.98Å; I577-F609 HydrophobicContact CD1-CD2 4.32Å; I577-F609 HydrophobicContact CD1-CG 4.17Å; L582-F609 HydrophobicContact CD1-CE2 4.31Å; L582-F609 HydrophobicContact CD1-CZ 4.46Å; L582-F609 HydrophobicContact CD2-CE2 4.26Å; L582-F609 HydrophobicContact CD2-CZ 4.32Å; L582-F609 HydrophobicContact CG-CZ 4.34Å; H595-F609 CarbonylContact C-O 3.57Å; H595-F609 VanDerWaalsContact CA-O 3.23Å; H595-F609 WeakPolarHBondContact CA-O 3.49Å; H595-F609 WeakPolarHBondContact CB-O 3.34Å; I596-F609 HydrophobicContact CB-CB 4.42Å; I596-F609 PolarHBondContact N-O 3.39Å; I596-F609 PolarHBondContact O-N 2.82Å; A598-F609 HydrophobicContact CB-CE2 4.47Å; F607-F609 HydrophobicContact CB-CD2 4.18Å; F607-F609 HydrophobicContact CB-CE2 3.43Å; F607-F609 VanDerWaalsContact CB-CE2 3.43Å; F607-F609 HydrophobicContact CB-CZ 3.81Å; F607-F609 HydrophobicContact CD1-CZ 4.15Å; F607-F609 HydrophobicContact CG-CE2 4.25Å; F607-F609 HydrophobicContact CG-CZ 4.22Å; F609-K614 CarbonylContact C-O 3.54Å; F609-K614 WeakPolarHBondContact CA-O 3.37Å; F609-L615 HydrophobicContact CD1-CB 4.26Å; F609-L615 HydrophobicContact CD1-CD1 3.99Å; F609-L615 HydrophobicContact CE1-CB 4.22Å; F609-L615 HydrophobicContact CE1-CD1 3.68Å; F609-L615 HydrophobicContact CZ-CD1 4.05Å
610	Q	92.8	Very high	90.4	Very high	62 Å²	62	40.7 Å²	40.7	29%	0.29	22%	0.224	S	C	.	.			trans	-69.9	160.1	160.6	-63.4	-173.8	-27.1	0	0	110.1	N612 G613 K614 V616	Q610-N612 VanDerWaalsContact CB-OD1 3.3Å; Q610-N612 WeakPolarHBondContact CB-OD1 3.44Å; Q610-N612 PolarHBondContact O-N 3.42Å; Q610-N612 VanDerWaalsContact O-N 3.13Å; Q610-N612 PolarHBondContact OE1-ND2 3.35Å; Q610-G613 WeakPolarHBondContact O-CA 3.49Å; Q610-G613 PolarHBondContact O-N 2.97Å; Q610-K614 HydrophobicContact CB-CB 4.4Å; Q610-K614 PolarHBondContact N-O 3.45Å; Q610-V616 HydrophobicContact CG-CG2 3.47Å; Q610-V616 VanDerWaalsContact CG-CG2 3.47Å
611	S	87.3	Confident	89.6	Confident	84 Å²	84	42.5 Å²	42.5	59%	0.587	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-27.4	175	54.8	0	0	0	0	113.5	G613	S611-G613 VanDerWaalsContact C-N 3.27Å; S611-G613 PolarHBondContact O-N 3.43Å
612	N	86.8	Confident	88.9	Confident	113 Å²	113	48.4 Å²	48.4	60%	0.604	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-2.8	173.5	67.2	20.7	0	0	0	114.4	Q610 K614	Q610-N612 VanDerWaalsContact CB-OD1 3.3Å; Q610-N612 WeakPolarHBondContact CB-OD1 3.44Å; Q610-N612 PolarHBondContact O-N 3.42Å; Q610-N612 VanDerWaalsContact O-N 3.13Å; Q610-N612 PolarHBondContact OE1-ND2 3.35Å; N612-K614 WeakPolarHBondContact OD1-CB 3.48Å; N612-K614 PolarHBondContact OD1-N 2.93Å
613	G	88.4	Confident	87.9	Confident	21 Å²	21	46.5 Å²	46.5	22%	0.216	26%	0.258	C	S	.	.	S	Bend	trans	88.4	-0.1	-179.4	0	0	0	0	0	116.1	I577 Q610 S611	I577-G613 VanDerWaalsContact CG2-CA 3.42Å; Q610-G613 WeakPolarHBondContact O-CA 3.49Å; Q610-G613 PolarHBondContact O-N 2.97Å; S611-G613 VanDerWaalsContact C-N 3.27Å; S611-G613 PolarHBondContact O-N 3.43Å
614	K	92.1	Very high	86.7	Confident	138 Å²	138	50.6 Å²	50.6	60%	0.6	28%	0.281	S	S	*	.			trans	-67.9	131.5	173.8	-174.1	-179.4	176.9	-175.4	0	110.1	F609 Q610 N612 V616	F609-K614 CarbonylContact C-O 3.54Å; F609-K614 WeakPolarHBondContact CA-O 3.37Å; Q610-K614 HydrophobicContact CB-CB 4.4Å; Q610-K614 PolarHBondContact N-O 3.45Å; N612-K614 WeakPolarHBondContact OD1-CB 3.48Å; N612-K614 PolarHBondContact OD1-N 2.93Å; K614-V616 PolarHBondContact O-N 2.85Å
615	L	93.3	Very high	85.7	Confident	47 Å²	47	52.9 Å²	52.9	25%	0.246	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	126.5	174.6	-175.9	70.5	0	0	0	109.9	R581 F607 I608 F609 T617	R581-L615 VanDerWaalsContact NH1-CD2 3.34Å; F607-L615 HydrophobicContact CB-CD1 4.23Å; F607-L615 HydrophobicContact CD1-CD1 3.78Å; I608-L615 WeakPolarHBondContact O-CD1 3.39Å; F609-L615 HydrophobicContact CD1-CB 4.26Å; F609-L615 HydrophobicContact CD1-CD1 3.99Å; F609-L615 HydrophobicContact CE1-CB 4.22Å; F609-L615 HydrophobicContact CE1-CD1 3.68Å; F609-L615 HydrophobicContact CZ-CD1 4.05Å; L615-T617 WeakPolarHBondContact CD1-O 3.19Å
616	V	92.1	Very high	84.7	Confident	74 Å²	74	58.7 Å²	58.7	45%	0.448	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	-61.7	174.2	-179	0	0	0	0	109.4	I608 Q610 K614	I608-V616 HydrophobicContact CB-CB 4.34Å; I608-V616 HydrophobicContact CG2-CB 4.12Å; I608-V616 HydrophobicContact CG2-CG2 4.36Å; I608-V616 WeakPolarHBondContact O-CB 3.33Å; I608-V616 PolarHBondContact O-N 3.41Å; Q610-V616 HydrophobicContact CG-CG2 3.47Å; Q610-V616 VanDerWaalsContact CG-CG2 3.47Å; K614-V616 PolarHBondContact O-N 2.85Å
617	T	91.8	Very high	83.6	Confident	41 Å²	41	66.6 Å²	66.6	25%	0.252	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	161.9	-178	-173.1	0	0	0	0	110.8	I608 L615 F619	I608-T617 HydrophobicContact CB-CG2 3.84Å; I608-T617 HydrophobicContact CD1-CG2 3.54Å; I608-T617 HydrophobicContact CG1-CG2 3.75Å; I608-T617 PolarHBondContact N-O 3.28Å; L615-T617 WeakPolarHBondContact CD1-O 3.19Å; T617-F619 HydrophobicContact CG2-CD1 4.43Å
618	K	91.5	Very high	82.8	Confident	110 Å²	110	69.3 Å²	69.3	48%	0.478	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	127.3	175.1	178.3	-162.7	174.1	-171.5	0	107.9	C605 V606 F607	C605-K618 HydrophobicContact CB-CG 4.22Å; C605-K618 WeakPolarHBondContact SG-CE 3.19Å; V606-K618 WeakPolarHBondContact O-CA 3.46Å; F607-K618 HydrophobicContact CD1-CB 4.17Å; F607-K618 HydrophobicContact CD1-CD 4.2Å; F607-K618 HydrophobicContact CD1-CG 3.91Å; F607-K618 HydrophobicContact CE1-CB 4.37Å; F607-K618 HydrophobicContact CE1-CD 3.57Å; F607-K618 HydrophobicContact CE1-CG 3.79Å; F607-K618 HydrophobicContact CG-CG 4.39Å; F607-K618 HydrophobicContact CZ-CD 3.85Å; F607-K618 HydrophobicContact CZ-CG 4.15Å
619	F	90.3	Very high	81.6	Confident	22 Å²	22	69.1 Å²	69.1	10%	0.096	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	170.5	178.7	63	-86.5	0	0	0	111.2	C605 V606 I608 T617 I664 Y677 G681	C605-F619 CarbonylContact C-O 3.55Å; C605-F619 VanDerWaalsContact CA-O 3.31Å; C605-F619 WeakPolarHBondContact CA-O 3.1Å; C605-F619 WeakPolarHBondContact CB-O 3.18Å; V606-F619 HydrophobicContact CB-CD1 4.42Å; V606-F619 HydrophobicContact CB-CD2 4.31Å; V606-F619 HydrophobicContact CB-CE1 3.92Å; V606-F619 HydrophobicContact CB-CE2 3.8Å; V606-F619 HydrophobicContact CB-CZ 3.59Å; V606-F619 HydrophobicContact CG1-CE1 3.97Å; V606-F619 HydrophobicContact CG1-CE2 4.35Å; V606-F619 HydrophobicContact CG1-CZ 3.68Å; V606-F619 HydrophobicContact CG2-CE2 3.94Å; V606-F619 HydrophobicContact CG2-CZ 4.12Å; V606-F619 PolarHBondContact N-O 3.31Å; V606-F619 PolarHBondContact O-N 3.22Å; V606-F619 VanDerWaalsContact O-N 3.08Å; I608-F619 HydrophobicContact CD1-CE1 3.99Å; I608-F619 HydrophobicContact CG1-CE1 4.14Å; T617-F619 HydrophobicContact CG2-CD1 4.43Å; F619-I664 HydrophobicContact CE1-CD1 4.03Å; F619-I664 HydrophobicContact CZ-CD1 3.76Å; F619-I664 HydrophobicContact CZ-CG2 4.49Å; F619-Y677 AromaticContact CD2-CD1 3.82Å; F619-Y677 HydrophobicContact CD2-CD1 3.82Å; F619-Y677 HydrophobicContact CD2-CE1 4.01Å; F619-Y677 HydrophobicContact CD2-CG 4.26Å; F619-Y677 AromaticContact CE2-CD1 3.64Å; F619-Y677 HydrophobicContact CE2-CD1 3.64Å; F619-Y677 AromaticContact CE2-CD2 3.94Å; F619-Y677 HydrophobicContact CE2-CD2 3.94Å; F619-Y677 HydrophobicContact CE2-CE1 4.07Å; F619-Y677 HydrophobicContact CE2-CE2 4.34Å; F619-Y677 AromaticContact CE2-CG 3.59Å; F619-Y677 HydrophobicContact CE2-CG 3.59Å; F619-Y677 HydrophobicContact CZ-CG 4.37Å; F619-G681 VanDerWaalsContact CD1-CA 3.44Å; F619-G681 WeakPolarHBondContact CD2-O 3.37Å
620	G	81.9	Confident	79.9	Confident	22 Å²	22	69.7 Å²	69.7	23%	0.227	37%	0.369	C	S	.	.			trans	89.3	143.2	-168.8	0	0	0	0	0	112.1	C604 C605	C604-G620 CarbonylContact O-C 3.54Å; C605-G620 PolarHBondContact SG-O 2.9Å
621	A	74.7	Confident	77.9	Confident	37 Å²	37	70.5 Å²	70.5	31%	0.306	38%	0.379	S	S	.	.			trans	-149.6	165.6	177.8	0	0	0	0	0	109	H628 F629	A621-H628 CarbonylContact O-C 3.5Å; A621-H628 WeakPolarHBondContact O-CA 3.1Å; A621-H628 VanDerWaalsContact O-CB 3.22Å; A621-H628 WeakPolarHBondContact O-CB 3.49Å; A621-F629 PolarHBondContact O-N 3.03Å
622	R	74.1	Confident	75.6	Confident	137 Å²	137	74.8 Å²	74.8	52%	0.517	39%	0.389	S	S	.	.	S	Bend	trans	-73.4	139	169	-66	-177.9	-173.3	144.8	4.6	109.8	K602 C604 H628 F629 F651	K602-R622 PolarHBondContact O-NH2 2.92Å; C604-R622 HydrophobicContact CB-CG 3.77Å; C604-R622 PolarHBondContact SG-NE 2.78Å; R622-H628 PolarHBondContact O-ND1 2.87Å; R622-F629 WeakPolarHBondContact CA-O 3.36Å; R622-F651 VanDerWaalsContact CZ-CE1 3.43Å
623	G	65.6	Low	73.4	Confident	23 Å²	23	77 Å²	77	24%	0.237	39%	0.393	C	S	.	.	S	Bend	trans	153.3	170.4	172.3	0	0	0	0	0	114.2	H628 A630	G623-H628 VanDerWaalsContact O-CB 3.27Å; G623-H628 WeakPolarHBondContact O-CB 3.29Å; G623-A630 CarbonylContact C-O 3.53Å; G623-A630 VanDerWaalsContact C-O 3.24Å; G623-A630 PolarHBondContact N-O 2.92Å; G623-A630 VanDerWaalsContact N-O 3.11Å; G623-A630 CarbonylContact O-C 3.48Å
624	T	61.1	Low	70.9	Confident	111 Å²	111	81.3 Å²	81.3	68%	0.681	42%	0.421	S	S	*	.	S	Bend	trans	-85.3	-5.1	-172.5	54.7	0	0	0	0	114.6	V631	T624-V631 HydrophobicContact CG2-CB 4.49Å; T624-V631 HydrophobicContact CG2-CG1 4.17Å; T624-V631 HydrophobicContact CG2-CG2 4.38Å
625	S	65.9	Low	68.2	Low	49 Å²	49	78.3 Å²	78.3	34%	0.343	43%	0.429	S	S	.	.	S	Bend	trans	-70	151.2	176.8	79.2	0	0	0	0	110.6	R627 H628	S625-R627 PolarHBondContact O-N 3Å; S625-H628 PolarHBondContact O-N 3.01Å; S625-H628 PolarHBondContact OG-CD2 2.85Å; S625-H628 PolarHBondContact OG-N 3.34Å; S625-H628 PolarHBondContact OG-ND1 3.17Å
626	E	69.1	Low	65.5	Low	129 Å²	129	80.8 Å²	80.8	60%	0.603	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-23.6	178.4	-62	-167.2	141.4	0	0	112.9	K675 F683	E626-K675 WeakPolarHBondContact O-CE 3.3Å; E626-K675 PolarHBondContact O-NZ 3.03Å; E626-F683 HydrophobicContact CB-CZ 4.24Å
627	R	71.6	Confident	62.9	Low	166 Å²	166	84.7 Å²	84.7	63%	0.626	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-20.4	178.6	-54.5	-174.8	174.3	-175.5	-4.3	113.8	S625 Y677 F683	S625-R627 PolarHBondContact O-N 3Å; R627-Y677 PolarHBondContact O-OH 3.33Å; R627-Y677 VanDerWaalsContact O-OH 3.07Å; R627-F683 HydrophobicContact CB-CB 4.23Å; R627-F683 HydrophobicContact CB-CG 4.26Å; R627-F683 HydrophobicContact CG-CB 3.85Å; R627-F683 HydrophobicContact CG-CD1 3.77Å; R627-F683 HydrophobicContact CG-CD2 4.44Å; R627-F683 HydrophobicContact CG-CE1 4.39Å; R627-F683 HydrophobicContact CG-CG 3.77Å
628	H	77.7	Confident	60.4	Low	65 Å²	65	87.7 Å²	87.7	30%	0.301	49%	0.488	S	S	.	.	S	Bend	trans	-99.6	149.1	-173.2	-72.9	-176.5	0	0	0	112.2	A621 R622 G623 S625 K675	A621-H628 CarbonylContact O-C 3.5Å; A621-H628 WeakPolarHBondContact O-CA 3.1Å; A621-H628 VanDerWaalsContact O-CB 3.22Å; A621-H628 WeakPolarHBondContact O-CB 3.49Å; R622-H628 PolarHBondContact O-ND1 2.87Å; G623-H628 VanDerWaalsContact O-CB 3.27Å; G623-H628 WeakPolarHBondContact O-CB 3.29Å; S625-H628 PolarHBondContact O-N 3.01Å; S625-H628 PolarHBondContact OG-CD2 2.85Å; S625-H628 PolarHBondContact OG-N 3.34Å; S625-H628 PolarHBondContact OG-ND1 3.17Å; H628-K675 PolarHBondContact O-NZ 3.46Å
629	F	70.5	Confident	57.9	Low	0 Å²	0	87.1 Å²	87.1	0%	0	50%	0.503	C	S	.	.	S	Bend	trans	-93.2	123.6	178.4	-56.4	-80.7	0	0	0	108.7	V606 A621 R622 S652 P653 V666 D668 K675 Y677	V606-F629 HydrophobicContact CG2-CE2 4.12Å; V606-F629 HydrophobicContact CG2-CZ 4.14Å; A621-F629 PolarHBondContact O-N 3.03Å; R622-F629 WeakPolarHBondContact CA-O 3.36Å; F629-S652 VanDerWaalsContact CA-OG 3.29Å; F629-S652 WeakPolarHBondContact CA-OG 3.45Å; F629-S652 WeakPolarHBondContact CB-OG 3.47Å; F629-S652 PolarHBondContact O-OG 3.34Å; F629-P653 HydrophobicContact CD1-CB 3.88Å; F629-P653 HydrophobicContact CE1-CB 4.07Å; F629-P653 HydrophobicContact CG-CB 4.16Å; F629-P653 HydrophobicContact CG-CG 4.33Å; F629-V666 HydrophobicContact CE1-CB 4.15Å; F629-V666 HydrophobicContact CE1-CG1 3.75Å; F629-V666 HydrophobicContact CZ-CB 4.26Å; F629-V666 HydrophobicContact CZ-CG1 3.98Å; F629-D668 HydrophobicContact CD1-CB 4.44Å; F629-K675 HydrophobicContact CD1-CD 4.03Å; F629-K675 HydrophobicContact CE1-CB 4.42Å; F629-K675 HydrophobicContact CE1-CD 3.84Å; F629-Y677 HydrophobicContact CE1-CE2 4.13Å; F629-Y677 HydrophobicContact CE2-CE2 4.41Å; F629-Y677 AromaticContact CZ-CE2 3.53Å; F629-Y677 HydrophobicContact CZ-CE2 3.53Å; F629-Y677 AromaticContact CZ-CZ 3.57Å; F629-Y677 WeakPolarHBondContact CZ-OH 3.34Å
630	A	58.5	Low	55.5	Low	12 Å²	12	94.1 Å²	94.1	10%	0.099	54%	0.541	C	S	.	.			trans	77.2	136.1	-179.7	0	0	0	0	0	121.1	G623 S652 N671	G623-A630 CarbonylContact C-O 3.53Å; G623-A630 VanDerWaalsContact C-O 3.24Å; G623-A630 PolarHBondContact N-O 2.92Å; G623-A630 VanDerWaalsContact N-O 3.11Å; G623-A630 CarbonylContact O-C 3.48Å; A630-S652 WeakPolarHBondContact CB-OG 3.14Å; A630-S652 PolarHBondContact N-OG 2.68Å; A630-N671 PolarHBondContact N-ND2 3.17Å
