A0A077YUM5_TRITR Loading...

Tubby-like protein

AlphaFold DB , UniProt , Accession A0A077YUM5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 455 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	41.2	Very low	36.3	Very low	251 Å²	251	172.8 Å²	172.8	100%	1.236	83%	0.833	S	S	*	*				0	143.9	0	-62.2	167.3	-171.8	0	0	107
2	A	38.5	Very low	35.8	Very low	106 Å²	106	168 Å²	168	88%	0.876	83%	0.831	S	S	*	*			trans	-136.8	130.4	-172.1	0	0	0	0	0	111
3	E	41.6	Very low	35.4	Very low	160 Å²	160	160.7 Å²	160.7	75%	0.748	80%	0.801	S	S	*	*			trans	-120.9	123.3	170.4	-166.5	-179.3	148.5	0	0	108.6	Q5	E3-Q5 HydrophobicContact CG-CG 4.48Å; E3-Q5 PolarHBondContact OE1-NE2 2.78Å
4	R	37.7	Very low	35	Very low	239 Å²	239	153.3 Å²	153.3	90%	0.902	79%	0.786	S	S	*	*			trans	-120.4	99.7	173.8	-83.8	-175.9	169	-177.6	-2.9	108.3	L6	R4-L6 PolarHBondContact O-N 3.45Å
5	Q	40.8	Very low	35	Very low	161 Å²	161	143.9 Å²	143.9	75%	0.752	74%	0.738	S	S	*	*			trans	-76.5	119.4	168.9	-62.8	-171	6.9	0	0	109.1	E3	E3-Q5 HydrophobicContact CG-CG 4.48Å; E3-Q5 PolarHBondContact OE1-NE2 2.78Å
6	L	36.8	Very low	34.9	Very low	146 Å²	146	138.5 Å²	138.5	76%	0.764	71%	0.714	S	S	*	*			trans	-100.6	96.5	-168.7	-167.2	87.1	0	0	0	111.5	R4 R8	R4-L6 PolarHBondContact O-N 3.45Å; L6-R8 PolarHBondContact O-N 3.16Å; L6-R8 VanDerWaalsContact O-N 3.16Å
7	I	33.5	Very low	35.2	Very low	150 Å²	150	132.1 Å²	132.1	77%	0.769	68%	0.682	S	S	*	*			trans	-71.2	108.4	175.6	-59.7	176.3	0	0	0	109.8	R9	I7-R9 PolarHBondContact O-N 3.31Å
8	R	34.5	Very low	35.1	Very low	232 Å²	232	135.2 Å²	135.2	88%	0.875	68%	0.684	S	S	*	*			trans	-79.4	101.4	170.4	-79.7	-176	168.8	-176.9	-2.9	110.6	L6	L6-R8 PolarHBondContact O-N 3.16Å; L6-R8 VanDerWaalsContact O-N 3.16Å
9	R	30.7	Very low	35.2	Very low	177 Å²	177	129.8 Å²	129.8	67%	0.668	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-79.9	137.7	160.8	-75.3	176.9	169.1	162.4	-14.5	110	I7 E172	I7-R9 PolarHBondContact O-N 3.31Å; R9-E172 VanDerWaalsContact CZ-CD 3.45Å; R9-E172 IonicContact CZ-OE1 3.17Å; R9-E172 IonicContact CZ-OE2 3.14Å; R9-E172 IonicContact NE-OE1 3.92Å; R9-E172 VanDerWaalsContact NH1-CD 3.26Å; R9-E172 IonicContact NH1-OE1 3.46Å; R9-E172 PolarHBondContact NH1-OE1 2.67Å; R9-E172 IonicContact NH1-OE2 2.67Å; R9-E172 PolarHBondContact NH1-OE2 3.46Å; R9-E172 IonicContact NH2-OE1 2.72Å; R9-E172 PolarHBondContact NH2-OE1 2.89Å; R9-E172 IonicContact NH2-OE2 2.89Å; R9-E172 PolarHBondContact NH2-OE2 2.72Å
10	G	32.3	Very low	34.9	Very low	80 Å²	80	129.4 Å²	129.4	83%	0.825	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-75	142.5	-179.9	0	0	0	0	0	112.5
11	R	32.2	Very low	35.1	Very low	199 Å²	199	127.6 Å²	127.6	75%	0.751	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-85.9	131.5	165.3	-84.4	-178.4	164.7	159.3	-2	109.4
12	S	30.1	Very low	34.9	Very low	115 Å²	115	120.8 Å²	120.8	80%	0.804	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-75.5	132.6	158.4	-173.9	0	0	0	0	108.7
13	T	30.3	Very low	34.7	Very low	73 Å²	73	122.9 Å²	122.9	45%	0.448	61%	0.613	S	S	.	*			trans	-111.1	90	174.4	51.4	0	0	0	0	109.3
14	G	29.4	Very low	34.6	Very low	57 Å²	57	122.7 Å²	122.7	59%	0.588	62%	0.617	S	S	*	*			trans	-59	138.1	161.1	0	0	0	0	0	109.2
15	M	35.7	Very low	34.3	Very low	13 Å²	13	120.3 Å²	120.3	6%	0.064	62%	0.616	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-124.5	126.2	-168.7	-96.9	177.7	38.9	0	0	112.5	V17 I389 F392 V396 T397 Q398 N403	M15-V17 PolarHBondContact O-N 3.12Å; M15-I389 WeakPolarHBondContact O-CG2 3.43Å; M15-F392 HydrophobicContact CE-CD2 4.47Å; M15-V396 HydrophobicContact CE-CB 4.11Å; M15-V396 HydrophobicContact CE-CG1 3.36Å; M15-V396 VanDerWaalsContact SD-C 3.59Å; M15-V396 HydrophobicContact SD-CB 4.28Å; M15-V396 HydrophobicContact SD-CG1 3.93Å; M15-T397 WeakPolarHBondContact SD-CA 3.19Å; M15-Q398 VanDerWaalsContact CE-C 3.41Å; M15-Q398 WeakPolarHBondContact CE-O 3.49Å; M15-Q398 PolarHBondContact SD-N 3.4Å; M15-Q398 VanDerWaalsContact SD-N 3.36Å; M15-N403 WeakPolarHBondContact CE-ND2 3.39Å
16	V	33.2	Very low	34.1	Very low	57 Å²	57	118.1 Å²	118.1	35%	0.345	62%	0.619	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-65.1	121.1	178.6	-176.9	0	0	0	0	111	R18	V16-R18 HydrophobicContact CG1-CB 3.96Å; V16-R18 HydrophobicContact CG1-CG 4.44Å
17	V	40.5	Very low	33.8	Very low	30 Å²	30	117.3 Å²	117.3	18%	0.182	62%	0.62	C	S	.	*			trans	-104.7	99.8	154.6	176.7	0	0	0	0	105.5	M15 T19 Y388	M15-V17 PolarHBondContact O-N 3.12Å; V17-T19 PolarHBondContact O-N 3.14Å; V17-Y388 PolarHBondContact N-O 2.82Å; V17-Y388 WeakPolarHBondContact O-CB 3.49Å; V17-Y388 VanDerWaalsContact O-O 3.13Å
18	R	32.6	Very low	33.9	Very low	188 Å²	188	119.3 Å²	119.3	71%	0.709	63%	0.626	S	S	*	*			trans	-75.3	116.6	-171.1	-156.4	-179.9	-170.1	114.6	9.8	110.6	V16 D20	V16-R18 HydrophobicContact CG1-CB 3.96Å; V16-R18 HydrophobicContact CG1-CG 4.44Å; R18-D20 IonicContact CZ-OD1 2.74Å; R18-D20 IonicContact NE-OD1 3.97Å; R18-D20 PolarHBondContact NE-OD1 3.35Å; R18-D20 IonicContact NE-OD2 2.66Å; R18-D20 IonicContact NH2-OD1 3.7Å; R18-D20 PolarHBondContact NH2-OD1 2.78Å
19	T	37.1	Very low	33.7	Very low	32 Å²	32	116 Å²	116	20%	0.196	62%	0.624	C	S	.	*			trans	-129.9	97.5	167.6	53.1	0	0	0	0	106.8	V17 V21 P329 Y388	V17-T19 PolarHBondContact O-N 3.14Å; T19-V21 PolarHBondContact O-N 3.21Å; T19-P329 HydrophobicContact CG2-CB 4Å; T19-P329 HydrophobicContact CG2-CG 3.85Å; T19-Y388 WeakPolarHBondContact O-CD2 3.33Å; T19-Y388 WeakPolarHBondContact O-CE2 3.42Å; T19-Y388 WeakPolarHBondContact OG1-CD2 3.4Å