631	V	50.7	Low	53.5	Low	80 Å²	80	101 Å²	101	49%	0.485	57%	0.567	S	S	.	*	P	Polyproline II helix	trans	-102.3	134.6	179.5	170.8	0	0	0	0	111.6	T624	T624-V631 HydrophobicContact CG2-CB 4.49Å; T624-V631 HydrophobicContact CG2-CG1 4.17Å; T624-V631 HydrophobicContact CG2-CG2 4.38Å
632	E	40	Very low	51.6	Low	174 Å²	174	104.3 Å²	104.3	81%	0.813	59%	0.588	S	S	*	*	P	Polyproline II helix	trans	-70.3	130.8	164	-76.2	-170.5	155.4	0	0	110.3	S634	E632-S634 PolarHBondContact O-N 2.94Å
633	K	41.2	Very low	49.8	Very low	158 Å²	158	107.2 Å²	107.2	69%	0.687	60%	0.604	S	S	*	*	P	Polyproline II helix	trans	-62.8	116.1	179	-72.2	-178.5	175.3	178.9	0	111.1
634	S	34.7	Very low	48.4	Very low	113 Å²	113	114.2 Å²	114.2	79%	0.79	64%	0.636	S	S	*	*			trans	-114.7	108.5	154.8	64.6	0	0	0	0	110.3	E632	E632-S634 PolarHBondContact O-N 2.94Å
635	G	36.1	Very low	47	Very low	75 Å²	75	113.6 Å²	113.6	77%	0.773	64%	0.636	S	S	*	*	S	Bend	trans	79.7	126.4	147.9	0	0	0	0	0	119.6
636	A	37	Very low	45.4	Very low	98 Å²	98	121.9 Å²	121.9	81%	0.81	67%	0.666	S	S	*	*	S	Bend	trans	80.5	112.1	159.7	0	0	0	0	0	118.5
637	N	36.8	Very low	43.5	Very low	157 Å²	157	120 Å²	120	84%	0.84	67%	0.667	S	S	*	*			trans	84.5	70.6	165.1	-58.6	-21.7	0	0	0	118.8
638	I	40.1	Very low	41.9	Very low	104 Å²	104	115.1 Å²	115.1	53%	0.533	67%	0.668	S	S	.	*			trans	-137.3	94.2	149.2	-56	177.1	0	0	0	108.8	E641	I638-E641 HydrophobicContact CG2-CB 4.32Å
639	A	37.9	Very low	40.3	Very low	97 Å²	97	115.9 Å²	115.9	80%	0.802	68%	0.679	S	S	*	*			trans	-123.4	65.1	164.9	0	0	0	0	0	108.8
640	L	39.8	Very low	39.4	Very low	169 Å²	169	120.1 Å²	120.1	89%	0.885	70%	0.701	S	S	*	*	S	Bend	trans	-162.6	0.6	156.4	-142.5	70.4	0	0	0	116.1
641	E	39.8	Very low	39.4	Very low	166 Å²	166	122 Å²	122	78%	0.776	71%	0.707	S	S	*	*			trans	-115.2	20.7	178.1	-71.2	-168.5	153.5	0	0	114.3	I638 K643	I638-E641 HydrophobicContact CG2-CB 4.32Å; E641-K643 VanDerWaalsContact C-N 3.35Å; E641-K643 PolarHBondContact O-N 3.48Å
642	S	35.8	Very low	40.2	Very low	107 Å²	107	118.2 Å²	118.2	75%	0.748	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.1	30.9	-174.7	75.1	0	0	0	0	115
643	K	36.5	Very low	42.5	Very low	198 Å²	198	109.9 Å²	109.9	86%	0.861	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.3	1.9	175.5	-85.6	-170	178.5	179.8	0	117.3	E641	E641-K643 VanDerWaalsContact C-N 3.35Å; E641-K643 PolarHBondContact O-N 3.48Å
644	L	35.6	Very low	44.9	Very low	171 Å²	171	102.6 Å²	102.6	90%	0.895	61%	0.613	S	S	*	*	S	Bend	trans	-132.3	12.2	-178.1	-119.5	92.6	0	0	0	119.5
645	S	30.9	Very low	47.7	Very low	98 Å²	98	97.9 Å²	97.9	69%	0.685	58%	0.579	S	S	*	*			trans	-150.1	109.3	162.6	63.5	0	0	0	0	114.9	S647	S645-S647 VanDerWaalsContact C-N 3.29Å; S645-S647 PolarHBondContact O-N 3.41Å
646	K	33.8	Very low	50.6	Low	222 Å²	222	94.7 Å²	94.7	97%	0.965	54%	0.544	S	S	*	.			trans	-77	79.4	150.6	-79.8	-179.8	174	177.4	0	107.8
647	S	29.2	Very low	53.4	Low	91 Å²	91	90.5 Å²	90.5	64%	0.636	51%	0.51	S	S	*	.			trans	-164.4	106.8	168.9	58.2	0	0	0	0	114.3	S645	S645-S647 VanDerWaalsContact C-N 3.29Å; S645-S647 PolarHBondContact O-N 3.41Å
648	G	37.6	Very low	56.2	Low	63 Å²	63	84.5 Å²	84.5	65%	0.649	48%	0.478	S	S	*	.			trans	57	177.6	138.2	0	0	0	0	0	121.2
649	P	42.7	Very low	58.7	Low	81 Å²	81	80.2 Å²	80.2	53%	0.526	46%	0.457	S	S	.	.			trans	-65.8	140.3	-175.4	-7	20.6	0	0	0	111.9	F651	P649-F651 HydrophobicContact CB-CD1 4.41Å; P649-F651 HydrophobicContact CB-CE1 3.69Å; P649-F651 HydrophobicContact CB-CZ 4.04Å; P649-F651 HydrophobicContact CG-CE1 3.94Å; P649-F651 HydrophobicContact CG-CZ 3.91Å; P649-F651 WeakPolarHBondContact O-CD2 3.38Å; P649-F651 WeakPolarHBondContact O-CE1 3.48Å; P649-F651 VanDerWaalsContact O-CE2 3.31Å; P649-F651 WeakPolarHBondContact O-CE2 3.33Å; P649-F651 WeakPolarHBondContact O-CG 3.44Å; P649-F651 WeakPolarHBondContact O-CZ 3.41Å
650	L	53.3	Low	61.1	Low	88 Å²	88	80.9 Å²	80.9	46%	0.461	45%	0.447	S	S	.	.			trans	-69.2	128.2	176.4	-94.4	66.2	0	0	0	110.3
651	F	58.7	Low	63.5	Low	52 Å²	52	79.6 Å²	79.6	23%	0.228	43%	0.434	C	S	.	.			trans	-123.9	135.2	-172.1	-57.4	-51.4	0	0	0	112.2	N601 C604 R622 P649 H670	N601-F651 VanDerWaalsContact ND2-C 3.31Å; N601-F651 PolarHBondContact ND2-O 2.95Å; N601-F651 WeakPolarHBondContact O-CB 3.36Å; C604-F651 VanDerWaalsContact SG-CD1 3.54Å; R622-F651 VanDerWaalsContact CZ-CE1 3.43Å; P649-F651 HydrophobicContact CB-CD1 4.41Å; P649-F651 HydrophobicContact CB-CE1 3.69Å; P649-F651 HydrophobicContact CB-CZ 4.04Å; P649-F651 HydrophobicContact CG-CE1 3.94Å; P649-F651 HydrophobicContact CG-CZ 3.91Å; P649-F651 WeakPolarHBondContact O-CD2 3.38Å; P649-F651 WeakPolarHBondContact O-CE1 3.48Å; P649-F651 VanDerWaalsContact O-CE2 3.31Å; P649-F651 WeakPolarHBondContact O-CE2 3.33Å; P649-F651 WeakPolarHBondContact O-CG 3.44Å; P649-F651 WeakPolarHBondContact O-CZ 3.41Å; F651-H670 PolarHBondContact N-CD2 3.46Å; F651-H670 PolarHBondContact N-NE2 2.91Å; F651-H670 PolarHBondContact O-CD2 2.93Å; F651-H670 VanDerWaalsContact O-CD2 3.32Å; F651-H670 PolarHBondContact O-NE2 3.44Å
652	S	67.6	Low	65.9	Low	0 Å²	0	72.3 Å²	72.3	0%	0	40%	0.4	C	S	.	.			cis	-176.4	-48.9	-36	166.9	0	0	0	0	107.9	N601 C604 F629 A630	N601-S652 PolarHBondContact ND2-N 2.79Å; C604-S652 WeakPolarHBondContact CB-OG 3.37Å; C604-S652 WeakPolarHBondContact SG-CB 3.13Å; F629-S652 VanDerWaalsContact CA-OG 3.29Å; F629-S652 WeakPolarHBondContact CA-OG 3.45Å; F629-S652 WeakPolarHBondContact CB-OG 3.47Å; F629-S652 PolarHBondContact O-OG 3.34Å; A630-S652 WeakPolarHBondContact CB-OG 3.14Å; A630-S652 PolarHBondContact N-OG 2.68Å
653	P	87.5	Confident	68.8	Low	0 Å²	0	69.1 Å²	69.1	0%	0	37%	0.374	C	S	.	.			trans	-120.6	154	157.3	36.9	-33.7	0	0	0	113.2	V599 N601 F629 V666 T667	V599-P653 HydrophobicContact CG1-CB 3.45Å; V599-P653 VanDerWaalsContact CG1-CB 3.45Å; V599-P653 HydrophobicContact CG1-CG 3.48Å; V599-P653 VanDerWaalsContact CG1-CG 3.48Å; N601-P653 PolarHBondContact ND2-O 3.18Å; F629-P653 HydrophobicContact CD1-CB 3.88Å; F629-P653 HydrophobicContact CE1-CB 4.07Å; F629-P653 HydrophobicContact CG-CB 4.16Å; F629-P653 HydrophobicContact CG-CG 4.33Å; P653-V666 HydrophobicContact CB-CG1 3.78Å; P653-T667 WeakPolarHBondContact CA-O 3.26Å
654	H	90.8	Very high	71.6	Confident	4 Å²	4	59.7 Å²	59.7	2%	0.019	33%	0.333	C	S	.	.			trans	-118.5	-76.4	-169.5	-150	-73.1	0	0	0	114.7	K586 G587 T667 F669 Q745	K586-H654 WeakPolarHBondContact CE-CE1 3.49Å; K586-H654 WeakPolarHBondContact CE-NE2 3.34Å; K586-H654 PolarHBondContact NZ-CD2 2.83Å; K586-H654 PolarHBondContact NZ-CE1 3.24Å; K586-H654 VanDerWaalsContact NZ-CE1 3.34Å; K586-H654 PolarHBondContact NZ-NE2 3.27Å; G587-H654 PolarHBondContact N-O 3.33Å; H654-T667 PolarHBondContact N-O 3.48Å; H654-F669 HydrophobicContact CB-CB 4.13Å; H654-F669 AromaticContact CD2-CD2 3.56Å; H654-F669 AromaticContact CD2-CG 3.8Å; H654-Q745 PolarHBondContact CE1-OE1 3.11Å
655	F	94.8	Very high	74.5	Confident	15 Å²	15	51.6 Å²	51.6	7%	0.066	29%	0.291	C	S	.	.			trans	-115.6	167.6	175.5	-77.2	-88.8	0	0	0	111.5	V666 T667 T701 V703	F655-V666 WeakPolarHBondContact O-CA 3.21Å; F655-T667 PolarHBondContact N-OG1 2.95Å; F655-T667 PolarHBondContact O-N 3.4Å; F655-T667 VanDerWaalsContact O-N 3.14Å; F655-T667 PolarHBondContact O-OG1 3.43Å; F655-T701 WeakPolarHBondContact CB-O 3.46Å; F655-T701 WeakPolarHBondContact CD2-O 3.48Å; F655-V703 HydrophobicContact CB-CG1 4.3Å
656	V	96.4	Very high	77.6	Confident	8 Å²	8	47 Å²	47	5%	0.048	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	145.5	179.1	54.1	0	0	0	0	110.5	A589 I597 V599 I664 V665 V666	A589-V656 HydrophobicContact CB-CG1 3.88Å; A589-V656 HydrophobicContact CB-CG2 4.3Å; I597-V656 HydrophobicContact CG2-CG2 4.06Å; V599-V656 HydrophobicContact CG2-CB 3.5Å; V599-V656 HydrophobicContact CG2-CG1 3.63Å; V599-V656 HydrophobicContact CG2-CG2 4.43Å; V656-I664 HydrophobicContact CG2-CG2 3.52Å; V656-V665 CarbonylContact C-O 3.44Å; V656-V665 VanDerWaalsContact CA-O 3.25Å; V656-V665 WeakPolarHBondContact CA-O 3.47Å; V656-V666 HydrophobicContact CB-CG2 4.43Å; V656-V666 HydrophobicContact CG2-CG2 4.17Å
657	A	96.5	Very high	80.5	Confident	10 Å²	10	36.4 Å²	36.4	8%	0.083	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	160.1	166.2	0	0	0	0	0	109.8	V665 V703 V705	A657-V665 PolarHBondContact N-O 2.87Å; A657-V665 PolarHBondContact O-N 2.86Å; A657-V703 HydrophobicContact CB-CG1 3.99Å; A657-V703 HydrophobicContact CB-CG2 4.26Å; A657-V705 HydrophobicContact CB-CG2 3.99Å
658	V	95.1	Very high	83.4	Confident	30 Å²	30	32 Å²	32	18%	0.182	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	133.8	177.7	-174	0	0	0	0	108	A589 D591 I597 E663	A589-V658 HydrophobicContact CB-CG2 4.02Å; D591-V658 HydrophobicContact CB-CG1 4.05Å; I597-V658 HydrophobicContact CD1-CG2 3.62Å; V658-E663 WeakPolarHBondContact CA-O 3.48Å
659	N	92.4	Very high	85.8	Confident	15 Å²	15	31 Å²	31	8%	0.08	16%	0.159	C	C	.	.			trans	-93.8	176.9	177.3	76.9	6.4	0	0	0	112.5	K661 N662 E663 V705	N659-K661 PolarHBondContact O-N 3.22Å; N659-K661 VanDerWaalsContact O-N 3.1Å; N659-K661 WeakPolarHBondContact OD1-CA 3.34Å; N659-K661 WeakPolarHBondContact OD1-CB 3.44Å; N659-K661 PolarHBondContact OD1-N 2.8Å; N659-N662 PolarHBondContact O-N 3.25Å; N659-N662 PolarHBondContact OD1-N 2.82Å; N659-E663 PolarHBondContact N-O 3.43Å; N659-E663 VanDerWaalsContact N-O 3.11Å; N659-E663 PolarHBondContact ND2-OE2 3.1Å; N659-E663 WeakPolarHBondContact OD1-CB 3.42Å; N659-E663 PolarHBondContact OD1-N 3.26Å; N659-V705 HydrophobicContact CB-CB 4.1Å; N659-V705 HydrophobicContact CB-CG1 3.6Å; N659-V705 HydrophobicContact CB-CG2 4.27Å
660	N	88.7	Confident	87.8	Confident	110 Å²	110	29.9 Å²	29.9	59%	0.588	15%	0.147	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-21.1	-179	-67.8	-23.2	0	0	0	114.1	K592 N662 A707	K592-N660 PolarHBondContact NZ-O 3.03Å; K592-N660 VanDerWaalsContact NZ-O 3.11Å; N660-N662 VanDerWaalsContact C-N 3.31Å; N660-A707 PolarHBondContact ND2-O 2.99Å
661	K	89.6	Confident	89.2	Confident	142 Å²	142	27.3 Å²	27.3	62%	0.617	13%	0.134	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86	2	175.4	-60	178.2	-175.4	170.7	0	113.1	N659 E663	N659-K661 PolarHBondContact O-N 3.22Å; N659-K661 VanDerWaalsContact O-N 3.1Å; N659-K661 WeakPolarHBondContact OD1-CA 3.34Å; N659-K661 WeakPolarHBondContact OD1-CB 3.44Å; N659-K661 PolarHBondContact OD1-N 2.8Å; K661-E663 HydrophobicContact CB-CG 4.06Å; K661-E663 PolarHBondContact O-N 2.95Å
662	N	91.6	Very high	90.7	Very high	13 Å²	13	26.7 Å²	26.7	7%	0.07	13%	0.132	C	C	.	.			trans	61.2	25.7	-169.3	-71.9	-7.8	0	0	0	114	K592 N593 N659 N660 A679	K592-N662 VanDerWaalsContact CD-OD1 3.31Å; K592-N662 WeakPolarHBondContact CD-OD1 3.37Å; K592-N662 VanDerWaalsContact CE-ND2 3.31Å; K592-N662 WeakPolarHBondContact CE-ND2 3.43Å; K592-N662 WeakPolarHBondContact CE-OD1 3.45Å; K592-N662 VanDerWaalsContact CG-OD1 3.25Å; K592-N662 WeakPolarHBondContact CG-OD1 3.46Å; N593-N662 PolarHBondContact ND2-ND2 3.47Å; N593-N662 VanDerWaalsContact ND2-ND2 3.14Å; N659-N662 PolarHBondContact O-N 3.25Å; N659-N662 PolarHBondContact OD1-N 2.82Å; N660-N662 VanDerWaalsContact C-N 3.31Å; N662-A679 HydrophobicContact CB-CB 3.98Å; N662-A679 WeakPolarHBondContact O-CA 3.26Å; N662-A679 PolarHBondContact O-N 3.12Å
663	E	94.8	Very high	91.8	Very high	40 Å²	40	26.7 Å²	26.7	19%	0.187	13%	0.132	C	C	.	.			trans	-78.7	136	169	-58.8	165.9	161.1	0	0	108.9	V658 N659 K661 V676 Y677 L684	V658-E663 WeakPolarHBondContact CA-O 3.48Å; N659-E663 PolarHBondContact N-O 3.43Å; N659-E663 VanDerWaalsContact N-O 3.11Å; N659-E663 PolarHBondContact ND2-OE2 3.1Å; N659-E663 WeakPolarHBondContact OD1-CB 3.42Å; N659-E663 PolarHBondContact OD1-N 3.26Å; K661-E663 HydrophobicContact CB-CG 4.06Å; K661-E663 PolarHBondContact O-N 2.95Å; E663-V676 HydrophobicContact CB-CG1 4.03Å; E663-Y677 CarbonylContact C-O 3.5Å; E663-Y677 WeakPolarHBondContact CA-O 3.47Å; E663-Y677 WeakPolarHBondContact CB-O 3.4Å; E663-L684 HydrophobicContact CG-CD1 3.99Å
664	I	95.9	Very high	92.2	Very high	1 Å²	1	26.7 Å²	26.7	1%	0.005	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	112.5	-174.1	-52.7	169.7	0	0	0	107.8	I597 I608 F619 V656 V666 V676 Y677	I597-I664 HydrophobicContact CD1-CD1 3.78Å; I597-I664 HydrophobicContact CD1-CG1 3.79Å; I597-I664 HydrophobicContact CG2-CG2 4.07Å; I608-I664 HydrophobicContact CD1-CD1 3.67Å; F619-I664 HydrophobicContact CE1-CD1 4.03Å; F619-I664 HydrophobicContact CZ-CD1 3.76Å; F619-I664 HydrophobicContact CZ-CG2 4.49Å; V656-I664 HydrophobicContact CG2-CG2 3.52Å; I664-V666 HydrophobicContact CG2-CG2 3.9Å; I664-V676 WeakPolarHBondContact O-CA 3.45Å; I664-Y677 PolarHBondContact N-O 3.22Å; I664-Y677 PolarHBondContact O-N 3.14Å
665	V	96.8	Very high	92.3	Very high	1 Å²	1	26.6 Å²	26.6	1%	0.006	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	120.8	-179.3	-172.7	0	0	0	0	108.9	V656 A657 V674 V676 V703 V705 I711	V656-V665 CarbonylContact C-O 3.44Å; V656-V665 VanDerWaalsContact CA-O 3.25Å; V656-V665 WeakPolarHBondContact CA-O 3.47Å; A657-V665 PolarHBondContact N-O 2.87Å; A657-V665 PolarHBondContact O-N 2.86Å; V665-V674 HydrophobicContact CG1-CG1 3.4Å; V665-V674 VanDerWaalsContact CG1-CG1 3.4Å; V665-V676 HydrophobicContact CG1-CG2 4.37Å; V665-V676 HydrophobicContact CG2-CG1 4.3Å; V665-V676 HydrophobicContact CG2-CG2 4.34Å; V665-V703 HydrophobicContact CB-CG2 4.38Å; V665-V703 HydrophobicContact CG1-CG2 3.76Å; V665-V705 HydrophobicContact CB-CG2 4.49Å; V665-V705 HydrophobicContact CG2-CG2 3.96Å; V665-I711 HydrophobicContact CG1-CD1 4.25Å; V665-I711 HydrophobicContact CG1-CG2 3.88Å; V665-I711 HydrophobicContact CG2-CD1 4.27Å
666	V	95.6	Very high	92.3	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	131.4	-174.1	-174.9	0	0	0	0	110.3	V599 V606 F629 P653 F655 V656 I664 K675 Y677	V599-V666 HydrophobicContact CG2-CG1 4.07Å; V606-V666 HydrophobicContact CG2-CG2 4.12Å; F629-V666 HydrophobicContact CE1-CB 4.15Å; F629-V666 HydrophobicContact CE1-CG1 3.75Å; F629-V666 HydrophobicContact CZ-CB 4.26Å; F629-V666 HydrophobicContact CZ-CG1 3.98Å; P653-V666 HydrophobicContact CB-CG1 3.78Å; F655-V666 WeakPolarHBondContact O-CA 3.21Å; V656-V666 HydrophobicContact CB-CG2 4.43Å; V656-V666 HydrophobicContact CG2-CG2 4.17Å; I664-V666 HydrophobicContact CG2-CG2 3.9Å; V666-K675 PolarHBondContact N-O 3.46Å; V666-K675 PolarHBondContact O-N 3.05Å; V666-Y677 HydrophobicContact CG2-CD2 4.39Å; V666-Y677 HydrophobicContact CG2-CE2 4.47Å
667	T	94.7	Very high	92.2	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	128.9	174.4	50.8	0	0	0	0	111.2	P653 H654 F655 V674 P700 T701 V703 V713	P653-T667 WeakPolarHBondContact CA-O 3.26Å; H654-T667 PolarHBondContact N-O 3.48Å; F655-T667 PolarHBondContact N-OG1 2.95Å; F655-T667 PolarHBondContact O-N 3.4Å; F655-T667 VanDerWaalsContact O-N 3.14Å; F655-T667 PolarHBondContact O-OG1 3.43Å; T667-V674 HydrophobicContact CG2-CG2 4.2Å; T667-P700 HydrophobicContact CG2-CB 4.46Å; T667-T701 VanDerWaalsContact CB-O 3.3Å; T667-T701 WeakPolarHBondContact CB-O 3.34Å; T667-T701 VanDerWaalsContact CG2-O 3.31Å; T667-T701 WeakPolarHBondContact CG2-O 3.32Å; T667-T701 PolarHBondContact OG1-O 3.06Å; T667-V703 HydrophobicContact CG2-CB 3.76Å; T667-V703 HydrophobicContact CG2-CG1 3.94Å; T667-V713 HydrophobicContact CG2-CG1 4.21Å
668	D	91	Very high	92	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	96.2	175.7	-170.2	-33.8	0	0	0	109.1	F629 H670 N671 H672 S673 K675	F629-D668 HydrophobicContact CD1-CB 4.44Å; D668-H670 VanDerWaalsContact C-N 3.3Å; D668-H670 PolarHBondContact O-N 2.77Å; D668-H670 PolarHBondContact OD1-N 3.04Å; D668-N671 HydrophobicContact CB-CB 4.23Å; D668-N671 VanDerWaalsContact CG-CB 3.48Å; D668-N671 PolarHBondContact O-N 3.34Å; D668-N671 WeakPolarHBondContact OD1-CB 3.5Å; D668-N671 PolarHBondContact OD1-N 3.02Å; D668-N671 PolarHBondContact OD2-ND2 3.44Å; D668-H672 PolarHBondContact O-N 2.82Å; D668-H672 VanDerWaalsContact O-N 3.13Å; D668-S673 WeakPolarHBondContact CB-O 3.42Å; D668-S673 PolarHBondContact N-O 2.91Å; D668-S673 PolarHBondContact O-N 2.98Å; D668-K675 WeakPolarHBondContact OD2-CE 3.42Å; D668-K675 IonicContact OD2-NZ 3.96Å
669	F	88	Confident	91.8	Very high	40 Å²	40	27.5 Å²	27.5	18%	0.175	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-36.1	-173.3	-179.4	-91.7	0	0	0	113	H654 A699 T701 W716	H654-F669 HydrophobicContact CB-CB 4.13Å; H654-F669 AromaticContact CD2-CD2 3.56Å; H654-F669 AromaticContact CD2-CG 3.8Å; F669-A699 HydrophobicContact CD1-CB 4.23Å; F669-A699 HydrophobicContact CD2-CB 3.72Å; F669-A699 WeakPolarHBondContact CD2-O 3.39Å; F669-A699 HydrophobicContact CE1-CB 3.98Å; F669-A699 HydrophobicContact CE2-CB 3.46Å; F669-A699 VanDerWaalsContact CE2-CB 3.46Å; F669-A699 HydrophobicContact CG-CB 4.1Å; F669-A699 HydrophobicContact CZ-CB 3.59Å; F669-A699 WeakPolarHBondContact O-CA 3.47Å; F669-A699 WeakPolarHBondContact O-CB 3.27Å; F669-T701 HydrophobicContact CD2-CG2 3.83Å; F669-T701 HydrophobicContact CE2-CG2 3.91Å; F669-W716 HydrophobicContact CE2-CD2 4.46Å; F669-W716 HydrophobicContact CE2-CE3 4.33Å; F669-W716 HydrophobicContact CZ-CE3 4.38Å
670	H	83.4	Confident	91.6	Very high	59 Å²	59	32.6 Å²	32.6	27%	0.273	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-25.2	-176.6	-70.4	-56.3	0	0	0	113.3	F651 D668 H672	F651-H670 PolarHBondContact N-CD2 3.46Å; F651-H670 PolarHBondContact N-NE2 2.91Å; F651-H670 PolarHBondContact O-CD2 2.93Å; F651-H670 VanDerWaalsContact O-CD2 3.32Å; F651-H670 PolarHBondContact O-NE2 3.44Å; D668-H670 VanDerWaalsContact C-N 3.3Å; D668-H670 PolarHBondContact O-N 2.77Å; D668-H670 PolarHBondContact OD1-N 3.04Å; H670-H672 VanDerWaalsContact C-N 3.31Å; H670-H672 PolarHBondContact O-CD2 3.39Å
671	N	83.2	Confident	91.6	Very high	34 Å²	34	27.9 Å²	27.9	18%	0.182	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	3.9	174.7	-67.7	-26.9	0	0	0	113.5	A630 D668 S673	A630-N671 PolarHBondContact N-ND2 3.17Å; D668-N671 HydrophobicContact CB-CB 4.23Å; D668-N671 VanDerWaalsContact CG-CB 3.48Å; D668-N671 PolarHBondContact O-N 3.34Å; D668-N671 WeakPolarHBondContact OD1-CB 3.5Å; D668-N671 PolarHBondContact OD1-N 3.02Å; D668-N671 PolarHBondContact OD2-ND2 3.44Å; N671-S673 VanDerWaalsContact C-N 3.25Å; N671-S673 PolarHBondContact O-N 3.19Å
672	H	90	Very high	91.6	Very high	39 Å²	39	27.3 Å²	27.3	18%	0.181	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.2	41	176.8	-55.5	-90	0	0	0	112.5	D668 H670 G688 S689 H690 F697 N698 A699	D668-H672 PolarHBondContact O-N 2.82Å; D668-H672 VanDerWaalsContact O-N 3.13Å; H670-H672 VanDerWaalsContact C-N 3.31Å; H670-H672 PolarHBondContact O-CD2 3.39Å; H672-G688 CarbonylContact O-C 3.58Å; H672-S689 CarbonylContact O-C 3.36Å; H672-S689 PolarHBondContact O-N 3.49Å; H672-H690 HydrophobicContact CB-CB 3.93Å; H672-H690 AromaticContact CD2-ND1 3.67Å; H672-H690 AromaticContact CE1-CE1 3.96Å; H672-H690 AromaticContact CE1-ND1 3.19Å; H672-H690 PolarHBondContact CE1-ND1 2.97Å; H672-H690 AromaticContact CG-ND1 3.64Å; H672-H690 AromaticContact ND1-ND1 3.29Å; H672-H690 PolarHBondContact ND1-ND1 3.18Å; H672-H690 AromaticContact NE2-ND1 3.38Å; H672-H690 PolarHBondContact NE2-ND1 3.1Å; H672-F697 WeakPolarHBondContact CB-O 3.46Å; H672-F697 PolarHBondContact ND1-O 3.48Å; H672-N698 PolarHBondContact CE1-OD1 3.07Å; H672-N698 WeakPolarHBondContact ND1-CA 3.36Å; H672-A699 PolarHBondContact ND1-N 3.38Å
673	S	91.6	Very high	91.6	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	165.3	-170.3	64.8	0	0	0	0	112.5	D668 N671 K686 F687	D668-S673 WeakPolarHBondContact CB-O 3.42Å; D668-S673 PolarHBondContact N-O 2.91Å; D668-S673 PolarHBondContact O-N 2.98Å; N671-S673 VanDerWaalsContact C-N 3.25Å; N671-S673 PolarHBondContact O-N 3.19Å; S673-K686 VanDerWaalsContact OG-CE 3.23Å; S673-K686 WeakPolarHBondContact OG-CE 3.28Å; S673-F687 WeakPolarHBondContact CA-O 3.36Å; S673-F687 WeakPolarHBondContact CB-O 3.47Å
674	V	95.1	Very high	91.5	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	138	173.7	-176.1	0	0	0	0	108.6	V665 T667 K686 F687 F697 V713	V665-V674 HydrophobicContact CG1-CG1 3.4Å; V665-V674 VanDerWaalsContact CG1-CG1 3.4Å; T667-V674 HydrophobicContact CG2-CG2 4.2Å; V674-K686 WeakPolarHBondContact O-CA 3.42Å; V674-F687 HydrophobicContact CB-CD1 4.28Å; V674-F687 HydrophobicContact CB-CD2 4.45Å; V674-F687 HydrophobicContact CB-CE1 3.77Å; V674-F687 HydrophobicContact CB-CE2 3.94Å; V674-F687 HydrophobicContact CB-CZ 3.58Å; V674-F687 HydrophobicContact CG1-CE1 3.75Å; V674-F687 HydrophobicContact CG1-CE2 4.48Å; V674-F687 HydrophobicContact CG1-CZ 3.66Å; V674-F687 HydrophobicContact CG2-CE2 4.17Å; V674-F687 HydrophobicContact CG2-CZ 4.14Å; V674-F687 PolarHBondContact N-O 3.47Å; V674-F687 PolarHBondContact O-N 3.49Å; V674-F697 HydrophobicContact CG2-CE2 3.94Å; V674-F697 HydrophobicContact CG2-CZ 4.06Å; V674-V713 HydrophobicContact CG2-CG1 4.12Å; V674-V713 HydrophobicContact CG2-CG2 4.02Å
675	K	93.3	Very high	91.3	Very high	2 Å²	2	33 Å²	33	1%	0.009	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	135.8	-178.1	-59.9	-170.8	-173	-158	0	110.1	E626 H628 F629 V666 D668 Y677 F683 K686	E626-K675 WeakPolarHBondContact O-CE 3.3Å; E626-K675 PolarHBondContact O-NZ 3.03Å; H628-K675 PolarHBondContact O-NZ 3.46Å; F629-K675 HydrophobicContact CD1-CD 4.03Å; F629-K675 HydrophobicContact CE1-CB 4.42Å; F629-K675 HydrophobicContact CE1-CD 3.84Å; V666-K675 PolarHBondContact N-O 3.46Å; V666-K675 PolarHBondContact O-N 3.05Å; D668-K675 WeakPolarHBondContact OD2-CE 3.42Å; D668-K675 IonicContact OD2-NZ 3.96Å; K675-Y677 HydrophobicContact CB-CD2 4.45Å; K675-Y677 HydrophobicContact CB-CE2 3.59Å; K675-F683 HydrophobicContact CB-CE2 4.35Å; K675-F683 HydrophobicContact CD-CE2 4.39Å; K675-F683 HydrophobicContact CG-CE2 4.42Å; K675-K686 HydrophobicContact CG-CB 4.39Å; K675-K686 HydrophobicContact CG-CG 4.26Å
676	V	94.9	Very high	91.1	Very high	2 Å²	2	36.6 Å²	36.6	1%	0.012	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	131.3	-178.6	-170	0	0	0	0	109.1	E663 I664 V665 L684 F685 F687 I711	E663-V676 HydrophobicContact CB-CG1 4.03Å; I664-V676 WeakPolarHBondContact O-CA 3.45Å; V665-V676 HydrophobicContact CG1-CG2 4.37Å; V665-V676 HydrophobicContact CG2-CG1 4.3Å; V665-V676 HydrophobicContact CG2-CG2 4.34Å; V676-L684 HydrophobicContact CG1-CD1 4.24Å; V676-L684 WeakPolarHBondContact O-CB 3.1Å; V676-L684 PolarHBondContact O-N 3.39Å; V676-F685 HydrophobicContact CB-CD1 4.26Å; V676-F685 HydrophobicContact CB-CE1 3.88Å; V676-F685 HydrophobicContact CB-CE2 4.26Å; V676-F685 HydrophobicContact CB-CZ 3.87Å; V676-F685 HydrophobicContact CG1-CE1 4.03Å; V676-F685 HydrophobicContact CG1-CZ 4.17Å; V676-F685 HydrophobicContact CG2-CD2 4.31Å; V676-F685 HydrophobicContact CG2-CE1 4.15Å; V676-F685 HydrophobicContact CG2-CE2 3.7Å; V676-F685 HydrophobicContact CG2-CZ 3.59Å; V676-F685 PolarHBondContact N-O 3.28Å; V676-F685 PolarHBondContact O-N 3.3Å; V676-F687 HydrophobicContact CG2-CE1 4.06Å; V676-I711 HydrophobicContact CG2-CD1 4.39Å
677	Y	94.3	Very high	91	Very high	4 Å²	4	37.5 Å²	37.5	2%	0.016	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	155.5	179.2	-59.5	-99.1	0	0	0	109.8	F619 R627 F629 E663 I664 V666 K675 E682 F683	F619-Y677 AromaticContact CD2-CD1 3.82Å; F619-Y677 HydrophobicContact CD2-CD1 3.82Å; F619-Y677 HydrophobicContact CD2-CE1 4.01Å; F619-Y677 HydrophobicContact CD2-CG 4.26Å; F619-Y677 AromaticContact CE2-CD1 3.64Å; F619-Y677 HydrophobicContact CE2-CD1 3.64Å; F619-Y677 AromaticContact CE2-CD2 3.94Å; F619-Y677 HydrophobicContact CE2-CD2 3.94Å; F619-Y677 HydrophobicContact CE2-CE1 4.07Å; F619-Y677 HydrophobicContact CE2-CE2 4.34Å; F619-Y677 AromaticContact CE2-CG 3.59Å; F619-Y677 HydrophobicContact CE2-CG 3.59Å; F619-Y677 HydrophobicContact CZ-CG 4.37Å; R627-Y677 PolarHBondContact O-OH 3.33Å; R627-Y677 VanDerWaalsContact O-OH 3.07Å; F629-Y677 HydrophobicContact CE1-CE2 4.13Å; F629-Y677 HydrophobicContact CE2-CE2 4.41Å; F629-Y677 AromaticContact CZ-CE2 3.53Å; F629-Y677 HydrophobicContact CZ-CE2 3.53Å; F629-Y677 AromaticContact CZ-CZ 3.57Å; F629-Y677 WeakPolarHBondContact CZ-OH 3.34Å; E663-Y677 CarbonylContact C-O 3.5Å; E663-Y677 WeakPolarHBondContact CA-O 3.47Å; E663-Y677 WeakPolarHBondContact CB-O 3.4Å; I664-Y677 PolarHBondContact N-O 3.22Å; I664-Y677 PolarHBondContact O-N 3.14Å; V666-Y677 HydrophobicContact CG2-CD2 4.39Å; V666-Y677 HydrophobicContact CG2-CE2 4.47Å; K675-Y677 HydrophobicContact CB-CD2 4.45Å; K675-Y677 HydrophobicContact CB-CE2 3.59Å; Y677-E682 CarbonylContact C-O 3.56Å; Y677-E682 WeakPolarHBondContact CA-O 3.37Å; Y677-E682 WeakPolarHBondContact CB-O 3.47Å; Y677-F683 HydrophobicContact CD1-CB 4.03Å; Y677-F683 HydrophobicContact CD1-CD2 4.46Å; Y677-F683 HydrophobicContact CE1-CB 3.85Å; Y677-F683 AromaticContact CE1-CD2 3.9Å; Y677-F683 HydrophobicContact CE1-CD2 3.9Å; Y677-F683 HydrophobicContact CE1-CG 4.39Å; Y677-F683 AromaticContact CZ-CD2 3.99Å
678	N	92.9	Very high	90.8	Very high	31 Å²	31	38.6 Å²	38.6	17%	0.166	20%	0.201	C	C	.	.			trans	-78	178.7	169.4	70.4	9.9	0	0	0	111.4	D680 G681 E682 L684	N678-D680 PolarHBondContact O-N 3.1Å; N678-D680 PolarHBondContact OD1-N 3.13Å; N678-D680 VanDerWaalsContact OD1-N 3.12Å; N678-G681 PolarHBondContact O-N 3.31Å; N678-G681 PolarHBondContact OD1-N 2.83Å; N678-G681 VanDerWaalsContact OD1-N 3.09Å; N678-E682 PolarHBondContact N-O 2.81Å; N678-E682 WeakPolarHBondContact ND2-CB 3.27Å; N678-E682 PolarHBondContact ND2-OE2 3.03Å; N678-E682 WeakPolarHBondContact OD1-CB 3.39Å; N678-E682 PolarHBondContact OD1-N 2.93Å; N678-L684 HydrophobicContact CB-CD1 4.16Å; N678-L684 HydrophobicContact CB-CD2 4.18Å; N678-L684 HydrophobicContact CB-CG 4.27Å
679	A	90.4	Very high	90.6	Very high	45 Å²	45	41.3 Å²	41.3	37%	0.372	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-27.2	-179.2	0	0	0	0	0	113.9	N662 G681	N662-A679 HydrophobicContact CB-CB 3.98Å; N662-A679 WeakPolarHBondContact O-CA 3.26Å; N662-A679 PolarHBondContact O-N 3.12Å; A679-G681 VanDerWaalsContact C-N 3.32Å