20	D	29.5	Very low	33.9	Very low	121 Å²	121	115.8 Å²	115.8	65%	0.647	64%	0.635	S	S	*	*			trans	-73.2	112.9	-173.1	-59.3	-75.3	0	0	0	110.5	R18	R18-D20 IonicContact CZ-OD1 2.74Å; R18-D20 IonicContact NE-OD1 3.97Å; R18-D20 PolarHBondContact NE-OD1 3.35Å; R18-D20 IonicContact NE-OD2 2.66Å; R18-D20 IonicContact NH2-OD1 3.7Å; R18-D20 PolarHBondContact NH2-OD1 2.78Å
21	V	39.7	Very low	33.7	Very low	93 Å²	93	116.8 Å²	116.8	56%	0.564	63%	0.629	S	S	*	*			trans	-131.9	128.1	173.7	-178.1	0	0	0	0	107.3	T19	T19-V21 PolarHBondContact O-N 3.21Å
22	P	36.9	Very low	33.8	Very low	108 Å²	108	113.5 Å²	113.5	70%	0.701	63%	0.631	S	S	*	*			trans	-63.5	141.8	176.2	-21.3	33.4	0	0	0	112
23	R	34.3	Very low	34	Very low	149 Å²	149	113 Å²	113	56%	0.562	63%	0.628	S	S	*	*			trans	-72.9	140.6	160.9	-81.7	-177.6	163.2	-163.7	-15	109.2	E383	R23-E383 IonicContact CZ-OE1 3.85Å; R23-E383 IonicContact NH1-OE1 3.5Å; R23-E383 PolarHBondContact NH1-OE1 3.3Å; R23-E383 IonicContact NH2-OE1 3.59Å; R23-E383 PolarHBondContact NH2-OE1 2.95Å
24	D	38.7	Very low	34	Very low	157 Å²	157	117.2 Å²	117.2	84%	0.84	65%	0.646	S	S	*	*			trans	-114.6	139.9	164.1	-159.9	0	0	0	0	108.3
25	E	31.4	Very low	34.2	Very low	188 Å²	188	125.5 Å²	125.5	88%	0.879	66%	0.659	S	S	*	*			trans	-99	106.9	-171.6	-71.7	-165.9	139.6	0	0	111.4
26	S	36.2	Very low	33.9	Very low	116 Å²	116	131.1 Å²	131.1	81%	0.811	70%	0.695	S	S	*	*			trans	-137.2	107.6	162	50.1	0	0	0	0	111.2
27	T	30.3	Very low	33.8	Very low	128 Å²	128	136.1 Å²	136.1	79%	0.785	72%	0.719	S	S	*	*			trans	-71.8	140.2	174.6	53.4	0	0	0	0	111
28	H	36.7	Very low	33.2	Very low	193 Å²	193	143.3 Å²	143.3	89%	0.894	75%	0.75	S	S	*	*			trans	-154.4	148.6	133.4	-102.3	-66	0	0	0	111.7
29	L	30.4	Very low	33.4	Very low	162 Å²	162	140.1 Å²	140.1	85%	0.848	75%	0.754	S	S	*	*			trans	-87	147.8	-175.5	-63.9	157.1	0	0	0	111.3
30	I	34.7	Very low	33.2	Very low	172 Å²	172	144.9 Å²	144.9	88%	0.882	78%	0.783	S	S	*	*			trans	-164.6	140.9	134.2	-98.8	147.6	0	0	0	108.1
31	S	29	Very low	33.4	Very low	102 Å²	102	150.1 Å²	150.1	71%	0.713	80%	0.795	S	S	*	*			trans	-111.4	148.7	175.9	60.3	0	0	0	0	110.8
32	T	32.6	Very low	33	Very low	129 Å²	129	150 Å²	150	79%	0.791	79%	0.792	S	S	*	*			trans	-176.5	150.2	130.3	18.7	0	0	0	0	114.2
33	S	34.6	Very low	33	Very low	106 Å²	106	149.4 Å²	149.4	74%	0.741	79%	0.789	S	S	*	*			trans	56.8	90.6	145.3	-57	0	0	0	0	119.9
34	I	31.1	Very low	32.9	Very low	161 Å²	161	149.6 Å²	149.6	83%	0.826	80%	0.796	S	S	*	*			trans	-61.8	132.3	155.5	-63.3	168	0	0	0	109.6
35	R	33.2	Very low	32.8	Very low	230 Å²	230	147.6 Å²	147.6	87%	0.868	79%	0.785	S	S	*	*			trans	-123.6	119	155.6	-79.7	-171.5	173.2	-172	-1.2	109.1
36	T	28.6	Very low	33	Very low	131 Å²	131	143.8 Å²	143.8	80%	0.804	77%	0.77	S	S	*	*			trans	-70.2	124.8	168.3	44.6	0	0	0	0	109.6
37	L	32.1	Very low	32.9	Very low	162 Å²	162	143.3 Å²	143.3	85%	0.848	76%	0.759	S	S	*	*			trans	-119.2	132.2	165.9	-67.8	176.1	0	0	0	108.1
38	E	27.6	Very low	33.1	Very low	181 Å²	181	140.3 Å²	140.3	85%	0.846	74%	0.742	S	S	*	*			trans	-77.7	142.5	175.8	-60.3	-177	139	0	0	109.8	V40	E38-V40 PolarHBondContact O-N 2.93Å
39	P	37.3	Very low	33.3	Very low	121 Å²	121	132.4 Å²	132.4	79%	0.786	71%	0.705	S	S	*	*			trans	-73.4	99.2	176.5	29.8	-33.2	0	0	0	110.1	Y41	P39-Y41 PolarHBondContact O-N 3.17Å
40	V	33.4	Very low	33.4	Very low	132 Å²	132	126.4 Å²	126.4	80%	0.8	68%	0.678	S	S	*	*			trans	-62.3	130.3	165.8	178.8	0	0	0	0	108.5	E38 D42	E38-V40 PolarHBondContact O-N 2.93Å; V40-D42 PolarHBondContact O-N 3.19Å
41	Y	32.1	Very low	33.3	Very low	231 Å²	231	125.6 Å²	125.6	91%	0.906	68%	0.676	S	S	*	*			trans	-71.9	91.7	175.2	-81.9	-96	0	0	0	110.3	P39	P39-Y41 PolarHBondContact O-N 3.17Å
42	D	31	Very low	33.3	Very low	92 Å²	92	125.3 Å²	125.3	49%	0.492	67%	0.671	S	S	.	*			trans	-81.7	124.2	174.9	-167.2	-18.9	0	0	0	111.4	V40 H44	V40-D42 PolarHBondContact O-N 3.19Å; D42-H44 VanDerWaalsContact C-N 3.28Å; D42-H44 PolarHBondContact O-N 3.17Å; D42-H44 WeakPolarHBondContact OD1-CB 3.46Å; D42-H44 IonicContact OD1-CD2 2.78Å; D42-H44 PolarHBondContact OD1-CD2 3.5Å; D42-H44 VanDerWaalsContact OD1-CD2 3.24Å; D42-H44 IonicContact OD1-CG 2.64Å; D42-H44 PolarHBondContact OD1-N 2.74Å
43	S	37	Very low	33.1	Very low	94 Å²	94	127.1 Å²	127.1	66%	0.657	67%	0.673	S	S	*	*	G	3₁₀ helix	trans	-73	-15.8	178.9	54.3	0	0	0	0	113.7	L45 L46	S43-L45 PolarHBondContact O-N 3Å; S43-L45 VanDerWaalsContact O-N 3.15Å; S43-L46 PolarHBondContact O-N 2.88Å
44	H	33.4	Very low	32.8	Very low	153 Å²	153	130.7 Å²	130.7	71%	0.708	68%	0.678	S	S	*	*	G	3₁₀ helix	trans	-64.6	-16.2	179.5	-78.8	-81.5	0	0	0	114.2	D42 L46	D42-H44 VanDerWaalsContact C-N 3.28Å; D42-H44 PolarHBondContact O-N 3.17Å; D42-H44 WeakPolarHBondContact OD1-CB 3.46Å; D42-H44 IonicContact OD1-CD2 2.78Å; D42-H44 PolarHBondContact OD1-CD2 3.5Å; D42-H44 VanDerWaalsContact OD1-CD2 3.24Å; D42-H44 IonicContact OD1-CG 2.64Å; D42-H44 PolarHBondContact OD1-N 2.74Å; H44-L46 PolarHBondContact O-N 3Å
45	L	36	Very low	32.6	Very low	115 Å²	115	128.8 Å²	128.8	60%	0.602	67%	0.668	S	S	*	*	G	3₁₀ helix	trans	-66.5	-11.4	177.2	-79.9	168.2	0	0	0	114.9	S43 C48	S43-L45 PolarHBondContact O-N 3Å; S43-L45 VanDerWaalsContact O-N 3.15Å; L45-C48 PolarHBondContact O-SG 2.83Å; L45-C48 VanDerWaalsContact O-SG 3.36Å