680	D	88.3	Confident	90.6	Very high	122 Å²	122	45.1 Å²	45.1	65%	0.652	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-8.2	179.4	-61.8	-53.1	0	0	0	112.9	N678	N678-D680 PolarHBondContact O-N 3.1Å; N678-D680 PolarHBondContact OD1-N 3.13Å; N678-D680 VanDerWaalsContact OD1-N 3.12Å
681	G	87.6	Confident	90.6	Very high	11 Å²	11	43 Å²	43	11%	0.113	23%	0.232	C	C	.	.	S	Bend	trans	90	14.4	-178.6	0	0	0	0	0	114.4	F619 N678 A679	F619-G681 VanDerWaalsContact CD1-CA 3.44Å; F619-G681 WeakPolarHBondContact CD2-O 3.37Å; N678-G681 PolarHBondContact O-N 3.31Å; N678-G681 PolarHBondContact OD1-N 2.83Å; N678-G681 VanDerWaalsContact OD1-N 3.09Å; A679-G681 VanDerWaalsContact C-N 3.32Å
682	E	90.2	Very high	90.7	Very high	129 Å²	129	48.7 Å²	48.7	60%	0.603	26%	0.258	S	S	*	.			trans	-78.7	138.5	172.3	-51.4	-176.2	132.5	0	0	110.5	Y677 N678 L684	Y677-E682 CarbonylContact C-O 3.56Å; Y677-E682 WeakPolarHBondContact CA-O 3.37Å; Y677-E682 WeakPolarHBondContact CB-O 3.47Å; N678-E682 PolarHBondContact N-O 2.81Å; N678-E682 WeakPolarHBondContact ND2-CB 3.27Å; N678-E682 PolarHBondContact ND2-OE2 3.03Å; N678-E682 WeakPolarHBondContact OD1-CB 3.39Å; N678-E682 PolarHBondContact OD1-N 2.93Å; E682-L684 PolarHBondContact O-N 3.03Å
683	F	91.9	Very high	90.2	Very high	41 Å²	41	48.3 Å²	48.3	18%	0.18	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	126.7	-179.5	175.6	-96.5	0	0	0	111	E626 R627 K675 Y677 F685 K686	E626-F683 HydrophobicContact CB-CZ 4.24Å; R627-F683 HydrophobicContact CB-CB 4.23Å; R627-F683 HydrophobicContact CB-CG 4.26Å; R627-F683 HydrophobicContact CG-CB 3.85Å; R627-F683 HydrophobicContact CG-CD1 3.77Å; R627-F683 HydrophobicContact CG-CD2 4.44Å; R627-F683 HydrophobicContact CG-CE1 4.39Å; R627-F683 HydrophobicContact CG-CG 3.77Å; K675-F683 HydrophobicContact CB-CE2 4.35Å; K675-F683 HydrophobicContact CD-CE2 4.39Å; K675-F683 HydrophobicContact CG-CE2 4.42Å; Y677-F683 HydrophobicContact CD1-CB 4.03Å; Y677-F683 HydrophobicContact CD1-CD2 4.46Å; Y677-F683 HydrophobicContact CE1-CB 3.85Å; Y677-F683 AromaticContact CE1-CD2 3.9Å; Y677-F683 HydrophobicContact CE1-CD2 3.9Å; Y677-F683 HydrophobicContact CE1-CG 4.39Å; Y677-F683 AromaticContact CZ-CD2 3.99Å; F683-F685 WeakPolarHBondContact CE2-O 3.42Å; F683-F685 VanDerWaalsContact CZ-C 3.4Å; F683-K686 HydrophobicContact CE2-CB 4.09Å; F683-K686 HydrophobicContact CZ-CB 3.78Å
684	L	91.8	Very high	89.9	Confident	73 Å²	73	53.5 Å²	53.5	38%	0.382	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	-66.4	176.3	-61.9	176.6	0	0	0	110.5	E663 V676 N678 E682	E663-L684 HydrophobicContact CG-CD1 3.99Å; V676-L684 HydrophobicContact CG1-CD1 4.24Å; V676-L684 WeakPolarHBondContact O-CB 3.1Å; V676-L684 PolarHBondContact O-N 3.39Å; N678-L684 HydrophobicContact CB-CD1 4.16Å; N678-L684 HydrophobicContact CB-CD2 4.18Å; N678-L684 HydrophobicContact CB-CG 4.27Å; E682-L684 PolarHBondContact O-N 3.03Å
685	F	92.7	Very high	89.5	Confident	60 Å²	60	54.2 Å²	54.2	26%	0.263	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	170.2	-178.9	63.1	-85.9	0	0	0	111.8	V676 F683 F687 S726 S727	V676-F685 HydrophobicContact CB-CD1 4.26Å; V676-F685 HydrophobicContact CB-CE1 3.88Å; V676-F685 HydrophobicContact CB-CE2 4.26Å; V676-F685 HydrophobicContact CB-CZ 3.87Å; V676-F685 HydrophobicContact CG1-CE1 4.03Å; V676-F685 HydrophobicContact CG1-CZ 4.17Å; V676-F685 HydrophobicContact CG2-CD2 4.31Å; V676-F685 HydrophobicContact CG2-CE1 4.15Å; V676-F685 HydrophobicContact CG2-CE2 3.7Å; V676-F685 HydrophobicContact CG2-CZ 3.59Å; V676-F685 PolarHBondContact N-O 3.28Å; V676-F685 PolarHBondContact O-N 3.3Å; F683-F685 WeakPolarHBondContact CE2-O 3.42Å; F683-F685 VanDerWaalsContact CZ-C 3.4Å; F685-F687 HydrophobicContact CD2-CD1 4.16Å; F685-F687 AromaticContact CE2-CD1 3.8Å; F685-F687 HydrophobicContact CE2-CD1 3.8Å; F685-F687 HydrophobicContact CE2-CE1 4.17Å; F685-S726 VanDerWaalsContact CZ-O 3.28Å; F685-S726 WeakPolarHBondContact CZ-O 3.39Å; F685-S727 WeakPolarHBondContact CE2-O 3.45Å
686	K	92.4	Very high	89.5	Confident	77 Å²	77	57.4 Å²	57.4	34%	0.335	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	142.2	176.7	171.3	-161.9	171.2	-161.6	0	108.4	S673 V674 K675 F683	S673-K686 VanDerWaalsContact OG-CE 3.23Å; S673-K686 WeakPolarHBondContact OG-CE 3.28Å; V674-K686 WeakPolarHBondContact O-CA 3.42Å; K675-K686 HydrophobicContact CG-CB 4.39Å; K675-K686 HydrophobicContact CG-CG 4.26Å; F683-K686 HydrophobicContact CE2-CB 4.09Å; F683-K686 HydrophobicContact CZ-CB 3.78Å
687	F	94.2	Very high	89.3	Confident	19 Å²	19	57.3 Å²	57.3	8%	0.083	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	161.4	168.9	64.4	-83.1	0	0	0	111.1	S673 V674 V676 F685 F697 I711 F724 G728	S673-F687 WeakPolarHBondContact CA-O 3.36Å; S673-F687 WeakPolarHBondContact CB-O 3.47Å; V674-F687 HydrophobicContact CB-CD1 4.28Å; V674-F687 HydrophobicContact CB-CD2 4.45Å; V674-F687 HydrophobicContact CB-CE1 3.77Å; V674-F687 HydrophobicContact CB-CE2 3.94Å; V674-F687 HydrophobicContact CB-CZ 3.58Å; V674-F687 HydrophobicContact CG1-CE1 3.75Å; V674-F687 HydrophobicContact CG1-CE2 4.48Å; V674-F687 HydrophobicContact CG1-CZ 3.66Å; V674-F687 HydrophobicContact CG2-CE2 4.17Å; V674-F687 HydrophobicContact CG2-CZ 4.14Å; V674-F687 PolarHBondContact N-O 3.47Å; V674-F687 PolarHBondContact O-N 3.49Å; V676-F687 HydrophobicContact CG2-CE1 4.06Å; F685-F687 HydrophobicContact CD2-CD1 4.16Å; F685-F687 AromaticContact CE2-CD1 3.8Å; F685-F687 HydrophobicContact CE2-CD1 3.8Å; F685-F687 HydrophobicContact CE2-CE1 4.17Å; F687-F697 HydrophobicContact CD2-CE2 4.39Å; F687-F697 HydrophobicContact CE2-CE2 4.42Å; F687-F697 HydrophobicContact CE2-CZ 4.31Å; F687-I711 HydrophobicContact CE1-CD1 3.78Å; F687-I711 HydrophobicContact CZ-CB 4.38Å; F687-I711 HydrophobicContact CZ-CD1 3.78Å; F687-I711 HydrophobicContact CZ-CG2 4.17Å; F687-F724 AromaticContact CD2-CD1 3.89Å; F687-F724 HydrophobicContact CD2-CD1 3.89Å; F687-F724 HydrophobicContact CD2-CE1 4.08Å; F687-F724 HydrophobicContact CD2-CG 4.29Å; F687-F724 HydrophobicContact CE2-CB 4.12Å; F687-F724 AromaticContact CE2-CD1 3.71Å; F687-F724 HydrophobicContact CE2-CD1 3.71Å; F687-F724 AromaticContact CE2-CD2 3.91Å; F687-F724 HydrophobicContact CE2-CD2 3.91Å; F687-F724 HydrophobicContact CE2-CE1 4.08Å; F687-F724 HydrophobicContact CE2-CE2 4.27Å; F687-F724 AromaticContact CE2-CG 3.63Å; F687-F724 HydrophobicContact CE2-CG 3.63Å; F687-F724 HydrophobicContact CE2-CZ 4.37Å; F687-F724 HydrophobicContact CZ-CB 4.48Å; F687-F724 HydrophobicContact CZ-CG 4.4Å; F687-G728 WeakPolarHBondContact CD2-O 3.45Å
688	G	89.3	Confident	89.1	Confident	22 Å²	22	59.4 Å²	59.4	23%	0.227	33%	0.325	C	S	.	.			trans	91.1	147.6	-176	0	0	0	0	0	115	H672 G695	H672-G688 CarbonylContact O-C 3.58Å; G688-G695 WeakPolarHBondContact CA-O 3.31Å
689	S	86.8	Confident	88.9	Confident	58 Å²	58	58.2 Å²	58.2	41%	0.406	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	163	175	65.5	0	0	0	0	110.5	H672 G691 Q696 F697	H672-S689 CarbonylContact O-C 3.36Å; H672-S689 PolarHBondContact O-N 3.49Å; S689-G691 PolarHBondContact O-N 2.9Å; S689-Q696 CarbonylContact O-C 3.59Å; S689-Q696 VanDerWaalsContact O-CA 3.24Å; S689-Q696 WeakPolarHBondContact O-CA 3.38Å; S689-Q696 WeakPolarHBondContact O-CB 3.26Å; S689-F697 PolarHBondContact O-N 2.91Å
690	H	88.4	Confident	89.1	Confident	120 Å²	120	56.1 Å²	56.1	56%	0.556	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-57.5	130.2	172.9	178.7	77.1	0	0	0	111.6	H672 F697	H672-H690 HydrophobicContact CB-CB 3.93Å; H672-H690 AromaticContact CD2-ND1 3.67Å; H672-H690 AromaticContact CE1-CE1 3.96Å; H672-H690 AromaticContact CE1-ND1 3.19Å; H672-H690 PolarHBondContact CE1-ND1 2.97Å; H672-H690 AromaticContact CG-ND1 3.64Å; H672-H690 AromaticContact ND1-ND1 3.29Å; H672-H690 PolarHBondContact ND1-ND1 3.18Å; H672-H690 AromaticContact NE2-ND1 3.38Å; H672-H690 PolarHBondContact NE2-ND1 3.1Å; H690-F697 WeakPolarHBondContact CA-O 3.37Å
691	G	83.1	Confident	89.4	Confident	13 Å²	13	50.3 Å²	50.3	13%	0.134	27%	0.271	C	S	.	.	S	Bend	trans	152.9	-171.1	171.7	0	0	0	0	0	113.8	S689 F697 N718	S689-G691 PolarHBondContact O-N 2.9Å; G691-F697 PolarHBondContact N-O 3.35Å; G691-F697 VanDerWaalsContact N-O 3.15Å; G691-F697 CarbonylContact O-C 3.59Å; G691-N718 PolarHBondContact O-ND2 3.47Å
692	E	85.2	Confident	89.7	Confident	155 Å²	155	49.8 Å²	49.8	72%	0.724	27%	0.266	S	S	*	.	S	Bend	trans	-113.6	-8.2	-175.4	-59.5	-179.1	173.4	0	0	112.6	R720	E692-R720 PolarHBondContact O-NH1 3.44Å; E692-R720 PolarHBondContact O-NH2 3.02Å; E692-R720 VanDerWaalsContact O-NH2 3.15Å
693	G	80.3	Confident	90.1	Very high	31 Å²	31	44 Å²	44	32%	0.32	24%	0.24	S	C	.	.	S	Bend	trans	-74.5	176.3	179.9	0	0	0	0	0	114.1	G695 Q696 R720	G693-G695 PolarHBondContact O-N 2.84Å; G693-Q696 WeakPolarHBondContact O-CB 3.09Å; G693-Q696 PolarHBondContact O-N 3.41Å; G693-R720 PolarHBondContact O-NH2 3.49Å
694	N	86.1	Confident	90.3	Very high	108 Å²	108	42.5 Å²	42.5	58%	0.578	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.9	128.9	175.1	-64	-0.1	0	0	0	110.6	Q696 F730 Y733	N694-Q696 PolarHBondContact O-N 3.26Å; N694-F730 HydrophobicContact CB-CD1 3.78Å; N694-F730 HydrophobicContact CB-CD2 4.27Å; N694-F730 HydrophobicContact CB-CE1 3.96Å; N694-F730 HydrophobicContact CB-CE2 4.43Å; N694-F730 HydrophobicContact CB-CG 3.95Å; N694-F730 HydrophobicContact CB-CZ 4.3Å; N694-Y733 VanDerWaalsContact CA-OH 3.27Å; N694-Y733 WeakPolarHBondContact CA-OH 3.5Å; N694-Y733 PolarHBondContact N-OH 2.8Å; N694-Y733 VanDerWaalsContact OD1-CE2 3.3Å; N694-Y733 WeakPolarHBondContact OD1-CE2 3.48Å; N694-Y733 PolarHBondContact OD1-OH 2.73Å
695	G	86.7	Confident	90.4	Very high	16 Å²	16	40.1 Å²	40.1	17%	0.165	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.7	5.3	-176.3	0	0	0	0	0	115.1	G688 G693	G688-G695 WeakPolarHBondContact CA-O 3.31Å; G693-G695 PolarHBondContact O-N 2.84Å
696	Q	91.6	Very high	90.4	Very high	69 Å²	69	37.5 Å²	37.5	32%	0.322	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	151.6	169.7	-57.2	-177.5	-24.2	0	0	110.2	S689 G693 N694 R720 Q722	S689-Q696 CarbonylContact O-C 3.59Å; S689-Q696 VanDerWaalsContact O-CA 3.24Å; S689-Q696 WeakPolarHBondContact O-CA 3.38Å; S689-Q696 WeakPolarHBondContact O-CB 3.26Å; G693-Q696 WeakPolarHBondContact O-CB 3.09Å; G693-Q696 PolarHBondContact O-N 3.41Å; N694-Q696 PolarHBondContact O-N 3.26Å; Q696-R720 PolarHBondContact O-NH2 3Å; Q696-Q722 PolarHBondContact O-NE2 3.24Å
697	F	91.9	Very high	90.2	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	152	-179.5	-58	-72.1	0	0	0	111.9	H672 V674 F687 S689 H690 G691 P700 V713 D715 Q722 F724	H672-F697 WeakPolarHBondContact CB-O 3.46Å; H672-F697 PolarHBondContact ND1-O 3.48Å; V674-F697 HydrophobicContact CG2-CE2 3.94Å; V674-F697 HydrophobicContact CG2-CZ 4.06Å; F687-F697 HydrophobicContact CD2-CE2 4.39Å; F687-F697 HydrophobicContact CE2-CE2 4.42Å; F687-F697 HydrophobicContact CE2-CZ 4.31Å; S689-F697 PolarHBondContact O-N 2.91Å; H690-F697 WeakPolarHBondContact CA-O 3.37Å; G691-F697 PolarHBondContact N-O 3.35Å; G691-F697 VanDerWaalsContact N-O 3.15Å; G691-F697 CarbonylContact O-C 3.59Å; F697-P700 HydrophobicContact CB-CB 4.18Å; F697-P700 HydrophobicContact CB-CG 3.97Å; F697-P700 HydrophobicContact CD1-CB 4.12Å; F697-P700 HydrophobicContact CD2-CG 4.46Å; F697-P700 HydrophobicContact CG-CB 4.12Å; F697-P700 HydrophobicContact CG-CG 4.14Å; F697-V713 HydrophobicContact CD1-CG1 4.3Å; F697-V713 HydrophobicContact CE1-CB 3.9Å; F697-V713 HydrophobicContact CE1-CG1 3.69Å; F697-V713 HydrophobicContact CE1-CG2 4.47Å; F697-V713 HydrophobicContact CZ-CB 4.21Å; F697-V713 HydrophobicContact CZ-CG1 4.08Å; F697-V713 HydrophobicContact CZ-CG2 4.28Å; F697-D715 HydrophobicContact CD1-CB 4.16Å; F697-Q722 HydrophobicContact CE1-CB 4.39Å; F697-F724 AromaticContact CE1-CE2 3.66Å; F697-F724 HydrophobicContact CE1-CE2 3.66Å; F697-F724 AromaticContact CE1-CZ 3.7Å; F697-F724 HydrophobicContact CE1-CZ 3.7Å; F697-F724 HydrophobicContact CE2-CE2 4.47Å; F697-F724 HydrophobicContact CE2-CZ 4.07Å; F697-F724 HydrophobicContact CZ-CD2 4.34Å; F697-F724 HydrophobicContact CZ-CE1 4.16Å; F697-F724 AromaticContact CZ-CE2 3.32Å; F697-F724 HydrophobicContact CZ-CE2 3.32Å; F697-F724 AromaticContact CZ-CZ 3.21Å; F697-F724 HydrophobicContact CZ-CZ 3.21Å
698	N	89.2	Confident	89.9	Confident	47 Å²	47	40.9 Å²	40.9	25%	0.251	24%	0.244	S	C	.	.	S	Bend	trans	-118.7	93.7	163.4	-167.8	8.2	0	0	0	109.2	H672 D715 G717 N718	H672-N698 PolarHBondContact CE1-OD1 3.07Å; H672-N698 WeakPolarHBondContact ND1-CA 3.36Å; N698-D715 PolarHBondContact N-OD1 3.04Å; N698-G717 WeakPolarHBondContact O-CA 3.47Å; N698-G717 PolarHBondContact O-N 3.3Å; N698-N718 VanDerWaalsContact CB-OD1 3.29Å; N698-N718 WeakPolarHBondContact CB-OD1 3.49Å; N698-N718 PolarHBondContact N-ND2 3.36Å
699	A	89.8	Confident	90	Very high	7 Å²	7	40.4 Å²	40.4	6%	0.058	24%	0.239	C	C	.	.	S	Bend	trans	58.9	65.5	178.5	0	0	0	0	0	114.2	F669 H672 W716	F669-A699 HydrophobicContact CD1-CB 4.23Å; F669-A699 HydrophobicContact CD2-CB 3.72Å; F669-A699 WeakPolarHBondContact CD2-O 3.39Å; F669-A699 HydrophobicContact CE1-CB 3.98Å; F669-A699 HydrophobicContact CE2-CB 3.46Å; F669-A699 VanDerWaalsContact CE2-CB 3.46Å; F669-A699 HydrophobicContact CG-CB 4.1Å; F669-A699 HydrophobicContact CZ-CB 3.59Å; F669-A699 WeakPolarHBondContact O-CA 3.47Å; F669-A699 WeakPolarHBondContact O-CB 3.27Å; H672-A699 PolarHBondContact ND1-N 3.38Å; A699-W716 HydrophobicContact CB-CE3 4.31Å; A699-W716 VanDerWaalsContact O-CB 3.3Å; A699-W716 WeakPolarHBondContact O-CB 3.27Å
700	P	94.9	Very high	90.4	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	142.4	-175.9	28.8	-33.4	0	0	0	111.3	T667 F697 V713 A714	T667-P700 HydrophobicContact CG2-CB 4.46Å; F697-P700 HydrophobicContact CB-CB 4.18Å; F697-P700 HydrophobicContact CB-CG 3.97Å; F697-P700 HydrophobicContact CD1-CB 4.12Å; F697-P700 HydrophobicContact CD2-CG 4.46Å; F697-P700 HydrophobicContact CG-CB 4.12Å; F697-P700 HydrophobicContact CG-CG 4.14Å; P700-V713 HydrophobicContact CB-CG1 3.79Å; P700-A714 WeakPolarHBondContact CA-O 3.37Å
701	T	94.3	Very high	90.7	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	-91.1	-174.1	49.2	0	0	0	0	111	F655 T667 F669 A714 W716 P744 Q745	F655-T701 WeakPolarHBondContact CB-O 3.46Å; F655-T701 WeakPolarHBondContact CD2-O 3.48Å; T667-T701 VanDerWaalsContact CB-O 3.3Å; T667-T701 WeakPolarHBondContact CB-O 3.34Å; T667-T701 VanDerWaalsContact CG2-O 3.31Å; T667-T701 WeakPolarHBondContact CG2-O 3.32Å; T667-T701 PolarHBondContact OG1-O 3.06Å; F669-T701 HydrophobicContact CD2-CG2 3.83Å; F669-T701 HydrophobicContact CE2-CG2 3.91Å; T701-A714 PolarHBondContact N-O 2.93Å; T701-A714 PolarHBondContact OG1-O 3.33Å; T701-W716 HydrophobicContact CG2-CB 3.55Å; T701-W716 HydrophobicContact CG2-CG 3.95Å; T701-P744 PolarHBondContact OG1-O 3.09Å; T701-Q745 PolarHBondContact OG1-O 3.03Å
702	G	93.7	Very high	91.4	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	148.2	-175.2	0	0	0	0	0	112.5	V713 A714 Q745	G702-V713 WeakPolarHBondContact O-CA 3.42Å; G702-A714 PolarHBondContact O-N 3.15Å; G702-Q745 WeakPolarHBondContact CA-O 3.48Å; G702-Q745 PolarHBondContact N-O 3.39Å
703	V	97.3	Very high	92	Very high	8 Å²	8	25.3 Å²	25.3	5%	0.048	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	141.8	174.3	59.5	0	0	0	0	110	F655 A657 V665 T667 I711 I712 V713	F655-V703 HydrophobicContact CB-CG1 4.3Å; A657-V703 HydrophobicContact CB-CG1 3.99Å; A657-V703 HydrophobicContact CB-CG2 4.26Å; V665-V703 HydrophobicContact CB-CG2 4.38Å; V665-V703 HydrophobicContact CG1-CG2 3.76Å; T667-V703 HydrophobicContact CG2-CB 3.76Å; T667-V703 HydrophobicContact CG2-CG1 3.94Å; V703-I711 HydrophobicContact CG2-CG2 3.66Å; V703-I712 CarbonylContact C-O 3.4Å; V703-I712 VanDerWaalsContact CA-O 3.25Å; V703-I712 WeakPolarHBondContact CA-O 3.45Å; V703-V713 HydrophobicContact CG2-CG2 4.35Å
704	A	96.1	Very high	92.7	Very high	10 Å²	10	23.8 Å²	23.8	8%	0.083	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	164.1	166.1	0	0	0	0	0	109.3	I712 L747	A704-I712 PolarHBondContact N-O 3.47Å; A704-I712 PolarHBondContact O-N 3.45Å; A704-L747 HydrophobicContact CB-CD1 3.28Å; A704-L747 VanDerWaalsContact N-CD1 3.32Å
705	V	94.9	Very high	93.1	Very high	23 Å²	23	18.7 Å²	18.7	14%	0.139	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	134.5	176.7	-170.3	0	0	0	0	108.5	A657 N659 V665 N710 I711 L749	A657-V705 HydrophobicContact CB-CG2 3.99Å; N659-V705 HydrophobicContact CB-CB 4.1Å; N659-V705 HydrophobicContact CB-CG1 3.6Å; N659-V705 HydrophobicContact CB-CG2 4.27Å; V665-V705 HydrophobicContact CB-CG2 4.49Å; V665-V705 HydrophobicContact CG2-CG2 3.96Å; V705-N710 VanDerWaalsContact CA-O 3.28Å; V705-N710 WeakPolarHBondContact CA-O 3.49Å; V705-N710 WeakPolarHBondContact CG1-O 3.28Å; V705-I711 HydrophobicContact CG2-CG1 4.39Å; V705-L749 WeakPolarHBondContact O-CD1 3.34Å
706	D	92.4	Very high	93.4	Very high	5 Å²	5	22.9 Å²	22.9	3%	0.027	13%	0.127	C	C	.	.			trans	-82.3	179.9	177.1	80.4	0.9	0	0	0	112.8	N708 G709 N710 L749 Y770	D706-N708 VanDerWaalsContact C-N 3.26Å; D706-N708 PolarHBondContact O-N 3.18Å; D706-N708 WeakPolarHBondContact OD1-CA 3.47Å; D706-N708 WeakPolarHBondContact OD1-CB 3.44Å; D706-N708 PolarHBondContact OD1-N 3.21Å; D706-G709 PolarHBondContact O-N 3.12Å; D706-G709 PolarHBondContact OD1-N 3.18Å; D706-N710 PolarHBondContact N-O 3.5Å; D706-N710 WeakPolarHBondContact OD1-CB 3.39Å; D706-N710 PolarHBondContact OD1-N 2.86Å; D706-N710 WeakPolarHBondContact OD2-CB 3.28Å; D706-N710 PolarHBondContact OD2-ND2 3.15Å; D706-L749 HydrophobicContact CB-CD1 3.56Å; D706-Y770 HydrophobicContact CB-CE1 4.03Å; D706-Y770 PolarHBondContact OD2-OH 3.33Å
707	A	88.3	Confident	93.2	Very high	63 Å²	63	21 Å²	21	52%	0.521	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-27.9	179.4	0	0	0	0	0	113.4	N660 G709	N660-A707 PolarHBondContact ND2-O 2.99Å; A707-G709 VanDerWaalsContact C-N 3.29Å
708	N	88.8	Confident	93	Very high	104 Å²	104	22.5 Å²	22.5	56%	0.556	14%	0.135	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-10.3	178.8	-63.8	-30.8	0	0	0	112.3	D706	D706-N708 VanDerWaalsContact C-N 3.26Å; D706-N708 PolarHBondContact O-N 3.18Å; D706-N708 WeakPolarHBondContact OD1-CA 3.47Å; D706-N708 WeakPolarHBondContact OD1-CB 3.44Å; D706-N708 PolarHBondContact OD1-N 3.21Å
709	G	90.5	Very high	93.2	Very high	12 Å²	12	22.3 Å²	22.3	12%	0.124	14%	0.137	C	C	.	.			trans	89.9	11.3	-177	0	0	0	0	0	114	D706 A707 S726	D706-G709 PolarHBondContact O-N 3.12Å; D706-G709 PolarHBondContact OD1-N 3.18Å; A707-G709 VanDerWaalsContact C-N 3.29Å; G709-S726 WeakPolarHBondContact O-CA 3.5Å; G709-S726 WeakPolarHBondContact O-CB 3.18Å
710	N	94.6	Very high	93.3	Very high	24 Å²	24	23.8 Å²	23.8	13%	0.128	14%	0.141	C	C	.	.			trans	-72.3	136.8	173.1	-57	-43.1	0	0	0	110.4	V705 D706 V723 F724	V705-N710 VanDerWaalsContact CA-O 3.28Å; V705-N710 WeakPolarHBondContact CA-O 3.49Å; V705-N710 WeakPolarHBondContact CG1-O 3.28Å; D706-N710 PolarHBondContact N-O 3.5Å; D706-N710 WeakPolarHBondContact OD1-CB 3.39Å; D706-N710 PolarHBondContact OD1-N 2.86Å; D706-N710 WeakPolarHBondContact OD2-CB 3.28Å; D706-N710 PolarHBondContact OD2-ND2 3.15Å; N710-V723 HydrophobicContact CB-CG1 4.28Å; N710-F724 CarbonylContact C-O 3.56Å; N710-F724 WeakPolarHBondContact CA-O 3.41Å; N710-F724 VanDerWaalsContact CB-O 3.29Å; N710-F724 WeakPolarHBondContact CB-O 3.25Å
711	I	96.1	Very high	93.3	Very high	4 Å²	4	23.8 Å²	23.8	2%	0.021	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	121.4	-176.2	-53.5	171.9	0	0	0	108.9	V665 V676 F687 V703 V705 V713 V723 F724	V665-I711 HydrophobicContact CG1-CD1 4.25Å; V665-I711 HydrophobicContact CG1-CG2 3.88Å; V665-I711 HydrophobicContact CG2-CD1 4.27Å; V676-I711 HydrophobicContact CG2-CD1 4.39Å; F687-I711 HydrophobicContact CE1-CD1 3.78Å; F687-I711 HydrophobicContact CZ-CB 4.38Å; F687-I711 HydrophobicContact CZ-CD1 3.78Å; F687-I711 HydrophobicContact CZ-CG2 4.17Å; V703-I711 HydrophobicContact CG2-CG2 3.66Å; V705-I711 HydrophobicContact CG2-CG1 4.39Å; I711-V713 HydrophobicContact CG2-CG2 3.83Å; I711-V723 CarbonylContact O-C 3.54Å; I711-F724 HydrophobicContact CB-CB 4.34Å; I711-F724 PolarHBondContact N-O 2.83Å; I711-F724 PolarHBondContact O-N 2.72Å
712	I	96.8	Very high	93.3	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	125.6	-180	-53.6	168.7	0	0	0	107.8	V703 A704 I721 Q722 V723 I734 L747 L749 V755 Y770	V703-I712 CarbonylContact C-O 3.4Å; V703-I712 VanDerWaalsContact CA-O 3.25Å; V703-I712 WeakPolarHBondContact CA-O 3.45Å; A704-I712 PolarHBondContact N-O 3.47Å; A704-I712 PolarHBondContact O-N 3.45Å; I712-I721 HydrophobicContact CG2-CG2 3.49Å; I712-I721 VanDerWaalsContact CG2-CG2 3.49Å; I712-Q722 CarbonylContact C-O 3.35Å; I712-Q722 WeakPolarHBondContact CA-O 3.45Å; I712-V723 HydrophobicContact CG1-CG1 4.32Å; I712-V723 HydrophobicContact CG1-CG2 4.39Å; I712-I734 HydrophobicContact CG2-CD1 4.15Å; I712-L747 HydrophobicContact CB-CD1 4.15Å; I712-L747 HydrophobicContact CG2-CD1 4.01Å; I712-L747 HydrophobicContact CG2-CD2 4.18Å; I712-L749 HydrophobicContact CD1-CD1 4Å; I712-L749 HydrophobicContact CD1-CD2 3.74Å; I712-L749 HydrophobicContact CD1-CG 4.07Å; I712-V755 HydrophobicContact CD1-CG2 3.8Å; I712-Y770 HydrophobicContact CD1-CD1 4.15Å; I712-Y770 HydrophobicContact CD1-CE1 3.71Å; I712-Y770 HydrophobicContact CD1-CE2 4.22Å
713	V	97.3	Very high	93.4	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	127.1	-170.9	-172.6	0	0	0	0	110.7	T667 V674 F697 P700 G702 V703 I711 I721 Q722 F724	T667-V713 HydrophobicContact CG2-CG1 4.21Å; V674-V713 HydrophobicContact CG2-CG1 4.12Å; V674-V713 HydrophobicContact CG2-CG2 4.02Å; F697-V713 HydrophobicContact CD1-CG1 4.3Å; F697-V713 HydrophobicContact CE1-CB 3.9Å; F697-V713 HydrophobicContact CE1-CG1 3.69Å; F697-V713 HydrophobicContact CE1-CG2 4.47Å; F697-V713 HydrophobicContact CZ-CB 4.21Å; F697-V713 HydrophobicContact CZ-CG1 4.08Å; F697-V713 HydrophobicContact CZ-CG2 4.28Å; P700-V713 HydrophobicContact CB-CG1 3.79Å; G702-V713 WeakPolarHBondContact O-CA 3.42Å; V703-V713 HydrophobicContact CG2-CG2 4.35Å; I711-V713 HydrophobicContact CG2-CG2 3.83Å; V713-I721 WeakPolarHBondContact O-CA 3.15Å; V713-Q722 PolarHBondContact N-O 2.88Å; V713-Q722 PolarHBondContact O-N 3.09Å; V713-F724 HydrophobicContact CB-CE2 4.39Å; V713-F724 HydrophobicContact CG2-CD2 4.11Å; V713-F724 HydrophobicContact CG2-CE2 4.18Å
714	A	96.1	Very high	93.3	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	120.8	169.2	0	0	0	0	0	109.4	P700 T701 G702 P744 L747	P700-A714 WeakPolarHBondContact CA-O 3.37Å; T701-A714 PolarHBondContact N-O 2.93Å; T701-A714 PolarHBondContact OG1-O 3.33Å; G702-A714 PolarHBondContact O-N 3.15Å; A714-P744 HydrophobicContact CB-CB 3.9Å; A714-P744 HydrophobicContact CB-CG 4.18Å; A714-L747 HydrophobicContact CB-CD2 3.67Å
715	D	94.4	Very high	93.1	Very high	0 Å²	0	25 Å²	25	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	87.4	-179.6	-171	3.1	0	0	0	108.9	F697 N698 G717 N718 S719 R720 Q722	F697-D715 HydrophobicContact CD1-CB 4.16Å; N698-D715 PolarHBondContact N-OD1 3.04Å; D715-G717 PolarHBondContact O-N 3.18Å; D715-N718 HydrophobicContact CB-CB 4.46Å; D715-N718 PolarHBondContact O-N 3.03Å; D715-N718 PolarHBondContact OD1-ND2 3.03Å; D715-N718 WeakPolarHBondContact OD2-CB 3.32Å; D715-N718 PolarHBondContact OD2-ND2 2.87Å; D715-S719 PolarHBondContact O-N 2.9Å; D715-R720 HydrophobicContact CB-CG 3.76Å; D715-R720 PolarHBondContact N-O 3.19Å; D715-R720 PolarHBondContact O-N 2.79Å; D715-R720 IonicContact OD2-CZ 3.43Å; D715-R720 IonicContact OD2-NE 3.05Å; D715-R720 PolarHBondContact OD2-NE 3.09Å; D715-R720 IonicContact OD2-NH2 3.66Å; D715-R720 PolarHBondContact OD2-NH2 3.34Å; D715-Q722 PolarHBondContact OD2-NE2 3.02Å
716	W	93.1	Very high	92.9	Very high	104 Å²	104	26.4 Å²	26.4	39%	0.394	16%	0.157	S	C	.	.	G	3₁₀ helix	trans	-58.4	-45.7	-166.6	176.6	91.5	0	0	0	113.5	F669 A699 T701 N718 S719 G743	F669-W716 HydrophobicContact CE2-CD2 4.46Å; F669-W716 HydrophobicContact CE2-CE3 4.33Å; F669-W716 HydrophobicContact CZ-CE3 4.38Å; A699-W716 HydrophobicContact CB-CE3 4.31Å; A699-W716 VanDerWaalsContact O-CB 3.3Å; A699-W716 WeakPolarHBondContact O-CB 3.27Å; T701-W716 HydrophobicContact CG2-CB 3.55Å; T701-W716 HydrophobicContact CG2-CG 3.95Å; W716-N718 VanDerWaalsContact C-N 3.35Å; W716-S719 PolarHBondContact O-N 3.43Å; W716-G743 VanDerWaalsContact CD1-C 3.47Å; W716-G743 VanDerWaalsContact NE1-CA 3.31Å
717	G	87.1	Confident	92.8	Very high	29 Å²	29	29.3 Å²	29.3	30%	0.299	18%	0.177	S	C	.	.	G	3₁₀ helix	trans	-76.8	-21.2	-176.2	0	0	0	0	0	113.8	N698 D715	N698-G717 WeakPolarHBondContact O-CA 3.47Å; N698-G717 PolarHBondContact O-N 3.3Å; D715-G717 PolarHBondContact O-N 3.18Å
718	N	88.2	Confident	92.8	Very high	33 Å²	33	26.9 Å²	26.9	18%	0.176	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-100.4	3.5	175.3	-64.7	-29.7	0	0	0	112.8	G691 N698 D715 W716 R720	G691-N718 PolarHBondContact O-ND2 3.47Å; N698-N718 VanDerWaalsContact CB-OD1 3.29Å; N698-N718 WeakPolarHBondContact CB-OD1 3.49Å; N698-N718 PolarHBondContact N-ND2 3.36Å; D715-N718 HydrophobicContact CB-CB 4.46Å; D715-N718 PolarHBondContact O-N 3.03Å; D715-N718 PolarHBondContact OD1-ND2 3.03Å; D715-N718 WeakPolarHBondContact OD2-CB 3.32Å; D715-N718 PolarHBondContact OD2-ND2 2.87Å; W716-N718 VanDerWaalsContact C-N 3.35Å; N718-R720 VanDerWaalsContact C-N 3.3Å; N718-R720 HydrophobicContact CB-CG 3.99Å; N718-R720 PolarHBondContact O-N 2.94Å
719	S	91.8	Very high	92.9	Very high	43 Å²	43	24.9 Å²	24.9	30%	0.301	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.7	39.6	176.9	-87.4	0	0	0	0	114.3	D715 W716 L741	D715-S719 PolarHBondContact O-N 2.9Å; W716-S719 PolarHBondContact O-N 3.43Å; S719-L741 WeakPolarHBondContact CB-O 3.27Å; S719-L741 PolarHBondContact OG-O 3.4Å