46	L	36.2	Very low	32.6	Very low	108 Å²	108	123.2 Å²	123.2	57%	0.565	66%	0.664	S	S	*	*	G	3₁₀ helix	trans	-75.8	-24.2	-177.2	-96.1	70.1	0	0	0	115.2	S43 H44	S43-L46 PolarHBondContact O-N 2.88Å; H44-L46 PolarHBondContact O-N 3Å
47	N	33.8	Very low	32.5	Very low	107 Å²	107	124.4 Å²	124.4	57%	0.572	67%	0.666	S	S	*	*	G	3₁₀ helix	trans	-81.3	-15.2	-169.8	-86.8	15.5	0	0	0	115.2	Y49 A50	N47-Y49 PolarHBondContact O-N 2.94Å; N47-A50 CarbonylContact O-C 3.55Å; N47-A50 PolarHBondContact O-N 3.15Å
48	C	35.4	Very low	32.7	Very low	64 Å²	64	120.2 Å²	120.2	43%	0.432	66%	0.662	S	S	.	*	G	3₁₀ helix	trans	-67.6	0.3	-172.9	60.7	0	0	0	0	116	L45	L45-C48 PolarHBondContact O-SG 2.83Å; L45-C48 VanDerWaalsContact O-SG 3.36Å
49	Y	39.9	Very low	32.9	Very low	27 Å²	27	120.6 Å²	120.6	11%	0.106	66%	0.663	C	S	.	*	G	3₁₀ helix	trans	-115.6	-1.5	172.1	-65.2	-78.3	0	0	0	113.7	N47 I372 Y433 P434	N47-Y49 PolarHBondContact O-N 2.94Å; Y49-I372 HydrophobicContact CD1-CD1 4.04Å; Y49-I372 HydrophobicContact CE1-CD1 4.45Å; Y49-Y433 HydrophobicContact CD1-CE1 4.18Å; Y49-Y433 HydrophobicContact CD2-CD1 4.37Å; Y49-Y433 AromaticContact CD2-CE1 3.81Å; Y49-Y433 HydrophobicContact CD2-CE1 3.81Å; Y49-Y433 HydrophobicContact CE2-CD1 4.44Å; Y49-Y433 HydrophobicContact CE2-CE1 4.3Å; Y49-Y433 AromaticContact CG-CE1 3.74Å; Y49-Y433 HydrophobicContact CG-CE1 3.74Å; Y49-P434 HydrophobicContact CE1-CG 4.35Å
50	A	31.6	Very low	33	Very low	36 Å²	36	122.6 Å²	122.6	30%	0.298	67%	0.668	S	S	.	*			trans	-137.2	78.2	-177.2	0	0	0	0	0	109.6	N47 P52	N47-A50 CarbonylContact O-C 3.55Å; N47-A50 PolarHBondContact O-N 3.15Å; A50-P52 WeakPolarHBondContact O-CD 3.49Å
51	N	33	Very low	33.1	Very low	156 Å²	156	123.7 Å²	123.7	83%	0.834	67%	0.669	S	S	*	*			trans	-65.8	115.9	172.1	-74.6	-12.8	0	0	0	109.9
52	P	30.3	Very low	33.4	Very low	95 Å²	95	120.2 Å²	120.2	62%	0.617	67%	0.666	S	S	*	*			trans	-78.9	136	161	1.7	19.3	0	0	0	107.7	A50 Q54	A50-P52 WeakPolarHBondContact O-CD 3.49Å; P52-Q54 PolarHBondContact O-N 3.36Å
53	M	27.7	Very low	33.9	Very low	167 Å²	167	124.5 Å²	124.5	82%	0.823	68%	0.683	S	S	*	*			trans	-72.1	98.8	174.2	-161.8	-179.4	89.2	0	0	109.1	I55	M53-I55 HydrophobicContact CE-CD1 3.8Å; M53-I55 HydrophobicContact CE-CG1 3.81Å; M53-I55 PolarHBondContact O-N 2.9Å
54	Q	28.9	Very low	33.7	Very low	182 Å²	182	124.2 Å²	124.2	85%	0.85	68%	0.679	S	S	*	*			trans	-82.2	104	170.7	-74.2	-161	-42.6	0	0	109.6	P52	P52-Q54 PolarHBondContact O-N 3.36Å
55	I	26.4	Very low	33.7	Very low	120 Å²	120	128 Å²	128	62%	0.615	69%	0.689	S	S	*	*			trans	-74	117	155.8	-59.1	173.4	0	0	0	105.7	M53 D57	M53-I55 HydrophobicContact CE-CD1 3.8Å; M53-I55 HydrophobicContact CE-CG1 3.81Å; M53-I55 PolarHBondContact O-N 2.9Å; I55-D57 PolarHBondContact O-N 3.4Å
56	S	32.4	Very low	33.5	Very low	113 Å²	113	129 Å²	129	79%	0.79	69%	0.694	S	S	*	*			trans	-89.5	87.8	173.1	57.3	0	0	0	0	109.3	G58	S56-G58 PolarHBondContact O-N 2.74Å
57	D	28	Very low	33.4	Very low	157 Å²	157	133.2 Å²	133.2	84%	0.84	71%	0.707	S	S	*	*			trans	-68.4	122.4	159.1	-63.4	-42.1	0	0	0	107.4	I55	I55-D57 PolarHBondContact O-N 3.4Å
58	G	35.9	Very low	33.3	Very low	73 Å²	73	130.8 Å²	130.8	75%	0.753	71%	0.708	S	S	*	*			trans	-154.7	110.5	-176.1	0	0	0	0	0	109.6	S56	S56-G58 PolarHBondContact O-N 2.74Å
59	E	32	Very low	33.3	Very low	189 Å²	189	136.8 Å²	136.8	88%	0.883	73%	0.73	S	S	*	*			trans	-80.3	143.3	175.7	-60.8	168.1	130	0	0	109.3
60	D	39.2	Very low	32.9	Very low	164 Å²	164	144.1 Å²	144.1	88%	0.877	77%	0.765	S	S	*	*			trans	177.4	138.4	137.7	-88.9	-16.8	0	0	0	110.6
61	D	34.4	Very low	33	Very low	154 Å²	154	152.6 Å²	152.6	82%	0.824	80%	0.795	S	S	*	*			trans	-53.6	149.4	-165.7	-59	-53	0	0	0	119.5
62	D	40.3	Very low	32.8	Very low	159 Å²	159	156.3 Å²	156.3	85%	0.85	80%	0.797	S	S	*	*				-171.1	114.1	120.1	-112.6	-22.9	0	0	0	114.3
63	E	40.9	Very low	32.9	Very low	181 Å²	181	158.8 Å²	158.8	85%	0.846	80%	0.804	S	S	*	*			trans	40.3	152.9	161.3	-84	-90.9	107.7	0	0	123.9
64	P	32.4	Very low	33	Very low	88 Å²	88	157.5 Å²	157.5	57%	0.571	80%	0.801	S	S	*	*			trans	-108.3	160.4	-161.8	40.8	-35	0	0	0	116.6
65	Y	32.9	Very low	33.1	Very low	232 Å²	232	159.2 Å²	159.2	91%	0.91	80%	0.801	S	S	*	*			trans	-141.9	132.6	150.7	-151	-97.3	0	0	0	112.2
66	I	31.7	Very low	33.5	Very low	138 Å²	138	161.7 Å²	161.7	71%	0.708	81%	0.81	S	S	*	*			trans	-109.2	123.3	-172.3	-66.6	172.7	0	0	0	111.1
67	F	33.9	Very low	33.3	Very low	195 Å²	195	160.6 Å²	160.6	86%	0.855	81%	0.808	S	S	*	*				-170	157.5	129.2	-135.5	-103.7	0	0	0	112.9
68	G	31.9	Very low	33.7	Very low	57 Å²	57	159 Å²	159	59%	0.588	80%	0.803	S	S	*	*			trans	129.1	34.4	137.7	0	0	0	0	0	123
69	Q	36.1	Very low	33.5	Very low	190 Å²	190	164.6 Å²	164.6	89%	0.888	81%	0.81	S	S	*	*			trans	72.4	149.4	155.5	-57.7	-175.5	-0.7	0	0	120.2
70	E	30.2	Very low	33.7	Very low	180 Å²	180	161.6 Å²	161.6	84%	0.841	80%	0.804	S	S	*	*			trans	-96.6	160	-176.8	-51.5	158.8	95.1	0	0	112.9
71	K	33.9	Very low	33.3	Very low	215 Å²	215	162.4 Å²	162.4	94%	0.935	80%	0.803	S	S	*	*				-161.5	114.3	125.9	-111.4	159.9	-172.5	170.3	0	111.8
72	R	28.7	Very low	33.5	Very low	234 Å²	234	160.9 Å²	160.9	88%	0.883	80%	0.804	S	S	*	*			trans	-109.9	134.4	175.9	-156.2	178.1	-166.5	176	5.4	108.9
73	L	33.6	Very low	33.2	Very low	146 Å²	146	162.5 Å²	162.5	76%	0.764	81%	0.807	S	S	*	*			trans	-124.1	105.8	177.2	-92.7	167.4	0	0	0	109.8	Y75	L73-Y75 HydrophobicContact CD2-CE2 4.13Å
74	N	28.6	Very low	32.9	Very low	140 Å²	140	157.7 Å²	157.7	75%	0.749	81%	0.805	S	S	*	*			trans	-107	137.7	159.7	-85.8	4	0	0	0	107.7
75	Y	32.8	Very low	33.1	Very low	219 Å²	219	158 Å²	158	86%	0.859	82%	0.816	S	S	*	*			trans	-107.1	126.1	165.7	-98.9	-84.6	0	0	0	109.8	L73	L73-Y75 HydrophobicContact CD2-CE2 4.13Å
76	H	34.4	Very low	33.2	Very low	172 Å²	172	154.4 Å²	154.4	80%	0.796	81%	0.807	S	S	*	*			trans	-89.4	145	178.2	-127.9	-88.7	0	0	0	110.3
77	A	28.6	Very low	33.5	Very low	90 Å²	90	157.8 Å²	157.8	74%	0.744	81%	0.811	S	S	*	*			trans	-74.6	147.5	160.1	0	0	0	0	0	109.8
78	V	36.2	Very low	33.7	Very low	123 Å²	123	153.3 Å²	153.3	75%	0.745	80%	0.804	S	S	*	*			trans	-134.9	115.3	173.9	178.9	0	0	0	0	108.4
79	E	30.4	Very low	34.1	Very low	191 Å²	191	156.2 Å²	156.2	89%	0.893	81%	0.806	S	S	*	*			trans	-95.7	148.8	161.3	-63.8	-179.7	139.6	0	0	108.5
80	T	36.8	Very low	34.4	Very low	125 Å²	125	154.5 Å²	154.5	77%	0.767	80%	0.798	S	S	*	*			trans	-154.9	110.8	167.3	-45	0	0	0	0	110.2
81	E	30.4	Very low	34.9	Very low	182 Å²	182	151 Å²	151	85%	0.85	79%	0.785	S	S	*	*			trans	-81.7	147.1	167.8	-64.4	-167.5	129.1	0	0	111.4
82	S	39.7	Very low	35.2	Very low	121 Å²	121	149.4 Å²	149.4	85%	0.846	78%	0.778	S	S	*	*			trans	-158.4	149.5	150.2	51.2	0	0	0	0	110.6
83	Q	33.3	Very low	35.8	Very low	194 Å²	194	143.2 Å²	143.2	91%	0.907	77%	0.771	S	S	*	*			trans	-110.4	147.5	-171	-56.4	174.2	3.6	0	0	111
84	G	34.3	Very low	36.2	Very low	79 Å²	79	140.9 Å²	140.9	81%	0.814	77%	0.767	S	S	*	*			trans	-178.6	80.8	178.5	0	0	0	0	0	119.6
85	A	36.1	Very low	36.8	Very low	96 Å²	96	139 Å²	139	79%	0.793	77%	0.765	S	S	*	*			trans	45.1	103.8	143.6	0	0	0	0	0	124.1
86	Q	36.6	Very low	37.3	Very low	155 Å²	155	134.7 Å²	134.7	72%	0.724	76%	0.761	S	S	*	*				66	142.4	120.9	-71.1	-162.1	13.3	0	0	125.7
87	R	36.9	Very low	37.6	Very low	209 Å²	209	133.6 Å²	133.6	79%	0.789	76%	0.76	S	S	*	*			trans	75.3	108.2	156.8	-67.5	155.8	-164.7	-110.8	1.7	116.7
88	S	37.8	Very low	38.3	Very low	102 Å²	102	136.3 Å²	136.3	71%	0.713	76%	0.757	S	S	*	*				89.2	147.1	79.7	84.7	0	0	0	0	111.8
89	D	40.5	Very low	38.5	Very low	118 Å²	118	138.8 Å²	138.8	63%	0.631	76%	0.758	S	S	*	*			cis	-147.5	159.7	23	-101.5	-86	0	0	0	112.7
90	Q	42	Very low	38.8	Very low	153 Å²	153	134.5 Å²	134.5	72%	0.715	75%	0.749	S	S	*	*			trans	45.1	146.9	142.7	-62.2	173.3	55.8	0	0	121.6
91	N	40.2	Very low	38.5	Very low	108 Å²	108	134.5 Å²	134.5	58%	0.578	75%	0.753	S	S	*	*			cis	-176	147.7	38.6	-133	-41.4	0	0	0	112
92	K	40.7	Very low	38.8	Very low	181 Å²	181	136.2 Å²	136.2	79%	0.787	76%	0.757	S	S	*	*			trans	57.8	161.4	154.2	-69.7	159.9	-170.8	176.9	0	119.5
93	S	41.9	Very low	38.6	Very low	103 Å²	103	133.7 Å²	133.7	72%	0.72	75%	0.75	S	S	*	*			cis	-174.7	152.3	-28.2	58.7	0	0	0	0	105.9
94	S	41.3	Very low	38.8	Very low	98 Å²	98	129.9 Å²	129.9	69%	0.685	75%	0.745	S	S	*	*			cis	-178.6	166.7	38.7	51.4	0	0	0	0	111.5
95	S	42.8	Very low	39	Very low	100 Å²	100	131.4 Å²	131.4	70%	0.699	74%	0.743	S	S	*	*			trans	56.8	140.6	141.7	59.3	0	0	0	0	122.7
96	T	41.9	Very low	39.1	Very low	128 Å²	128	132.5 Å²	132.5	79%	0.785	75%	0.745	S	S	*	*			cis	-168.5	165.6	-14.2	-63.3	0	0	0	0	108.5
97	I	42	Very low	39.2	Very low	149 Å²	149	128.2 Å²	128.2	76%	0.764	74%	0.743	S	S	*	*			trans	125.1	100.8	151	-61.4	178.2	0	0	0	116.2
98	Q	42.6	Very low	39.4	Very low	147 Å²	147	125.3 Å²	125.3	69%	0.687	75%	0.748	S	S	*	*			trans	18	145.6	132.1	-61.9	-177.6	11.2	0	0	120.1
99	K	39.8	Very low	39.6	Very low	175 Å²	175	125.4 Å²	125.4	76%	0.761	75%	0.749	S	S	*	*			cis	-169.3	173.5	33	-115.2	143	176.1	153.1	0	107.7
100	S	36.7	Very low	39.6	Very low	102 Å²	102	128.4 Å²	128.4	71%	0.713	76%	0.759	S	S	*	*			cis	-178.3	155.6	-25.1	50.9	0	0	0	0	109.5
101	C	31.5	Very low	39.4	Very low	125 Å²	125	130 Å²	130	85%	0.845	77%	0.766	S	S	*	*			trans	-131.6	174.1	-179.4	-59.8	0	0	0	0	113.8
102	K	36.9	Very low	39.6	Very low	218 Å²	218	129.4 Å²	129.4	95%	0.948	77%	0.769	S	S	*	*			trans	84.3	152.5	-178	-51.1	169.6	-178.6	-179.6	0	114.6
103	G	35.5	Very low	39.6	Very low	68 Å²	68	130.2 Å²	130.2	70%	0.701	78%	0.775	S	S	*	*			cis	157.8	138.1	-12.9	0	0	0	0	0	115.3
104	S	36.3	Very low	39.3	Very low	113 Å²	113	130.1 Å²	130.1	79%	0.79	78%	0.775	S	S	*	*			trans	69.7	136.2	156.2	-51.9	0	0	0	0	123.2
105	S	39	Very low	39.2	Very low	111 Å²	111	132.6 Å²	132.6	78%	0.776	79%	0.786	S	S	*	*			trans	61.7	153.9	146.8	47.2	0	0	0	0	121.4
106	S	39	Very low	38.9	Very low	120 Å²	120	132.5 Å²	132.5	84%	0.839	79%	0.785	S	S	*	*			cis	-176.8	150.8	-25.7	55.3	0	0	0	0	112.1
107	G	38.7	Very low	38.8	Very low	65 Å²	65	135.6 Å²	135.6	67%	0.67	79%	0.788	S	S	*	*			trans	119.7	138.2	147	0	0	0	0	0	119.8
108	T	40.4	Very low	38.6	Very low	147 Å²	147	134 Å²	134	90%	0.902	79%	0.785	S	S	*	*			trans	59.2	140.8	150.1	41.1	0	0	0	0	119.7
109	S	41.3	Very low	38.4	Very low	105 Å²	105	131.2 Å²	131.2	73%	0.734	78%	0.782	S	S	*	*			cis	-165.4	-164.1	-3.7	-152.5	0	0	0	0	107.3
110	E	40.5	Very low	38.4	Very low	180 Å²	180	130.1 Å²	130.1	84%	0.841	79%	0.785	S	S	*	*			cis	-135.6	-109.5	7.2	-66.1	-171.2	108.1	0	0	113.5
111	Q	37.9	Very low	38.6	Very low	186 Å²	186	135.8 Å²	135.8	87%	0.869	79%	0.79	S	S	*	*			trans	-147.9	174.7	-159.6	-92.6	-89.5	-66.3	0	0	113.5