720	R	92.8	Very high	92.9	Very high	37 Å²	37	27 Å²	27	14%	0.14	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	170.5	-175.1	67.9	-174.4	-176.9	178.9	1.7	112.8	E692 G693 Q696 D715 N718 Y733	E692-R720 PolarHBondContact O-NH1 3.44Å; E692-R720 PolarHBondContact O-NH2 3.02Å; E692-R720 VanDerWaalsContact O-NH2 3.15Å; G693-R720 PolarHBondContact O-NH2 3.49Å; Q696-R720 PolarHBondContact O-NH2 3Å; D715-R720 HydrophobicContact CB-CG 3.76Å; D715-R720 PolarHBondContact N-O 3.19Å; D715-R720 PolarHBondContact O-N 2.79Å; D715-R720 IonicContact OD2-CZ 3.43Å; D715-R720 IonicContact OD2-NE 3.05Å; D715-R720 PolarHBondContact OD2-NE 3.09Å; D715-R720 IonicContact OD2-NH2 3.66Å; D715-R720 PolarHBondContact OD2-NH2 3.34Å; N718-R720 VanDerWaalsContact C-N 3.3Å; N718-R720 HydrophobicContact CB-CG 3.99Å; N718-R720 PolarHBondContact O-N 2.94Å; R720-Y733 PolarHBondContact NH1-OH 3.14Å
721	I	95.2	Very high	92.6	Very high	0 Å²	0	30 Å²	30	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	131.5	171.2	-53.7	169.5	0	0	0	108.3	I712 V713 Y733 I734 L741 L747 V755 V757 Y768	I712-I721 HydrophobicContact CG2-CG2 3.49Å; I712-I721 VanDerWaalsContact CG2-CG2 3.49Å; V713-I721 WeakPolarHBondContact O-CA 3.15Å; I721-Y733 WeakPolarHBondContact O-CA 3.27Å; I721-I734 HydrophobicContact CB-CB 4.15Å; I721-I734 HydrophobicContact CB-CD1 4.25Å; I721-I734 HydrophobicContact CB-CG1 4.29Å; I721-I734 HydrophobicContact CD1-CD1 4.43Å; I721-I734 HydrophobicContact CG2-CB 4.5Å; I721-I734 HydrophobicContact CG2-CD1 3.71Å; I721-I734 HydrophobicContact CG2-CG1 4.08Å; I721-I734 PolarHBondContact O-N 3.07Å; I721-I734 VanDerWaalsContact O-N 3.14Å; I721-L741 HydrophobicContact CD1-CD1 3.71Å; I721-L741 HydrophobicContact CG1-CD1 3.67Å; I721-L747 HydrophobicContact CG2-CD2 4.36Å; I721-V755 HydrophobicContact CD1-CG1 4.46Å; I721-V757 HydrophobicContact CD1-CB 4Å; I721-V757 HydrophobicContact CD1-CG1 4.03Å; I721-V757 HydrophobicContact CD1-CG2 4.1Å; I721-Y768 HydrophobicContact CD1-CD2 4.5Å
722	Q	94.5	Very high	92.3	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	144.2	179.2	-75.2	-174.8	88.1	0	0	110.9	Q696 F697 I712 V713 D715 F724 F730 Y733	Q696-Q722 PolarHBondContact O-NE2 3.24Å; F697-Q722 HydrophobicContact CE1-CB 4.39Å; I712-Q722 CarbonylContact C-O 3.35Å; I712-Q722 WeakPolarHBondContact CA-O 3.45Å; V713-Q722 PolarHBondContact N-O 2.88Å; V713-Q722 PolarHBondContact O-N 3.09Å; D715-Q722 PolarHBondContact OD2-NE2 3.02Å; Q722-F724 HydrophobicContact CB-CD2 4.31Å; Q722-F724 HydrophobicContact CB-CE2 3.38Å; Q722-F724 HydrophobicContact CB-CZ 3.84Å; Q722-F724 HydrophobicContact CG-CE2 4.49Å; Q722-F730 HydrophobicContact CB-CE2 4.48Å; Q722-F730 HydrophobicContact CG-CE2 4.14Å; Q722-Y733 HydrophobicContact CG-CD1 3.46Å; Q722-Y733 VanDerWaalsContact CG-CD1 3.46Å; Q722-Y733 HydrophobicContact CG-CE1 3.28Å
723	V	94.7	Very high	91.9	Very high	2 Å²	2	36 Å²	36	1%	0.012	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	134.8	177.4	-171.6	0	0	0	0	109	N710 I711 I712 L731 S732 I734 Y770	N710-V723 HydrophobicContact CB-CG1 4.28Å; I711-V723 CarbonylContact O-C 3.54Å; I712-V723 HydrophobicContact CG1-CG1 4.32Å; I712-V723 HydrophobicContact CG1-CG2 4.39Å; V723-L731 HydrophobicContact CG1-CD1 4.36Å; V723-L731 PolarHBondContact O-N 3.29Å; V723-S732 PolarHBondContact N-O 3.05Å; V723-S732 PolarHBondContact O-N 3.24Å; V723-I734 HydrophobicContact CG2-CD1 4.49Å; V723-I734 HydrophobicContact CG2-CG1 4.02Å; V723-Y770 HydrophobicContact CG1-CE2 4.07Å; V723-Y770 HydrophobicContact CG2-CE2 4Å
724	F	94.8	Very high	91.5	Very high	1 Å²	1	36.3 Å²	36.3	0%	0.004	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	153.9	-178.4	-61.4	-96.3	0	0	0	110.2	F687 F697 N710 I711 V713 Q722 G728 S729 F730	F687-F724 AromaticContact CD2-CD1 3.89Å; F687-F724 HydrophobicContact CD2-CD1 3.89Å; F687-F724 HydrophobicContact CD2-CE1 4.08Å; F687-F724 HydrophobicContact CD2-CG 4.29Å; F687-F724 HydrophobicContact CE2-CB 4.12Å; F687-F724 AromaticContact CE2-CD1 3.71Å; F687-F724 HydrophobicContact CE2-CD1 3.71Å; F687-F724 AromaticContact CE2-CD2 3.91Å; F687-F724 HydrophobicContact CE2-CD2 3.91Å; F687-F724 HydrophobicContact CE2-CE1 4.08Å; F687-F724 HydrophobicContact CE2-CE2 4.27Å; F687-F724 AromaticContact CE2-CG 3.63Å; F687-F724 HydrophobicContact CE2-CG 3.63Å; F687-F724 HydrophobicContact CE2-CZ 4.37Å; F687-F724 HydrophobicContact CZ-CB 4.48Å; F687-F724 HydrophobicContact CZ-CG 4.4Å; F697-F724 AromaticContact CE1-CE2 3.66Å; F697-F724 HydrophobicContact CE1-CE2 3.66Å; F697-F724 AromaticContact CE1-CZ 3.7Å; F697-F724 HydrophobicContact CE1-CZ 3.7Å; F697-F724 HydrophobicContact CE2-CE2 4.47Å; F697-F724 HydrophobicContact CE2-CZ 4.07Å; F697-F724 HydrophobicContact CZ-CD2 4.34Å; F697-F724 HydrophobicContact CZ-CE1 4.16Å; F697-F724 AromaticContact CZ-CE2 3.32Å; F697-F724 HydrophobicContact CZ-CE2 3.32Å; F697-F724 AromaticContact CZ-CZ 3.21Å; F697-F724 HydrophobicContact CZ-CZ 3.21Å; N710-F724 CarbonylContact C-O 3.56Å; N710-F724 WeakPolarHBondContact CA-O 3.41Å; N710-F724 VanDerWaalsContact CB-O 3.29Å; N710-F724 WeakPolarHBondContact CB-O 3.25Å; I711-F724 HydrophobicContact CB-CB 4.34Å; I711-F724 PolarHBondContact N-O 2.83Å; I711-F724 PolarHBondContact O-N 2.72Å; V713-F724 HydrophobicContact CB-CE2 4.39Å; V713-F724 HydrophobicContact CG2-CD2 4.11Å; V713-F724 HydrophobicContact CG2-CE2 4.18Å; Q722-F724 HydrophobicContact CB-CD2 4.31Å; Q722-F724 HydrophobicContact CB-CE2 3.38Å; Q722-F724 HydrophobicContact CB-CZ 3.84Å; Q722-F724 HydrophobicContact CG-CE2 4.49Å; F724-G728 WeakPolarHBondContact CD1-O 3.47Å; F724-S729 CarbonylContact C-O 3.58Å; F724-S729 WeakPolarHBondContact CA-O 3.41Å; F724-S729 WeakPolarHBondContact CB-O 3.45Å; F724-F730 HydrophobicContact CD1-CB 4.23Å; F724-F730 HydrophobicContact CE1-CB 4Å; F724-F730 HydrophobicContact CE1-CD2 4.27Å; F724-F730 HydrophobicContact CZ-CD2 4.33Å
725	D	92.6	Very high	90.8	Very high	42 Å²	42	36.9 Å²	36.9	23%	0.225	21%	0.21	C	C	.	.			trans	-74.3	176.4	169.2	71.9	14.4	0	0	0	111.7	S727 G728 S729 L731	D725-S727 VanDerWaalsContact CG-OG 3.23Å; D725-S727 PolarHBondContact O-N 3.22Å; D725-S727 VanDerWaalsContact O-N 3.11Å; D725-S727 VanDerWaalsContact OD1-CA 3.28Å; D725-S727 WeakPolarHBondContact OD1-CA 3.14Å; D725-S727 WeakPolarHBondContact OD1-CB 3.18Å; D725-S727 PolarHBondContact OD1-N 2.98Å; D725-S727 PolarHBondContact OD1-OG 3.33Å; D725-S727 PolarHBondContact OD2-OG 3.49Å; D725-S727 VanDerWaalsContact OD2-OG 3.11Å; D725-G728 PolarHBondContact O-N 3.18Å; D725-G728 PolarHBondContact OD1-N 3.05Å; D725-S729 PolarHBondContact N-O 3.28Å; D725-S729 PolarHBondContact OD1-N 3Å; D725-S729 WeakPolarHBondContact OD2-CB 3.23Å; D725-L731 HydrophobicContact CB-CD1 4.02Å; D725-L731 HydrophobicContact CB-CD2 4.21Å; D725-L731 HydrophobicContact CB-CG 4.2Å
726	S	91	Very high	90.3	Very high	52 Å²	52	37.9 Å²	37.9	36%	0.364	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-13.1	177.7	67	0	0	0	0	114.9	F685 G709	F685-S726 VanDerWaalsContact CZ-O 3.28Å; F685-S726 WeakPolarHBondContact CZ-O 3.39Å; G709-S726 WeakPolarHBondContact O-CA 3.5Å; G709-S726 WeakPolarHBondContact O-CB 3.18Å
727	S	90.3	Very high	89.6	Confident	66 Å²	66	35.6 Å²	35.6	46%	0.462	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-9.1	175.3	77.9	0	0	0	0	113.1	F685 D725 S729	F685-S727 WeakPolarHBondContact CE2-O 3.45Å; D725-S727 VanDerWaalsContact CG-OG 3.23Å; D725-S727 PolarHBondContact O-N 3.22Å; D725-S727 VanDerWaalsContact O-N 3.11Å; D725-S727 VanDerWaalsContact OD1-CA 3.28Å; D725-S727 WeakPolarHBondContact OD1-CA 3.14Å; D725-S727 WeakPolarHBondContact OD1-CB 3.18Å; D725-S727 PolarHBondContact OD1-N 2.98Å; D725-S727 PolarHBondContact OD1-OG 3.33Å; D725-S727 PolarHBondContact OD2-OG 3.49Å; D725-S727 VanDerWaalsContact OD2-OG 3.11Å; S727-S729 PolarHBondContact OG-OG 2.91Å; S727-S729 VanDerWaalsContact OG-OG 3.13Å
728	G	88.3	Confident	89	Confident	12 Å²	12	36.7 Å²	36.7	12%	0.124	22%	0.222	C	C	.	.	S	Bend	trans	88.4	14.4	-175.3	0	0	0	0	0	114.3	F687 F724 D725	F687-G728 WeakPolarHBondContact CD2-O 3.45Å; F724-G728 WeakPolarHBondContact CD1-O 3.47Å; D725-G728 PolarHBondContact O-N 3.18Å; D725-G728 PolarHBondContact OD1-N 3.05Å
729	S	90.1	Very high	88.7	Confident	61 Å²	61	36.7 Å²	36.7	43%	0.427	22%	0.222	S	C	.	.			trans	-81	136.6	173.7	-56.9	0	0	0	0	110.3	F724 D725 S727 L731	F724-S729 CarbonylContact C-O 3.58Å; F724-S729 WeakPolarHBondContact CA-O 3.41Å; F724-S729 WeakPolarHBondContact CB-O 3.45Å; D725-S729 PolarHBondContact N-O 3.28Å; D725-S729 PolarHBondContact OD1-N 3Å; D725-S729 WeakPolarHBondContact OD2-CB 3.23Å; S727-S729 PolarHBondContact OG-OG 2.91Å; S727-S729 VanDerWaalsContact OG-OG 3.13Å; S729-L731 PolarHBondContact O-N 3.45Å
730	F	91.9	Very high	88.4	Confident	56 Å²	56	38.2 Å²	38.2	25%	0.246	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66	130.4	-179.4	172.3	-92.2	0	0	0	111	N694 Q722 F724 S732 Y733	N694-F730 HydrophobicContact CB-CD1 3.78Å; N694-F730 HydrophobicContact CB-CD2 4.27Å; N694-F730 HydrophobicContact CB-CE1 3.96Å; N694-F730 HydrophobicContact CB-CE2 4.43Å; N694-F730 HydrophobicContact CB-CG 3.95Å; N694-F730 HydrophobicContact CB-CZ 4.3Å; Q722-F730 HydrophobicContact CB-CE2 4.48Å; Q722-F730 HydrophobicContact CG-CE2 4.14Å; F724-F730 HydrophobicContact CD1-CB 4.23Å; F724-F730 HydrophobicContact CE1-CB 4Å; F724-F730 HydrophobicContact CE1-CD2 4.27Å; F724-F730 HydrophobicContact CZ-CD2 4.33Å; F730-S732 VanDerWaalsContact CE2-O 3.29Å; F730-S732 WeakPolarHBondContact CE2-O 3.5Å; F730-S732 VanDerWaalsContact CZ-C 3.48Å; F730-Y733 HydrophobicContact CE1-CE2 4.21Å; F730-Y733 HydrophobicContact CE2-CD1 4.21Å; F730-Y733 HydrophobicContact CE2-CD2 4.07Å; F730-Y733 AromaticContact CE2-CE1 3.89Å; F730-Y733 HydrophobicContact CE2-CE1 3.89Å; F730-Y733 AromaticContact CE2-CE2 3.74Å; F730-Y733 HydrophobicContact CE2-CE2 3.74Å; F730-Y733 HydrophobicContact CE2-CG 4.29Å; F730-Y733 AromaticContact CE2-CZ 3.62Å; F730-Y733 HydrophobicContact CZ-CD1 4.49Å; F730-Y733 AromaticContact CZ-CD2 3.53Å; F730-Y733 HydrophobicContact CZ-CD2 3.53Å; F730-Y733 HydrophobicContact CZ-CE1 4.26Å; F730-Y733 AromaticContact CZ-CE2 3.24Å; F730-Y733 HydrophobicContact CZ-CE2 3.24Å; F730-Y733 HydrophobicContact CZ-CG 4.15Å; F730-Y733 AromaticContact CZ-CZ 3.65Å
731	L	88.6	Confident	88.3	Confident	88 Å²	88	36.6 Å²	36.6	46%	0.461	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	-59.7	176.1	-64.4	177.8	0	0	0	111.1	V723 D725 S729	V723-L731 HydrophobicContact CG1-CD1 4.36Å; V723-L731 PolarHBondContact O-N 3.29Å; D725-L731 HydrophobicContact CB-CD1 4.02Å; D725-L731 HydrophobicContact CB-CD2 4.21Å; D725-L731 HydrophobicContact CB-CG 4.2Å; S729-L731 PolarHBondContact O-N 3.45Å
732	S	89.1	Confident	88	Confident	54 Å²	54	44.2 Å²	44.2	38%	0.378	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	174.5	-171.8	65.7	0	0	0	0	112.8	V723 F730	V723-S732 PolarHBondContact N-O 3.05Å; V723-S732 PolarHBondContact O-N 3.24Å; F730-S732 VanDerWaalsContact CE2-O 3.29Å; F730-S732 WeakPolarHBondContact CE2-O 3.5Å; F730-S732 VanDerWaalsContact CZ-C 3.48Å
733	Y	88.3	Confident	87.7	Confident	76 Å²	76	44.7 Å²	44.7	30%	0.298	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	149.3	165.9	-61.2	-82.6	0	0	0	109.2	N694 R720 I721 Q722 F730	N694-Y733 VanDerWaalsContact CA-OH 3.27Å; N694-Y733 WeakPolarHBondContact CA-OH 3.5Å; N694-Y733 PolarHBondContact N-OH 2.8Å; N694-Y733 VanDerWaalsContact OD1-CE2 3.3Å; N694-Y733 WeakPolarHBondContact OD1-CE2 3.48Å; N694-Y733 PolarHBondContact OD1-OH 2.73Å; R720-Y733 PolarHBondContact NH1-OH 3.14Å; I721-Y733 WeakPolarHBondContact O-CA 3.27Å; Q722-Y733 HydrophobicContact CG-CD1 3.46Å; Q722-Y733 VanDerWaalsContact CG-CD1 3.46Å; Q722-Y733 HydrophobicContact CG-CE1 3.28Å; F730-Y733 HydrophobicContact CE1-CE2 4.21Å; F730-Y733 HydrophobicContact CE2-CD1 4.21Å; F730-Y733 HydrophobicContact CE2-CD2 4.07Å; F730-Y733 AromaticContact CE2-CE1 3.89Å; F730-Y733 HydrophobicContact CE2-CE1 3.89Å; F730-Y733 AromaticContact CE2-CE2 3.74Å; F730-Y733 HydrophobicContact CE2-CE2 3.74Å; F730-Y733 HydrophobicContact CE2-CG 4.29Å; F730-Y733 AromaticContact CE2-CZ 3.62Å; F730-Y733 HydrophobicContact CZ-CD1 4.49Å; F730-Y733 AromaticContact CZ-CD2 3.53Å; F730-Y733 HydrophobicContact CZ-CD2 3.53Å; F730-Y733 HydrophobicContact CZ-CE1 4.26Å; F730-Y733 AromaticContact CZ-CE2 3.24Å; F730-Y733 HydrophobicContact CZ-CE2 3.24Å; F730-Y733 HydrophobicContact CZ-CG 4.15Å; F730-Y733 AromaticContact CZ-CZ 3.65Å