112	P	45.3	Very low	39	Very low	97 Å²	97	135.4 Å²	135.4	63%	0.63	79%	0.789	S	S	*	*			trans	-118.4	-174	-152.1	45.1	-38.1	0	0	0	115.6
113	E	39.4	Very low	39.1	Very low	197 Å²	197	128.2 Å²	128.2	92%	0.921	78%	0.776	S	S	*	*			trans	-151.9	-177.5	149	-133	174.7	-144.1	0	0	113.8
114	S	35.8	Very low	39.4	Very low	101 Å²	101	133 Å²	133	71%	0.706	78%	0.781	S	S	*	*			trans	-142.1	156.8	-165	73.4	0	0	0	0	114.3
115	T	39.8	Very low	39.6	Very low	151 Å²	151	134.9 Å²	134.9	93%	0.926	78%	0.777	S	S	*	*			trans	-167.5	177.4	156.5	4.4	0	0	0	0	113.4
116	S	36.1	Very low	39.6	Very low	98 Å²	98	133.9 Å²	133.9	69%	0.685	77%	0.77	S	S	*	*			trans	-146.5	177.6	-169.3	58.4	0	0	0	0	113.2
117	K	40.6	Very low	39.6	Very low	193 Å²	193	133.1 Å²	133.1	84%	0.839	77%	0.765	S	S	*	*			trans	96.5	157.6	169.4	-59.2	169.4	-175.7	174.5	0	117.5
118	T	37.9	Very low	39.8	Very low	115 Å²	115	135.8 Å²	135.8	71%	0.706	77%	0.767	S	S	*	*			cis	-163.5	151	-41	-52.5	0	0	0	0	109.3
119	S	38.4	Very low	39.6	Very low	88 Å²	88	134.9 Å²	134.9	62%	0.615	76%	0.762	S	S	*	*			trans	51.1	127.1	151	56.5	0	0	0	0	123.9
120	N	40.3	Very low	39.6	Very low	153 Å²	153	133.9 Å²	133.9	82%	0.818	76%	0.755	S	S	*	*				160.9	176	117.3	-83.2	-32.2	0	0	0	112.6
121	R	39.4	Very low	39.5	Very low	221 Å²	221	133 Å²	133	83%	0.834	76%	0.755	S	S	*	*				-167.6	143.3	-70.9	-163	-178.3	-171.6	-170.9	2	110.2
122	S	39.8	Very low	39.7	Very low	117 Å²	117	128.1 Å²	128.1	82%	0.818	74%	0.742	S	S	*	*			trans	68.3	152.7	157	40.2	0	0	0	0	122.8
123	G	40.1	Very low	39.3	Very low	66 Å²	66	130.9 Å²	130.9	68%	0.68	75%	0.751	S	S	*	*			trans	113.2	114.5	178.7	0	0	0	0	0	112.5
124	E	40.4	Very low	39.4	Very low	169 Å²	169	125.9 Å²	125.9	79%	0.79	74%	0.738	S	S	*	*			cis	76.6	135.9	35.6	-55.4	-163.5	98.9	0	0	114.5
125	Q	40.9	Very low	39.5	Very low	152 Å²	152	132.4 Å²	132.4	71%	0.71	75%	0.747	S	S	*	*			cis	-160.8	155.2	-0.9	-124	-174.5	55.4	0	0	112.9
126	S	38.7	Very low	39.5	Very low	90 Å²	90	129.6 Å²	129.6	63%	0.629	73%	0.734	S	S	*	*			trans	57.1	141	143.5	70.6	0	0	0	0	126.4
127	S	39.9	Very low	39.5	Very low	105 Å²	105	134 Å²	134	73%	0.734	74%	0.743	S	S	*	*			trans	79.9	153.1	137	79.6	0	0	0	0	121.3
128	V	42.3	Very low	39.1	Very low	120 Å²	120	131.4 Å²	131.4	73%	0.727	74%	0.744	S	S	*	*			cis	-165.4	153.2	-29.7	-90.1	0	0	0	0	110.8
129	T	37.8	Very low	39.1	Very low	128 Å²	128	131 Å²	131	79%	0.785	75%	0.752	S	S	*	*			trans	56.4	159	149.8	49	0	0	0	0	121.2
130	S	39.8	Very low	38.8	Very low	85 Å²	85	133.5 Å²	133.5	59%	0.594	76%	0.764	S	S	*	*			cis	-178.4	164	-22.1	58.3	0	0	0	0	110.6
131	L	39.6	Very low	38.6	Very low	160 Å²	160	133.1 Å²	133.1	84%	0.838	77%	0.767	S	S	*	*			trans	67.6	160.5	161.5	-60.6	162.7	0	0	0	116.8
132	S	40.9	Very low	38.4	Very low	84 Å²	84	127 Å²	127	59%	0.587	76%	0.764	S	S	*	*			cis	-173.1	152.7	-29.8	57.3	0	0	0	0	110.7
133	N	38	Very low	38.3	Very low	156 Å²	156	130 Å²	130	83%	0.834	77%	0.765	S	S	*	*			trans	65.7	156.6	161	-69.5	-9.2	0	0	0	117.8
134	S	41.2	Very low	37.8	Very low	91 Å²	91	136.1 Å²	136.1	64%	0.636	78%	0.775	S	S	*	*			cis	-172.4	155.6	-17.7	52.6	0	0	0	0	110.9
135	R	38.9	Very low	37.4	Very low	239 Å²	239	134.2 Å²	134.2	90%	0.902	78%	0.775	S	S	*	*			trans	63.9	162	166.5	-74.8	176.5	169.3	170.2	-5.6	115.9
136	S	37.9	Very low	37	Very low	92 Å²	92	136.1 Å²	136.1	64%	0.643	78%	0.781	S	S	*	*			cis	-167.1	141.6	-33.4	49.5	0	0	0	0	105.9
137	E	37.8	Very low	36.7	Very low	189 Å²	189	137.7 Å²	137.7	88%	0.883	79%	0.789	S	S	*	*				-179.7	-177.2	86.2	-96.1	179.2	173.3	0	0	111.6
138	T	31.7	Very low	36.2	Very low	140 Å²	140	141.4 Å²	141.4	86%	0.859	79%	0.794	S	S	*	*			trans	-81.1	141.5	-167.5	50.6	0	0	0	0	116.9
139	A	37.2	Very low	35.6	Very low	105 Å²	105	145.5 Å²	145.5	87%	0.868	80%	0.803	S	S	*	*			trans	-157.4	152.2	140.2	0	0	0	0	0	111
140	T	32.2	Very low	35.1	Very low	141 Å²	141	144.5 Å²	144.5	87%	0.865	80%	0.797	S	S	*	*			trans	-104.9	127.7	-171.4	49	0	0	0	0	113.9
141	V	37.5	Very low	34.6	Very low	145 Å²	145	144.5 Å²	144.5	88%	0.879	80%	0.797	S	S	*	*			trans	-139.1	139.3	153.6	-177.3	0	0	0	0	108.1
142	A	33.4	Very low	34.2	Very low	94 Å²	94	147.3 Å²	147.3	78%	0.777	80%	0.798	S	S	*	*			trans	-76	143.2	-179.9	0	0	0	0	0	112
143	H	38	Very low	33.7	Very low	180 Å²	180	151 Å²	151	83%	0.833	81%	0.805	S	S	*	*			trans	-142.3	133.8	160.9	-126.4	-74.6	0	0	0	111	V145	H143-V145 PolarHBondContact O-N 3.11Å
144	E	29.8	Very low	33.5	Very low	194 Å²	194	152 Å²	152	91%	0.907	80%	0.797	S	S	*	*			trans	-76.6	119.3	-176.3	-171.7	179.5	-166.4	0	0	110.7
145	V	33	Very low	32.9	Very low	129 Å²	129	151.5 Å²	151.5	78%	0.782	79%	0.794	S	S	*	*			trans	-123	131.7	-178.9	-178.7	0	0	0	0	110.4	H143	H143-V145 PolarHBondContact O-N 3.11Å
146	K	31.2	Very low	32.8	Very low	191 Å²	191	145.2 Å²	145.2	83%	0.83	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-66.3	139.4	-177.3	-63.6	162.1	-177.8	162.6	0	111.3
147	P	32.8	Very low	32.6	Very low	123 Å²	123	144.9 Å²	144.9	80%	0.799	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-68.6	137.6	163.6	29.8	-33.4	0	0	0	110.4
148	E	30.2	Very low	32.7	Very low	183 Å²	183	139.8 Å²	139.8	86%	0.855	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-68.2	151.3	174.8	-67.3	-170.4	100.7	0	0	112.1	T150	E148-T150 PolarHBondContact O-N 3.15Å