734	I	87.7	Confident	87.7	Confident	6 Å²	6	44.6 Å²	44.6	3%	0.031	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	130.8	163	-56.3	-174.9	0	0	0	107.5	E478 I712 I721 V723 T736 V755 Y768 Y770	E478-I734 WeakPolarHBondContact OE2-CG2 3.31Å; I712-I734 HydrophobicContact CG2-CD1 4.15Å; I721-I734 HydrophobicContact CB-CB 4.15Å; I721-I734 HydrophobicContact CB-CD1 4.25Å; I721-I734 HydrophobicContact CB-CG1 4.29Å; I721-I734 HydrophobicContact CD1-CD1 4.43Å; I721-I734 HydrophobicContact CG2-CB 4.5Å; I721-I734 HydrophobicContact CG2-CD1 3.71Å; I721-I734 HydrophobicContact CG2-CG1 4.08Å; I721-I734 PolarHBondContact O-N 3.07Å; I721-I734 VanDerWaalsContact O-N 3.14Å; V723-I734 HydrophobicContact CG2-CD1 4.49Å; V723-I734 HydrophobicContact CG2-CG1 4.02Å; I734-T736 PolarHBondContact O-N 3.31Å; I734-T736 VanDerWaalsContact O-N 3.1Å; I734-V755 HydrophobicContact CD1-CB 3.88Å; I734-V755 HydrophobicContact CD1-CG1 3.9Å; I734-V755 HydrophobicContact CD1-CG2 3.71Å; I734-Y768 HydrophobicContact CG2-CD1 4.2Å; I734-Y768 HydrophobicContact CG2-CG 3.87Å; I734-Y770 HydrophobicContact CD1-CD2 4.5Å
735	N	82.1	Confident	87.7	Confident	13 Å²	13	45.6 Å²	45.6	7%	0.07	26%	0.264	C	S	.	.			trans	-70.8	103.7	-178.8	-179.5	19.5	0	0	0	111.1	I475 E476 E478 S737	I475-N735 HydrophobicContact CB-CB 4.34Å; I475-N735 WeakPolarHBondContact CB-ND2 3.5Å; I475-N735 HydrophobicContact CG2-CB 3.67Å; I475-N735 WeakPolarHBondContact CG2-ND2 3.28Å; I475-N735 PolarHBondContact O-ND2 3.31Å; E476-N735 PolarHBondContact O-ND2 3Å; E478-N735 HydrophobicContact CB-CB 4.24Å; E478-N735 HydrophobicContact CG-CB 3.99Å; E478-N735 PolarHBondContact OE2-N 3.02Å; N735-S737 PolarHBondContact ND2-OG 2.94Å; N735-S737 VanDerWaalsContact OD1-CB 3.27Å; N735-S737 WeakPolarHBondContact OD1-CB 3.49Å; N735-S737 PolarHBondContact OD1-N 2.78Å; N735-S737 VanDerWaalsContact OD1-N 3.13Å; N735-S737 PolarHBondContact OD1-OG 3.37Å
736	T	84.8	Confident	87.8	Confident	20 Å²	20	43.7 Å²	43.7	12%	0.123	25%	0.254	C	S	.	.			trans	-105	20.7	177.3	66.5	0	0	0	0	112.7	I734 D739 P740 L741 Y768	I734-T736 PolarHBondContact O-N 3.31Å; I734-T736 VanDerWaalsContact O-N 3.1Å; T736-D739 CarbonylContact O-C 3.44Å; T736-P740 VanDerWaalsContact O-CA 3.31Å; T736-P740 WeakPolarHBondContact O-CA 3.5Å; T736-L741 HydrophobicContact CG2-CD1 3.6Å; T736-L741 HydrophobicContact CG2-CG 4Å; T736-Y768 HydrophobicContact CG2-CE1 3.98Å; T736-Y768 HydrophobicContact CG2-CE2 4.29Å
737	S	76.8	Confident	88	Confident	56 Å²	56	41.6 Å²	41.6	39%	0.392	24%	0.238	S	C	.	.	S	Bend	trans	-70.5	-34.3	-173.5	57.6	0	0	0	0	113.4	N735	N735-S737 PolarHBondContact ND2-OG 2.94Å; N735-S737 VanDerWaalsContact OD1-CB 3.27Å; N735-S737 WeakPolarHBondContact OD1-CB 3.49Å; N735-S737 PolarHBondContact OD1-N 2.78Å; N735-S737 VanDerWaalsContact OD1-N 3.13Å; N735-S737 PolarHBondContact OD1-OG 3.37Å
738	A	75.2	Confident	88.3	Confident	52 Å²	52	38.9 Å²	38.9	43%	0.43	22%	0.22	S	C	.	.	S	Bend	trans	-65.2	-40.3	-179.7	0	0	0	0	0	113.7	D477	D477-A738 HydrophobicContact CB-CB 4.43Å; D477-A738 WeakPolarHBondContact OD1-CB 3.22Å; D477-A738 WeakPolarHBondContact OD2-CB 3.46Å
739	D	81.3	Confident	88.6	Confident	34 Å²	34	40.2 Å²	40.2	18%	0.182	22%	0.224	C	C	.	.	S	Bend	trans	-138.5	92.4	172.1	-166.8	-9.8	0	0	0	109.5	L479 R482 T736 K766 Y768	L479-D739 HydrophobicContact CD2-CB 3.68Å; R482-D739 WeakPolarHBondContact CD-OD2 3.36Å; R482-D739 IonicContact NH1-OD2 3.07Å; T736-D739 CarbonylContact O-C 3.44Å; D739-K766 HydrophobicContact CB-CD 4.31Å; D739-K766 PolarHBondContact O-NZ 3.27Å; D739-K766 WeakPolarHBondContact OD1-CE 3.29Å; D739-K766 IonicContact OD1-NZ 3.59Å; D739-K766 PolarHBondContact OD1-NZ 2.82Å; D739-K766 WeakPolarHBondContact OD2-CE 3.24Å; D739-K766 IonicContact OD2-NZ 3.6Å; D739-K766 PolarHBondContact OD2-NZ 3.29Å; D739-Y768 PolarHBondContact O-OH 2.67Å
740	P	86.6	Confident	88.7	Confident	74 Å²	74	37.7 Å²	37.7	48%	0.481	21%	0.206	S	C	.	.			trans	-54.2	137.9	-175.6	-27.8	35.2	0	0	0	113.2	T736 N762 K766	T736-P740 VanDerWaalsContact O-CA 3.31Å; T736-P740 WeakPolarHBondContact O-CA 3.5Å; P740-N762 PolarHBondContact O-ND2 3.27Å; P740-K766 PolarHBondContact O-NZ 3.26Å
741	L	90.3	Very high	88.5	Confident	4 Å²	4	37.8 Å²	37.8	2%	0.021	21%	0.214	C	C	.	.			trans	-76.6	137.8	176.1	-64.6	172.1	0	0	0	110.6	S719 I721 T736 P744 V757 D759 K766 Y768	S719-L741 WeakPolarHBondContact CB-O 3.27Å; S719-L741 PolarHBondContact OG-O 3.4Å; I721-L741 HydrophobicContact CD1-CD1 3.71Å; I721-L741 HydrophobicContact CG1-CD1 3.67Å; T736-L741 HydrophobicContact CG2-CD1 3.6Å; T736-L741 HydrophobicContact CG2-CG 4Å; L741-P744 HydrophobicContact CB-CB 4.43Å; L741-P744 HydrophobicContact CB-CG 4.34Å; L741-P744 HydrophobicContact CD1-CB 4.11Å; L741-P744 HydrophobicContact CD1-CG 4.36Å; L741-V757 HydrophobicContact CD1-CG1 4.31Å; L741-V757 HydrophobicContact CD2-CG1 3.73Å; L741-D759 WeakPolarHBondContact CA-OD2 3.39Å; L741-D759 HydrophobicContact CD2-CB 3.87Å; L741-K766 HydrophobicContact CD2-CD 3.88Å; L741-Y768 HydrophobicContact CD2-CE2 4.22Å
742	Y	90.1	Very high	88.3	Confident	159 Å²	159	38 Å²	38	62%	0.624	22%	0.216	S	C	*	.	S	Bend	trans	-121.6	94.4	173.5	-163.4	-115.1	0	0	0	109.9	D759 G761	Y742-D759 WeakPolarHBondContact CA-OD1 3.4Å; Y742-D759 PolarHBondContact N-OD1 3.06Å; Y742-G761 WeakPolarHBondContact O-CA 3.43Å; Y742-G761 PolarHBondContact O-N 3.31Å
743	G	88.1	Confident	88.3	Confident	10 Å²	10	36.3 Å²	36.3	10%	0.103	21%	0.207	C	C	.	.	S	Bend	trans	70.4	61.6	-176.7	0	0	0	0	0	113.5	W716 Q745	W716-G743 VanDerWaalsContact CD1-C 3.47Å; W716-G743 VanDerWaalsContact NE1-CA 3.31Å; G743-Q745 PolarHBondContact O-N 3.33Å
744	P	94.8	Very high	88.4	Confident	0 Å²	0	35 Å²	35	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	131	174.4	27.1	-34.7	0	0	0	110.8	T701 A714 L741 V757 A758	T701-P744 PolarHBondContact OG1-O 3.09Å; A714-P744 HydrophobicContact CB-CB 3.9Å; A714-P744 HydrophobicContact CB-CG 4.18Å; L741-P744 HydrophobicContact CB-CB 4.43Å; L741-P744 HydrophobicContact CB-CG 4.34Å; L741-P744 HydrophobicContact CD1-CB 4.11Å; L741-P744 HydrophobicContact CD1-CG 4.36Å; P744-V757 HydrophobicContact CB-CG2 3.79Å; P744-A758 WeakPolarHBondContact CA-O 3.38Å
745	Q	94.4	Very high	88.8	Confident	23 Å²	23	34.7 Å²	34.7	11%	0.107	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	-108.3	-177.7	-69.5	-68.6	-16.3	0	0	109.9	Q497 H654 T701 G702 G743 A758	Q497-Q745 HydrophobicContact CG-CG 4.44Å; Q497-Q745 VanDerWaalsContact O-CB 3.29Å; Q497-Q745 WeakPolarHBondContact O-CB 3.29Å; H654-Q745 PolarHBondContact CE1-OE1 3.11Å; T701-Q745 PolarHBondContact OG1-O 3.03Å; G702-Q745 WeakPolarHBondContact CA-O 3.48Å; G702-Q745 PolarHBondContact N-O 3.39Å; G743-Q745 PolarHBondContact O-N 3.33Å; Q745-A758 HydrophobicContact CB-CB 4.32Å; Q745-A758 PolarHBondContact N-O 3.41Å
746	G	93.9	Very high	89.4	Confident	1 Å²	1	34.1 Å²	34.1	1%	0.01	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	154.3	174.9	0	0	0	0	0	111.8	Q497 I499 A758	Q497-G746 WeakPolarHBondContact O-CA 3.44Å; Q497-G746 PolarHBondContact O-N 3.49Å; I499-G746 VanDerWaalsContact CG2-O 3.29Å; I499-G746 WeakPolarHBondContact CG2-O 3.18Å; G746-A758 PolarHBondContact O-N 2.6Å
747	L	95.9	Very high	89.9	Confident	8 Å²	8	33.1 Å²	33.1	4%	0.042	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	153.9	169.1	67.2	86.5	0	0	0	109.8	I499 A704 I712 A714 I721 A756 V757	I499-L747 VanDerWaalsContact CG2-CA 3.47Å; A704-L747 HydrophobicContact CB-CD1 3.28Å; A704-L747 VanDerWaalsContact N-CD1 3.32Å; I712-L747 HydrophobicContact CB-CD1 4.15Å; I712-L747 HydrophobicContact CG2-CD1 4.01Å; I712-L747 HydrophobicContact CG2-CD2 4.18Å; A714-L747 HydrophobicContact CB-CD2 3.67Å; I721-L747 HydrophobicContact CG2-CD2 4.36Å; L747-A756 CarbonylContact C-O 3.52Å; L747-A756 VanDerWaalsContact CA-O 3.23Å; L747-A756 WeakPolarHBondContact CA-O 3.41Å; L747-V757 HydrophobicContact CB-CB 4.34Å; L747-V757 HydrophobicContact CB-CG2 4.29Å
748	A	95.6	Very high	90.9	Very high	10 Å²	10	30.5 Å²	30.5	8%	0.083	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	155.5	179.1	0	0	0	0	0	111.1	I499 A501 A756	I499-A748 HydrophobicContact CG2-CB 4.28Å; A501-A748 HydrophobicContact CB-CB 4.41Å; A748-A756 PolarHBondContact N-O 3.06Å; A748-A756 PolarHBondContact O-N 3.22Å
749	L	94.1	Very high	91.8	Very high	39 Å²	39	28 Å²	28	20%	0.204	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	124.4	174.1	-74.3	166.8	0	0	0	110.4	A501 V705 D706 I712 H754 V755 Y770	A501-L749 VanDerWaalsContact CB-O 3.27Å; A501-L749 WeakPolarHBondContact CB-O 3.35Å; V705-L749 WeakPolarHBondContact O-CD1 3.34Å; D706-L749 HydrophobicContact CB-CD1 3.56Å; I712-L749 HydrophobicContact CD1-CD1 4Å; I712-L749 HydrophobicContact CD1-CD2 3.74Å; I712-L749 HydrophobicContact CD1-CG 4.07Å; L749-H754 CarbonylContact C-O 3.51Å; L749-H754 WeakPolarHBondContact CA-O 3.34Å; L749-V755 HydrophobicContact CD2-CG2 3.47Å; L749-V755 VanDerWaalsContact CD2-CG2 3.47Å; L749-Y770 HydrophobicContact CD2-CD1 3.69Å; L749-Y770 HydrophobicContact CD2-CE1 4.12Å
750	T	92.4	Very high	92.3	Very high	8 Å²	8	27.3 Å²	27.3	5%	0.049	15%	0.151	C	C	.	.			trans	-69.8	161.8	174.6	69.8	0	0	0	0	110.9	A501 I507 D752 G753 H754 A756	A501-T750 HydrophobicContact CB-CG2 4.39Å; I507-T750 HydrophobicContact CD1-CG2 3.98Å; I507-T750 HydrophobicContact CG1-CG2 4.3Å; T750-D752 PolarHBondContact O-N 3.3Å; T750-D752 VanDerWaalsContact O-N 3.1Å; T750-D752 PolarHBondContact OG1-N 3.46Å; T750-G753 PolarHBondContact O-N 3.46Å; T750-H754 HydrophobicContact CG2-CB 4.44Å; T750-H754 PolarHBondContact N-O 3.2Å; T750-H754 WeakPolarHBondContact OG1-CB 3.43Å; T750-H754 PolarHBondContact OG1-N 3.35Å; T750-H754 VanDerWaalsContact OG1-N 3.09Å; T750-H754 PolarHBondContact OG1-O 2.66Å; T750-A756 HydrophobicContact CG2-CB 4.2Å
751	S	87.9	Confident	92.5	Very high	59 Å²	59	25.1 Å²	25.1	41%	0.413	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-20.3	175.7	58	0	0	0	0	113.4	N522 G753	N522-S751 PolarHBondContact ND2-OG 3.08Å; S751-G753 VanDerWaalsContact C-N 3.31Å
752	D	85.6	Confident	92.5	Very high	93 Å²	93	27.2 Å²	27.2	50%	0.497	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	5.1	-179.4	-46.1	-28.2	0	0	0	111.9	N522 T750	N522-D752 WeakPolarHBondContact CB-OD2 3.27Å; N522-D752 VanDerWaalsContact ND2-CG 3.26Å; N522-D752 PolarHBondContact ND2-OD1 3.45Å; N522-D752 PolarHBondContact ND2-OD2 2.9Å; T750-D752 PolarHBondContact O-N 3.3Å; T750-D752 VanDerWaalsContact O-N 3.1Å; T750-D752 PolarHBondContact OG1-N 3.46Å
753	G	87.5	Confident	92.7	Very high	18 Å²	18	21.4 Å²	21.4	19%	0.186	13%	0.132	C	C	.	.	S	Bend	trans	85.7	8.9	177.3	0	0	0	0	0	115	T750 S751 Y770	T750-G753 PolarHBondContact O-N 3.46Å; S751-G753 VanDerWaalsContact C-N 3.31Å; G753-Y770 WeakPolarHBondContact O-CB 3.29Å
754	H	92.3	Very high	93	Very high	48 Å²	48	20.9 Å²	20.9	22%	0.222	13%	0.127	C	C	.	.			trans	-89.7	155.3	179.4	-56.5	137.7	0	0	0	112.3	I480 L749 T750 V767 Y768	I480-H754 HydrophobicContact CD1-CB 4.02Å; I480-H754 VanDerWaalsContact CD1-CD2 3.41Å; I480-H754 WeakPolarHBondContact CD1-CD2 3.39Å; I480-H754 VanDerWaalsContact CD1-CE1 3.45Å; I480-H754 WeakPolarHBondContact CD1-CE1 3.45Å; I480-H754 WeakPolarHBondContact CD1-ND1 3.3Å; I480-H754 WeakPolarHBondContact CD1-NE2 3.31Å; L749-H754 CarbonylContact C-O 3.51Å; L749-H754 WeakPolarHBondContact CA-O 3.34Å; T750-H754 HydrophobicContact CG2-CB 4.44Å; T750-H754 PolarHBondContact N-O 3.2Å; T750-H754 WeakPolarHBondContact OG1-CB 3.43Å; T750-H754 PolarHBondContact OG1-N 3.35Å; T750-H754 VanDerWaalsContact OG1-N 3.09Å; T750-H754 PolarHBondContact OG1-O 2.66Å; H754-V767 HydrophobicContact CB-CG1 3.67Å; H754-Y768 WeakPolarHBondContact CA-O 3.25Å; H754-Y768 WeakPolarHBondContact CB-O 3.28Å
755	V	94.4	Very high	93.1	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	113.9	177.3	174	0	0	0	0	110	I712 I721 I734 L749 V767 Y768 Y770	I712-V755 HydrophobicContact CD1-CG2 3.8Å; I721-V755 HydrophobicContact CD1-CG1 4.46Å; I734-V755 HydrophobicContact CD1-CB 3.88Å; I734-V755 HydrophobicContact CD1-CG1 3.9Å; I734-V755 HydrophobicContact CD1-CG2 3.71Å; L749-V755 HydrophobicContact CD2-CG2 3.47Å; L749-V755 VanDerWaalsContact CD2-CG2 3.47Å; V755-V767 CarbonylContact O-C 3.55Å; V755-V767 WeakPolarHBondContact O-CA 3.31Å; V755-Y768 PolarHBondContact N-O 3.13Å; V755-Y768 PolarHBondContact O-N 3.35Å; V755-Y770 HydrophobicContact CG2-CD1 4.15Å; V755-Y770 HydrophobicContact CG2-CD2 4.4Å; V755-Y770 HydrophobicContact CG2-CG 3.83Å
756	A	95.6	Very high	93.1	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	124.1	170.8	0	0	0	0	0	110	I499 I507 L747 A748 T750 K766 V767	I499-A756 HydrophobicContact CD1-CB 3.73Å; I499-A756 HydrophobicContact CG1-CB 4.47Å; I507-A756 HydrophobicContact CD1-CB 4.43Å; L747-A756 CarbonylContact C-O 3.52Å; L747-A756 VanDerWaalsContact CA-O 3.23Å; L747-A756 WeakPolarHBondContact CA-O 3.41Å; A748-A756 PolarHBondContact N-O 3.06Å; A748-A756 PolarHBondContact O-N 3.22Å; T750-A756 HydrophobicContact CG2-CB 4.2Å; A756-K766 CarbonylContact C-O 3.51Å; A756-K766 WeakPolarHBondContact CA-O 3.16Å; A756-V767 HydrophobicContact CB-CG2 3.92Å