149	K	28.8	Very low	32.5	Very low	207 Å²	207	139 Å²	139	90%	0.9	75%	0.748	S	S	*	*			trans	-92.6	78.4	176.7	-73.6	-174.2	175.7	179.2	0	111.2	S151	K149-S151 PolarHBondContact O-N 3.14Å
150	T	27.8	Very low	32.3	Very low	107 Å²	107	138.4 Å²	138.4	66%	0.656	73%	0.726	S	S	*	*			trans	-60.6	103.5	171.1	-43.7	0	0	0	0	110	E148 Y152	E148-T150 PolarHBondContact O-N 3.15Å; T150-Y152 PolarHBondContact O-N 2.67Å
151	S	28.9	Very low	32.2	Very low	85 Å²	85	140.3 Å²	140.3	59%	0.594	73%	0.726	S	S	*	*			trans	-79.9	103	178.9	71.2	0	0	0	0	110.2	K149 Q153	K149-S151 PolarHBondContact O-N 3.14Å; S151-Q153 PolarHBondContact O-N 3.34Å; S151-Q153 PolarHBondContact OG-NE2 2.65Å
152	Y	30.3	Very low	31.7	Very low	219 Å²	219	142.1 Å²	142.1	86%	0.859	73%	0.725	S	S	*	*			trans	-66.1	101.1	171	-77	-85.7	0	0	0	110.4	T150	T150-Y152 PolarHBondContact O-N 2.67Å
153	Q	30.8	Very low	31.5	Very low	160 Å²	160	144.4 Å²	144.4	75%	0.748	73%	0.728	S	S	*	*			trans	-94.9	96.4	172.1	-63.4	-179.9	27.2	0	0	108.3	S151	S151-Q153 PolarHBondContact O-N 3.34Å; S151-Q153 PolarHBondContact OG-NE2 2.65Å
154	R	33.8	Very low	31	Very low	178 Å²	178	142.6 Å²	142.6	67%	0.672	72%	0.724	S	S	*	*			trans	-81.7	134.7	166.5	-134.7	179.8	-171.6	-173.5	1.8	107.6	E455	R154-E455 IonicContact CZ-OE1 3.95Å; R154-E455 IonicContact NH1-OE1 2.65Å; R154-E455 PolarHBondContact NH1-OE1 3.44Å; R154-E455 IonicContact NH1-OE2 2.65Å; R154-E455 IonicContact NH2-OE1 3.5Å
155	S	29.7	Very low	30.9	Very low	80 Å²	80	138.6 Å²	138.6	56%	0.559	72%	0.718	S	S	*	*			trans	-81	132	174.6	50.5	0	0	0	0	110.8	S157	S155-S157 PolarHBondContact O-N 2.96Å
156	D	35.9	Very low	31	Very low	108 Å²	108	138.6 Å²	138.6	58%	0.578	72%	0.721	S	S	*	*			trans	-74.5	61.2	175.2	-65.3	-39	0	0	0	111.7	E158	D156-E158 PolarHBondContact O-N 3.25Å
157	S	34.2	Very low	30.8	Very low	85 Å²	85	134 Å²	134	59%	0.594	71%	0.712	S	S	*	*			trans	-78.5	86.3	164.4	51.6	0	0	0	0	108.6	S155 T159	S155-S157 PolarHBondContact O-N 2.96Å; S157-T159 PolarHBondContact O-N 3.3Å; S157-T159 PolarHBondContact O-OG1 2.93Å
158	E	39.8	Very low	30.8	Very low	82 Å²	82	131.4 Å²	131.4	38%	0.383	71%	0.708	S	S	.	*			trans	-65.7	76.5	175	-61.3	-173.2	93.6	0	0	110.5	D156 E160 R218 K220 K402	D156-E158 PolarHBondContact O-N 3.25Å; E158-E160 VanDerWaalsContact C-N 3.28Å; E158-E160 PolarHBondContact O-N 2.78Å; E158-R218 IonicContact OE2-CZ 2.78Å; E158-R218 IonicContact OE2-NH1 3.44Å; E158-R218 PolarHBondContact OE2-NH1 2.91Å; E158-R218 IonicContact OE2-NH2 3.12Å; E158-R218 PolarHBondContact OE2-NH2 2.9Å; E158-K220 IonicContact OE2-NZ 3.66Å; E158-K402 IonicContact OE1-NZ 2.68Å; E158-K402 PolarHBondContact OE1-NZ 3.12Å
159	T	27.5	Very low	30.8	Very low	124 Å²	124	128.2 Å²	128.2	76%	0.761	71%	0.706	S	S	*	*			trans	-82.6	63.7	179.6	-45.5	0	0	0	0	111.8	S157	S157-T159 PolarHBondContact O-N 3.3Å; S157-T159 PolarHBondContact O-OG1 2.93Å
160	E	33.5	Very low	31.2	Very low	91 Å²	91	126 Å²	126	43%	0.425	71%	0.71	S	S	.	*	P	Polyproline II helix	trans	-83.5	121.9	167.7	-66	-179.8	144.7	0	0	108.7	E158 R421	E158-E160 VanDerWaalsContact C-N 3.28Å; E158-E160 PolarHBondContact O-N 2.78Å; E160-R421 IonicContact OE2-NH1 2.78Å; E160-R421 PolarHBondContact OE2-NH1 2.84Å
161	Q	29.9	Very low	31.5	Very low	181 Å²	181	124.2 Å²	124.2	85%	0.846	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-74	131.6	-176.9	-71.3	178.3	-40.5	0	0	112.1
162	E	26.6	Very low	31.5	Very low	184 Å²	184	127.1 Å²	127.1	86%	0.86	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-70.5	135.4	167.9	-66	-169.4	124.6	0	0	111.1
163	V	29.6	Very low	32.1	Very low	141 Å²	141	124.5 Å²	124.5	86%	0.855	72%	0.716	S	S	*	*			trans	-129.1	130.5	167.4	-177	0	0	0	0	108.3
164	L	27	Very low	32.2	Very low	142 Å²	142	122.8 Å²	122.8	74%	0.743	72%	0.719	S	S	*	*			trans	-106.1	144.3	-165.3	-78.5	161.9	0	0	0	113.2
165	S	27.9	Very low	32.1	Very low	111 Å²	111	118 Å²	118	78%	0.776	73%	0.725	S	S	*	*			trans	69.1	171.2	151.4	-68.4	0	0	0	0	116.6
166	P	33.8	Very low	32.3	Very low	129 Å²	129	124.1 Å²	124.1	84%	0.838	74%	0.742	S	S	*	*			cis	-121.6	-173.3	4.3	42	-27.4	0	0	0	115.4
167	S	27.1	Very low	32.1	Very low	93 Å²	93	130.5 Å²	130.5	65%	0.65	76%	0.758	S	S	*	*			trans	-102.1	132.8	-177.3	52.7	0	0	0	0	113.9
168	G	33.2	Very low	32	Very low	69 Å²	69	132.8 Å²	132.8	71%	0.711	77%	0.768	S	S	*	*			trans	-119.6	172.4	165.5	0	0	0	0	0	112.9
169	S	30.9	Very low	31.9	Very low	117 Å²	117	137.2 Å²	137.2	82%	0.818	79%	0.789	S	S	*	*			trans	-154.5	106.7	-172.5	58.2	0	0	0	0	115.5
170	V	36.3	Very low	32	Very low	161 Å²	161	141.6 Å²	141.6	98%	0.976	80%	0.798	S	S	*	*			trans	-160.6	155.9	163.2	-112.2	0	0	0	0	106.7
171	G	34.1	Very low	32	Very low	69 Å²	69	143.8 Å²	143.8	71%	0.711	82%	0.818	S	S	*	*			cis	-174.9	142.1	-9	0	0	0	0	0	107.4
172	E	29.9	Very low	32	Very low	146 Å²	146	139.4 Å²	139.4	68%	0.682	81%	0.812	S	S	*	*			trans	-87.3	144.2	-170.3	-69.3	-169.8	103.1	0	0	114.4	R9	R9-E172 VanDerWaalsContact CZ-CD 3.45Å; R9-E172 IonicContact CZ-OE1 3.17Å; R9-E172 IonicContact CZ-OE2 3.14Å; R9-E172 IonicContact NE-OE1 3.92Å; R9-E172 VanDerWaalsContact NH1-CD 3.26Å; R9-E172 IonicContact NH1-OE1 3.46Å; R9-E172 PolarHBondContact NH1-OE1 2.67Å; R9-E172 IonicContact NH1-OE2 2.67Å; R9-E172 PolarHBondContact NH1-OE2 3.46Å; R9-E172 IonicContact NH2-OE1 2.72Å; R9-E172 PolarHBondContact NH2-OE1 2.89Å; R9-E172 IonicContact NH2-OE2 2.89Å; R9-E172 PolarHBondContact NH2-OE2 2.72Å
173	L	42	Very low	32.2	Very low	163 Å²	163	138.2 Å²	138.2	85%	0.853	81%	0.812	S	S	*	*			trans	-118.3	147.6	163.1	-78.7	169.4	0	0	0	109.9
174	P	34.4	Very low	32.3	Very low	124 Å²	124	137 Å²	137	81%	0.805	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-78.4	145.4	-164.6	30.7	-35.8	0	0	0	113.7
175	G	29.9	Very low	32.6	Very low	78 Å²	78	138.1 Å²	138.1	80%	0.804	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-78	152.6	-170.6	0	0	0	0	0	115.8
176	F	35.1	Very low	33	Very low	208 Å²	208	137.1 Å²	137.1	91%	0.912	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-91.9	143.3	163.6	-108.6	-103.4	0	0	0	111.2
177	R	31.2	Very low	33.7	Very low	243 Å²	243	134.8 Å²	134.8	92%	0.917	79%	0.793	S	S	*	*			trans	-114.1	84.4	-175.2	-178.1	-170.8	176.6	-174.9	-0	110.3
178	T	32.7	Very low	35.1	Very low	132 Å²	132	135.8 Å²	135.8	81%	0.81	80%	0.795	S	S	*	*			trans	-91	152.8	173.6	-46.1	0	0	0	0	110.5
179	Q	38.1	Very low	36.8	Very low	176 Å²	176	134 Å²	134	82%	0.822	77%	0.77	S	S	*	*			trans	-88.6	158.2	-158.3	-63.8	168.3	-1.2	0	0	113.1	T181	Q179-T181 PolarHBondContact O-N 3.06Å; Q179-T181 VanDerWaalsContact O-N 3.17Å
180	K	29.9	Very low	39.1	Very low	215 Å²	215	131.7 Å²	131.7	94%	0.935	75%	0.752	S	S	*	*			trans	-67.9	107.1	166.6	-81.9	-174.5	170.8	-173.7	0	109.6
181	T	33	Very low	41.3	Very low	138 Å²	138	127.2 Å²	127.2	85%	0.847	72%	0.724	S	S	*	*			trans	-91	128.9	143.1	41.4	0	0	0	0	107.9	Q179	Q179-T181 PolarHBondContact O-N 3.06Å; Q179-T181 VanDerWaalsContact O-N 3.17Å
182	A	30.2	Very low	43.6	Very low	89 Å²	89	127 Å²	127	74%	0.736	71%	0.712	S	S	*	*			trans	-85.4	128.7	162	0	0	0	0	0	107
183	D	29.7	Very low	46.3	Very low	159 Å²	159	124.3 Å²	124.3	85%	0.85	70%	0.7	S	S	*	*			trans	175.2	106.9	146.9	-89.1	-20.1	0	0	0	108.3
184	S	32.7	Very low	48.5	Very low	116 Å²	116	116.7 Å²	116.7	81%	0.811	66%	0.66	S	S	*	*			trans	-162.1	110.5	174.5	-76.4	0	0	0	0	108.9	S186	S184-S186 VanDerWaalsContact C-N 3.26Å; S184-S186 PolarHBondContact O-N 3.46Å
185	N	31.7	Very low	51	Low	164 Å²	164	115 Å²	115	88%	0.877	65%	0.647	S	S	*	*			trans	-71.2	78.9	178.4	-76.1	-31.6	0	0	0	110.9	T187	N185-T187 PolarHBondContact O-N 2.96Å
186	S	36.2	Very low	53.9	Low	91 Å²	91	118.2 Å²	118.2	64%	0.636	64%	0.641	S	S	*	*			trans	-62	105.7	166.5	-172.7	0	0	0	0	108.5	S184 T188	S184-S186 VanDerWaalsContact C-N 3.26Å; S184-S186 PolarHBondContact O-N 3.46Å; S186-T188 VanDerWaalsContact C-N 3.27Å; S186-T188 PolarHBondContact O-N 3.41Å
187	T	48.9	Very low	56.6	Low	80 Å²	80	112.1 Å²	112.1	49%	0.491	62%	0.618	S	S	.	*			trans	-71.5	85.1	178.2	-45.1	0	0	0	0	109	N185 V189	N185-T187 PolarHBondContact O-N 2.96Å; T187-V189 HydrophobicContact CG2-CG2 4.05Å; T187-V189 PolarHBondContact O-N 3.11Å
188	T	56.7	Low	59.6	Low	113 Å²	113	101.7 Å²	101.7	69%	0.693	58%	0.58	S	S	*	*			trans	-77.7	54.6	-174.1	43.3	0	0	0	0	112.8	S186 T190	S186-T188 VanDerWaalsContact C-N 3.27Å; S186-T188 PolarHBondContact O-N 3.41Å; T188-T190 PolarHBondContact O-N 2.78Å; T188-T190 VanDerWaalsContact O-N 3.09Å
189	V	69.5	Low	62.5	Low	31 Å²	31	100.1 Å²	100.1	19%	0.188	56%	0.564	C	S	.	*			trans	-43.8	119.8	172.9	-168.7	0	0	0	0	108.5	T187 E193 I194 K237	T187-V189 HydrophobicContact CG2-CG2 4.05Å; T187-V189 PolarHBondContact O-N 3.11Å; V189-E193 WeakPolarHBondContact CA-OE2 3.46Å; V189-E193 HydrophobicContact CG1-CB 4.47Å; V189-E193 VanDerWaalsContact CG1-CD 3.45Å; V189-E193 HydrophobicContact CG1-CG 3.98Å; V189-E193 WeakPolarHBondContact CG1-OE2 3.4Å; V189-I194 HydrophobicContact CB-CD1 4.28Å; V189-I194 HydrophobicContact CB-CG1 4.42Å; V189-I194 HydrophobicContact CG1-CD1 4.03Å; V189-I194 HydrophobicContact CG1-CG1 3.63Å; V189-K237 PolarHBondContact O-NZ 2.9Å
190	T	79.8	Confident	65.1	Low	70 Å²	70	96.7 Å²	96.7	43%	0.429	55%	0.548	S	S	.	.			trans	-72	168.9	-163	70.3	0	0	0	0	111.4	T188 E193 I194 K237	T188-T190 PolarHBondContact O-N 2.78Å; T188-T190 VanDerWaalsContact O-N 3.09Å; T190-E193 PolarHBondContact N-OE2 2.82Å; T190-E193 WeakPolarHBondContact OG1-CB 3.44Å; T190-E193 PolarHBondContact OG1-N 3.36Å; T190-E193 VanDerWaalsContact OG1-N 3.13Å; T190-I194 WeakPolarHBondContact O-CD1 3.48Å; T190-I194 WeakPolarHBondContact O-CG1 3.1Å; T190-K237 PolarHBondContact O-NZ 3.49Å
191	V	82.4	Confident	68.2	Low	66 Å²	66	87.5 Å²	87.5	40%	0.4	51%	0.508	S	S	.	.	H	α-helix	trans	-66.1	-44.3	175.4	-178.5	0	0	0	0	110.1	V195 K237 I243	V191-V195 WeakPolarHBondContact O-CG2 3.06Å; V191-V195 PolarHBondContact O-N 2.89Å; V191-K237 HydrophobicContact CG2-CD 4.19Å; V191-I243 HydrophobicContact CB-CD1 4.31Å; V191-I243 HydrophobicContact CG1-CD1 3.92Å; V191-I243 HydrophobicContact CG1-CG1 4.2Å; V191-I243 HydrophobicContact CG2-CD1 4.21Å
192	S	82.4	Confident	71.2	Confident	66 Å²	66	80.9 Å²	80.9	46%	0.462	47%	0.467	S	S	.	.	H	α-helix	trans	-64.1	-49.2	-178.4	-39.7	0	0	0	0	111.8	I194 V195 E196	S192-I194 VanDerWaalsContact C-N 3.29Å; S192-I194 PolarHBondContact O-N 3.26Å; S192-V195 CarbonylContact O-C 3.56Å; S192-V195 PolarHBondContact O-N 3.19Å; S192-E196 WeakPolarHBondContact CB-OE1 3.43Å; S192-E196 WeakPolarHBondContact O-CB 3.41Å; S192-E196 WeakPolarHBondContact O-CG 3.45Å; S192-E196 PolarHBondContact O-N 2.84Å