757	V	96.2	Very high	93.1	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	137.2	-179.6	64.3	0	0	0	0	111.3	I721 L741 P744 L747 D759 F765 K766 Y768	I721-V757 HydrophobicContact CD1-CB 4Å; I721-V757 HydrophobicContact CD1-CG1 4.03Å; I721-V757 HydrophobicContact CD1-CG2 4.1Å; L741-V757 HydrophobicContact CD1-CG1 4.31Å; L741-V757 HydrophobicContact CD2-CG1 3.73Å; P744-V757 HydrophobicContact CB-CG2 3.79Å; L747-V757 HydrophobicContact CB-CB 4.34Å; L747-V757 HydrophobicContact CB-CG2 4.29Å; V757-D759 PolarHBondContact O-N 3.3Å; V757-F765 CarbonylContact O-C 3.53Å; V757-F765 WeakPolarHBondContact O-CA 3.43Å; V757-F765 VanDerWaalsContact O-CB 3.32Å; V757-F765 WeakPolarHBondContact O-CB 3.36Å; V757-K766 HydrophobicContact CG1-CB 4.12Å; V757-K766 PolarHBondContact N-O 3.49Å; V757-K766 PolarHBondContact O-N 3.22Å; V757-Y768 HydrophobicContact CG1-CD2 3.96Å; V757-Y768 HydrophobicContact CG1-CE2 3.51Å
758	A	96.4	Very high	93	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	107.4	172.7	0	0	0	0	0	110.2	L496 Q497 I499 P744 Q745 G746 S760	L496-A758 HydrophobicContact CD1-CB 3.57Å; L496-A758 HydrophobicContact CG-CB 3.96Å; Q497-A758 VanDerWaalsContact O-CB 3.25Å; Q497-A758 WeakPolarHBondContact O-CB 3.41Å; I499-A758 HydrophobicContact CB-CB 4.38Å; I499-A758 HydrophobicContact CG2-CB 4.35Å; P744-A758 WeakPolarHBondContact CA-O 3.38Å; Q745-A758 HydrophobicContact CB-CB 4.32Å; Q745-A758 PolarHBondContact N-O 3.41Å; G746-A758 PolarHBondContact O-N 2.6Å; A758-S760 PolarHBondContact O-N 3.27Å
759	D	95.2	Very high	92.6	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	82.6	178.3	-171.6	-2.5	0	0	0	109.8	L741 Y742 V757 G761 N762 H763 C764 K766	L741-D759 WeakPolarHBondContact CA-OD2 3.39Å; L741-D759 HydrophobicContact CD2-CB 3.87Å; Y742-D759 WeakPolarHBondContact CA-OD1 3.4Å; Y742-D759 PolarHBondContact N-OD1 3.06Å; V757-D759 PolarHBondContact O-N 3.3Å; D759-G761 VanDerWaalsContact C-N 3.31Å; D759-G761 PolarHBondContact O-N 3.22Å; D759-N762 PolarHBondContact O-N 3.38Å; D759-N762 WeakPolarHBondContact OD2-CB 3.33Å; D759-N762 PolarHBondContact OD2-ND2 3.43Å; D759-H763 PolarHBondContact O-N 3.32Å; D759-H763 VanDerWaalsContact O-N 3.09Å; D759-C764 CarbonylContact C-O 3.56Å; D759-C764 WeakPolarHBondContact CA-O 3.37Å; D759-C764 WeakPolarHBondContact CB-O 3.2Å; D759-C764 PolarHBondContact N-O 3.41Å; D759-C764 PolarHBondContact O-N 3.43Å; D759-C764 VanDerWaalsContact O-O 3.05Å; D759-K766 WeakPolarHBondContact OD2-CE 3.37Å; D759-K766 IonicContact OD2-NZ 2.73Å; D759-K766 PolarHBondContact OD2-NZ 3.31Å
760	S	91.3	Very high	92.2	Very high	19 Å²	19	24.4 Å²	24.4	13%	0.133	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-40.8	-171.7	170.4	0	0	0	0	112.7	N495 L496 A758 H763	N495-S760 PolarHBondContact OD1-OG 2.82Å; L496-S760 WeakPolarHBondContact O-CB 3.36Å; A758-S760 PolarHBondContact O-N 3.27Å; S760-H763 PolarHBondContact O-N 3.32Å
761	G	89.6	Confident	90.8	Very high	29 Å²	29	30 Å²	30	30%	0.299	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-26.3	-176.6	0	0	0	0	0	113.8	Y742 D759	Y742-G761 WeakPolarHBondContact O-CA 3.43Å; Y742-G761 PolarHBondContact O-N 3.31Å; D759-G761 VanDerWaalsContact C-N 3.31Å; D759-G761 PolarHBondContact O-N 3.22Å
762	N	91.9	Very high	89.2	Confident	48 Å²	48	34.4 Å²	34.4	26%	0.257	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.5	5.1	171.4	-70.7	-41.1	0	0	0	113.6	R482 P740 D759 C764	R482-N762 PolarHBondContact NH2-O 3.41Å; P740-N762 PolarHBondContact O-ND2 3.27Å; D759-N762 PolarHBondContact O-N 3.38Å; D759-N762 WeakPolarHBondContact OD2-CB 3.33Å; D759-N762 PolarHBondContact OD2-ND2 3.43Å; N762-C764 VanDerWaalsContact C-N 3.27Å; N762-C764 PolarHBondContact O-N 3.14Å
763	H	94	Very high	89.3	Confident	36 Å²	36	31.5 Å²	31.5	17%	0.167	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.8	38.2	177.8	-54	-66.9	0	0	0	113.9	G484 T485 R486 T494 D759 S760	G484-H763 CarbonylContact C-O 3.56Å; T485-H763 CarbonylContact C-O 3.57Å; R486-H763 HydrophobicContact CB-CB 4.04Å; T494-H763 PolarHBondContact O-CE1 3.17Å; T494-H763 VanDerWaalsContact O-CE1 3.26Å; T494-H763 PolarHBondContact O-ND1 2.8Å; D759-H763 PolarHBondContact O-N 3.32Å; D759-H763 VanDerWaalsContact O-N 3.09Å; S760-H763 PolarHBondContact O-N 3.32Å
764	C	95	Very high	89.4	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	162.1	-177.3	62.9	0	0	0	0	110.8	R482 V483 G484 L496 D759 N762	R482-C764 HydrophobicContact CG-CB 3.91Å; R482-C764 VanDerWaalsContact NE-CB 3.34Å; R482-C764 PolarHBondContact NE-SG 3.05Å; V483-C764 WeakPolarHBondContact O-CA 3.34Å; V483-C764 VanDerWaalsContact O-CB 3.29Å; V483-C764 WeakPolarHBondContact O-CB 3.39Å; G484-C764 WeakPolarHBondContact O-CB 3.45Å; L496-C764 WeakPolarHBondContact CD1-O 3.32Å; D759-C764 CarbonylContact C-O 3.56Å; D759-C764 WeakPolarHBondContact CA-O 3.37Å; D759-C764 WeakPolarHBondContact CB-O 3.2Å; D759-C764 PolarHBondContact N-O 3.41Å; D759-C764 PolarHBondContact O-N 3.43Å; D759-C764 VanDerWaalsContact O-O 3.05Å; N762-C764 VanDerWaalsContact C-N 3.27Å; N762-C764 PolarHBondContact O-N 3.14Å
765	F	96	Very high	89.3	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	148.5	159.7	74.4	-90.4	0	0	0	109.9	Y481 V483 F493 L496 I499 I507 V509 F520 V757 V767	Y481-F765 AromaticContact CE2-CE2 3.98Å; Y481-F765 HydrophobicContact CE2-CE2 3.98Å; V483-F765 HydrophobicContact CB-CD1 4.06Å; V483-F765 HydrophobicContact CB-CE1 3.46Å; V483-F765 VanDerWaalsContact CB-CE1 3.46Å; V483-F765 HydrophobicContact CB-CE2 4.2Å; V483-F765 HydrophobicContact CB-CZ 3.54Å; V483-F765 HydrophobicContact CG1-CD1 4.46Å; V483-F765 HydrophobicContact CG1-CE1 3.66Å; V483-F765 HydrophobicContact CG1-CZ 4.02Å; V483-F765 HydrophobicContact CG2-CE1 4.2Å; V483-F765 HydrophobicContact CG2-CE2 4.26Å; V483-F765 HydrophobicContact CG2-CZ 3.75Å; V483-F765 PolarHBondContact N-O 3.42Å; V483-F765 PolarHBondContact O-N 3.42Å; F493-F765 AromaticContact CE2-CD1 3.9Å; F493-F765 HydrophobicContact CE2-CD1 3.9Å; F493-F765 HydrophobicContact CE2-CE1 4.29Å; F493-F765 AromaticContact CZ-CD1 3.83Å; F493-F765 HydrophobicContact CZ-CD1 3.83Å; F493-F765 HydrophobicContact CZ-CE1 4.07Å; L496-F765 HydrophobicContact CD1-CB 3.82Å; I499-F765 HydrophobicContact CD1-CB 3.88Å; I499-F765 HydrophobicContact CD1-CD2 4.05Å; I499-F765 HydrophobicContact CD1-CG 4.06Å; I507-F765 HydrophobicContact CD1-CE2 4.13Å; I507-F765 HydrophobicContact CG2-CE2 4.28Å; V509-F765 HydrophobicContact CG2-CD1 3.95Å; V509-F765 HydrophobicContact CG2-CE1 4.21Å; V509-F765 HydrophobicContact CG2-CG 4.42Å; F520-F765 HydrophobicContact CB-CZ 4.16Å; F520-F765 HydrophobicContact CD1-CE1 4.18Å; F520-F765 HydrophobicContact CD1-CZ 4.29Å; F520-F765 AromaticContact CD2-CE1 3.7Å; F520-F765 HydrophobicContact CD2-CE1 3.7Å; F520-F765 HydrophobicContact CD2-CZ 4.06Å; F520-F765 HydrophobicContact CE1-CE1 4.28Å; F520-F765 AromaticContact CE2-CE1 3.82Å; F520-F765 HydrophobicContact CE2-CE1 3.82Å; F520-F765 AromaticContact CG-CE1 3.91Å; F520-F765 HydrophobicContact CG-CE1 3.91Å; F520-F765 AromaticContact CG-CZ 3.91Å; F520-F765 HydrophobicContact CG-CZ 3.91Å; F520-F765 HydrophobicContact CZ-CE1 4.12Å; V757-F765 CarbonylContact O-C 3.53Å; V757-F765 WeakPolarHBondContact O-CA 3.43Å; V757-F765 VanDerWaalsContact O-CB 3.32Å; V757-F765 WeakPolarHBondContact O-CB 3.36Å; F765-V767 HydrophobicContact CD2-CG2 4.06Å; F765-V767 HydrophobicContact CE2-CG2 3.98Å
766	K	95	Very high	89	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	142.9	-178.3	-64.4	179.4	-173.4	171.3	0	108.8	L479 R482 D739 P740 L741 A756 V757 D759 Y768	L479-K766 HydrophobicContact CD1-CB 3.85Å; L479-K766 HydrophobicContact CD1-CD 4.39Å; L479-K766 HydrophobicContact CD1-CG 4.29Å; R482-K766 HydrophobicContact CB-CG 4.32Å; R482-K766 HydrophobicContact CG-CG 4.17Å; D739-K766 HydrophobicContact CB-CD 4.31Å; D739-K766 PolarHBondContact O-NZ 3.27Å; D739-K766 WeakPolarHBondContact OD1-CE 3.29Å; D739-K766 IonicContact OD1-NZ 3.59Å; D739-K766 PolarHBondContact OD1-NZ 2.82Å; D739-K766 WeakPolarHBondContact OD2-CE 3.24Å; D739-K766 IonicContact OD2-NZ 3.6Å; D739-K766 PolarHBondContact OD2-NZ 3.29Å; P740-K766 PolarHBondContact O-NZ 3.26Å; L741-K766 HydrophobicContact CD2-CD 3.88Å; A756-K766 CarbonylContact C-O 3.51Å; A756-K766 WeakPolarHBondContact CA-O 3.16Å; V757-K766 HydrophobicContact CG1-CB 4.12Å; V757-K766 PolarHBondContact N-O 3.49Å; V757-K766 PolarHBondContact O-N 3.22Å; D759-K766 WeakPolarHBondContact OD2-CE 3.37Å; D759-K766 IonicContact OD2-NZ 2.73Å; D759-K766 PolarHBondContact OD2-NZ 3.31Å; K766-Y768 HydrophobicContact CB-CD2 4.39Å; K766-Y768 HydrophobicContact CB-CE2 3.59Å; K766-Y768 HydrophobicContact CD-CE2 4.42Å; K766-Y768 WeakPolarHBondContact CD-OH 2.9Å
767	V	93.9	Very high	88.6	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	123.2	177.7	-177	0	0	0	0	108.9	I480 Y481 I507 H754 V755 A756 F765	I480-V767 WeakPolarHBondContact CB-O 3.3Å; I480-V767 HydrophobicContact CD1-CG1 4.24Å; I480-V767 PolarHBondContact N-O 3.39Å; Y481-V767 HydrophobicContact CD1-CB 4.35Å; Y481-V767 HydrophobicContact CD2-CG2 4.38Å; Y481-V767 HydrophobicContact CE1-CB 3.93Å; Y481-V767 HydrophobicContact CE1-CG1 4.22Å; Y481-V767 HydrophobicContact CE1-CG2 4.06Å; Y481-V767 HydrophobicContact CE2-CB 4.18Å; Y481-V767 HydrophobicContact CE2-CG2 3.64Å; Y481-V767 VanDerWaalsContact CZ-CG2 3.44Å; Y481-V767 PolarHBondContact O-N 3.34Å; Y481-V767 WeakPolarHBondContact OH-CG2 3.21Å; I507-V767 HydrophobicContact CD1-CG2 4.32Å; H754-V767 HydrophobicContact CB-CG1 3.67Å; V755-V767 CarbonylContact O-C 3.55Å; V755-V767 WeakPolarHBondContact O-CA 3.31Å; A756-V767 HydrophobicContact CB-CG2 3.92Å; F765-V767 HydrophobicContact CD2-CG2 4.06Å; F765-V767 HydrophobicContact CE2-CG2 3.98Å
768	Y	92.4	Very high	88.1	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	143.3	-178.8	-62.1	-87.8	0	0	0	110.6	E478 L479 I721 I734 T736 D739 L741 H754 V755 V757 K766 Y770	E478-Y768 HydrophobicContact CB-CD1 4.47Å; E478-Y768 CarbonylContact O-C 3.54Å; E478-Y768 WeakPolarHBondContact O-CA 3.28Å; L479-Y768 HydrophobicContact CB-CD1 4.12Å; L479-Y768 HydrophobicContact CB-CE1 3.96Å; L479-Y768 HydrophobicContact CD1-CD1 4.08Å; L479-Y768 HydrophobicContact CD1-CE1 3.67Å; L479-Y768 HydrophobicContact CD1-CE2 4.38Å; L479-Y768 HydrophobicContact CG-CE1 4.4Å; I721-Y768 HydrophobicContact CD1-CD2 4.5Å; I734-Y768 HydrophobicContact CG2-CD1 4.2Å; I734-Y768 HydrophobicContact CG2-CG 3.87Å; T736-Y768 HydrophobicContact CG2-CE1 3.98Å; T736-Y768 HydrophobicContact CG2-CE2 4.29Å; D739-Y768 PolarHBondContact O-OH 2.67Å; L741-Y768 HydrophobicContact CD2-CE2 4.22Å; H754-Y768 WeakPolarHBondContact CA-O 3.25Å; H754-Y768 WeakPolarHBondContact CB-O 3.28Å; V755-Y768 PolarHBondContact N-O 3.13Å; V755-Y768 PolarHBondContact O-N 3.35Å; V757-Y768 HydrophobicContact CG1-CD2 3.96Å; V757-Y768 HydrophobicContact CG1-CE2 3.51Å; K766-Y768 HydrophobicContact CB-CD2 4.39Å; K766-Y768 HydrophobicContact CB-CE2 3.59Å; K766-Y768 HydrophobicContact CD-CE2 4.42Å; K766-Y768 WeakPolarHBondContact CD-OH 2.9Å; Y768-Y770 PolarHBondContact O-N 3.41Å
769	R	88.4	Confident	87.5	Confident	132 Å²	132	40.3 Å²	40.3	50%	0.498	20%	0.201	S	C	.	.			trans	-63.9	128.8	168.9	-170.9	175.6	-65.9	-173.2	1.7	108	E478 I480 L771	E478-R769 HydrophobicContact CB-CB 4.34Å; E478-R769 PolarHBondContact O-N 2.64Å; I480-R769 HydrophobicContact CD1-CB 4.25Å; I480-R769 HydrophobicContact CG1-CB 4.23Å; R769-L771 HydrophobicContact CG-CD2 4.3Å; R769-L771 HydrophobicContact CG-CG 4.34Å
770	Y	84.8	Confident	86.9	Confident	23 Å²	23	43.4 Å²	43.4	9%	0.09	22%	0.216	C	C	.	.			trans	-124.4	105	175.8	174.3	-120.6	0	0	0	106.7	D706 I712 V723 I734 L749 G753 V755 Y768 Q772	D706-Y770 HydrophobicContact CB-CE1 4.03Å; D706-Y770 PolarHBondContact OD2-OH 3.33Å; I712-Y770 HydrophobicContact CD1-CD1 4.15Å; I712-Y770 HydrophobicContact CD1-CE1 3.71Å; I712-Y770 HydrophobicContact CD1-CE2 4.22Å; V723-Y770 HydrophobicContact CG1-CE2 4.07Å; V723-Y770 HydrophobicContact CG2-CE2 4Å; I734-Y770 HydrophobicContact CD1-CD2 4.5Å; L749-Y770 HydrophobicContact CD2-CD1 3.69Å; L749-Y770 HydrophobicContact CD2-CE1 4.12Å; G753-Y770 WeakPolarHBondContact O-CB 3.29Å; V755-Y770 HydrophobicContact CG2-CD1 4.15Å; V755-Y770 HydrophobicContact CG2-CD2 4.4Å; V755-Y770 HydrophobicContact CG2-CG 3.83Å; Y768-Y770 PolarHBondContact O-N 3.41Å; Y770-Q772 HydrophobicContact CD1-CG 4.36Å; Y770-Q772 HydrophobicContact CE1-CG 4.06Å
771	L	63.8	Low	86.5	Confident	126 Å²	126	45.4 Å²	45.4	66%	0.66	22%	0.223	S	C	*	.			trans	-81.8	116.2	176.5	-64.4	170.8	0	0	0	107.1	R769	R769-L771 HydrophobicContact CG-CD2 4.3Å; R769-L771 HydrophobicContact CG-CG 4.34Å
772	Q	53.2	Low	86.2	Confident	151 Å²	151	46.9 Å²	46.9	71%	0.706	22%	0.216	S	C	*	.			trans	-73	0	176.7	-78.2	179.7	2.1	0	0	112.4	Y770	Y770-Q772 HydrophobicContact CD1-CG 4.36Å; Y770-Q772 HydrophobicContact CE1-CG 4.06Å

Retrieved 772 of 772 residues in 147.3 ms (Link to these results)

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