193	E	86.6	Confident	74.3	Confident	88 Å²	88	79.6 Å²	79.6	41%	0.411	45%	0.447	S	S	.	.	H	α-helix	trans	-54.4	-40.1	179.4	179.3	-175.3	-178	0	0	113.5	V189 T190 N197	V189-E193 WeakPolarHBondContact CA-OE2 3.46Å; V189-E193 HydrophobicContact CG1-CB 4.47Å; V189-E193 VanDerWaalsContact CG1-CD 3.45Å; V189-E193 HydrophobicContact CG1-CG 3.98Å; V189-E193 WeakPolarHBondContact CG1-OE2 3.4Å; T190-E193 PolarHBondContact N-OE2 2.82Å; T190-E193 WeakPolarHBondContact OG1-CB 3.44Å; T190-E193 PolarHBondContact OG1-N 3.36Å; T190-E193 VanDerWaalsContact OG1-N 3.13Å; E193-N197 WeakPolarHBondContact O-CB 3.4Å; E193-N197 PolarHBondContact O-N 3.05Å; E193-N197 VanDerWaalsContact O-N 3.11Å; E193-N197 PolarHBondContact O-ND2 2.83Å
194	I	87.4	Confident	77.3	Confident	3 Å²	3	77.5 Å²	77.5	2%	0.015	43%	0.43	C	S	.	.	H	α-helix	trans	-69.8	-36.9	175.7	-66.1	166.4	0	0	0	111.6	V189 T190 S192 L198 F201 L235 I243 L245	V189-I194 HydrophobicContact CB-CD1 4.28Å; V189-I194 HydrophobicContact CB-CG1 4.42Å; V189-I194 HydrophobicContact CG1-CD1 4.03Å; V189-I194 HydrophobicContact CG1-CG1 3.63Å; T190-I194 WeakPolarHBondContact O-CD1 3.48Å; T190-I194 WeakPolarHBondContact O-CG1 3.1Å; S192-I194 VanDerWaalsContact C-N 3.29Å; S192-I194 PolarHBondContact O-N 3.26Å; I194-L198 WeakPolarHBondContact O-CA 3.11Å; I194-L198 WeakPolarHBondContact O-CB 3.37Å; I194-L198 PolarHBondContact O-N 2.86Å; I194-F201 HydrophobicContact CD1-CE2 4.12Å; I194-F201 HydrophobicContact CD1-CZ 4.29Å; I194-F201 HydrophobicContact CG1-CD2 3.94Å; I194-F201 HydrophobicContact CG1-CE2 3.92Å; I194-F201 HydrophobicContact CG1-CG 4.44Å; I194-F201 HydrophobicContact CG1-CZ 4.4Å; I194-F201 HydrophobicContact CG2-CD1 3.9Å; I194-F201 HydrophobicContact CG2-CD2 4.34Å; I194-F201 HydrophobicContact CG2-CE1 4.15Å; I194-F201 HydrophobicContact CG2-CG 4.01Å; I194-F201 HydrophobicContact CG2-CZ 4.47Å; I194-L235 HydrophobicContact CD1-CD2 3.87Å; I194-I243 HydrophobicContact CD1-CD1 4.16Å; I194-I243 HydrophobicContact CG2-CG2 4.19Å; I194-L245 HydrophobicContact CG2-CD2 4.01Å
195	V	87.7	Confident	80.3	Confident	89 Å²	89	73.2 Å²	73.2	54%	0.539	40%	0.4	S	S	.	.	H	α-helix	trans	-77.2	-38.9	-178.5	171.7	0	0	0	0	111.3	V191 S192 I243	V191-V195 WeakPolarHBondContact O-CG2 3.06Å; V191-V195 PolarHBondContact O-N 2.89Å; S192-V195 CarbonylContact O-C 3.56Å; S192-V195 PolarHBondContact O-N 3.19Å; V195-I243 HydrophobicContact CG2-CG2 4.04Å
196	E	90.1	Very high	83.2	Confident	146 Å²	146	65.6 Å²	65.6	68%	0.682	36%	0.359	S	S	*	.	H	α-helix	trans	-69.9	-38.1	178.4	-71.5	161.5	-158.8	0	0	111.9	S192	S192-E196 WeakPolarHBondContact CB-OE1 3.43Å; S192-E196 WeakPolarHBondContact O-CB 3.41Å; S192-E196 WeakPolarHBondContact O-CG 3.45Å; S192-E196 PolarHBondContact O-N 2.84Å
197	N	92.3	Very high	85.9	Confident	80 Å²	80	64.7 Å²	64.7	43%	0.428	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.5	34.6	-177.1	-52.9	-81.8	0	0	0	112.3	E193 E199 E200 F201	E193-N197 WeakPolarHBondContact O-CB 3.4Å; E193-N197 PolarHBondContact O-N 3.05Å; E193-N197 VanDerWaalsContact O-N 3.11Å; E193-N197 PolarHBondContact O-ND2 2.83Å; N197-E199 VanDerWaalsContact C-N 3.32Å; N197-E199 PolarHBondContact O-N 3.45Å; N197-E200 PolarHBondContact O-N 3.04Å; N197-E200 VanDerWaalsContact O-N 3.1Å; N197-F201 PolarHBondContact O-N 2.86Å
198	L	94	Very high	87.9	Confident	24 Å²	24	65 Å²	65	13%	0.126	34%	0.344	C	S	.	.	H	α-helix	trans	-57.6	-40.6	-169.7	-179.1	57.9	0	0	0	113.4	I194 E200 F201 I202 L245 I263	I194-L198 WeakPolarHBondContact O-CA 3.11Å; I194-L198 WeakPolarHBondContact O-CB 3.37Å; I194-L198 PolarHBondContact O-N 2.86Å; L198-E200 PolarHBondContact O-N 3.02Å; L198-F201 PolarHBondContact O-N 2.95Å; L198-I202 HydrophobicContact CD1-CG2 3.91Å; L198-I202 HydrophobicContact CG-CG2 4.45Å; L198-I202 WeakPolarHBondContact O-CG1 3.19Å; L198-I202 WeakPolarHBondContact O-CG2 3.34Å; L198-I202 PolarHBondContact O-N 3.34Å; L198-L245 HydrophobicContact CD1-CD2 3.79Å; L198-I263 HydrophobicContact CD2-CB 4.01Å; L198-I263 HydrophobicContact CD2-CG2 4.22Å; L198-I263 HydrophobicContact CG-CB 4.41Å; L198-I263 HydrophobicContact CG-CG2 4.14Å
199	E	93.8	Very high	89.5	Confident	98 Å²	98	63.1 Å²	63.1	46%	0.458	35%	0.348	S	S	.	.	H	α-helix	trans	-64.9	-37.2	178.8	-168.6	173.2	-173.6	0	0	112.5	N197 I202 I263 V276	N197-E199 VanDerWaalsContact C-N 3.32Å; N197-E199 PolarHBondContact O-N 3.45Å; E199-I202 VanDerWaalsContact O-CG1 3.24Å; E199-I202 WeakPolarHBondContact O-CG1 3.45Å; E199-I263 HydrophobicContact CB-CD1 4.19Å; E199-V276 HydrophobicContact CG-CG1 4.27Å
200	E	93.2	Very high	90.6	Very high	104 Å²	104	63.7 Å²	63.7	49%	0.486	35%	0.351	S	S	.	.	H	α-helix	trans	-67.5	-49	171.3	-165.6	-162.6	131.4	0	0	110	N197 L198 I202 M203 K204	N197-E200 PolarHBondContact O-N 3.04Å; N197-E200 VanDerWaalsContact O-N 3.1Å; L198-E200 PolarHBondContact O-N 3.02Å; E200-I202 VanDerWaalsContact C-N 3.33Å; E200-I202 PolarHBondContact O-N 3.34Å; E200-M203 CarbonylContact O-C 3.54Å; E200-M203 PolarHBondContact O-N 2.78Å; E200-K204 WeakPolarHBondContact O-CB 3.39Å; E200-K204 PolarHBondContact O-N 2.76Å; E200-K204 WeakPolarHBondContact OE1-CD 3.39Å; E200-K204 WeakPolarHBondContact OE1-CE 3.45Å; E200-K204 IonicContact OE1-NZ 3.86Å; E200-K204 PolarHBondContact OE1-NZ 3.05Å
201	F	94.7	Very high	91.4	Very high	22 Å²	22	63.6 Å²	63.6	10%	0.096	35%	0.351	C	S	.	.	H	α-helix	trans	-57.6	-40.8	-175.6	-178.6	-91.7	0	0	0	113.2	I194 N197 L198 M203 F212 L235 L245	I194-F201 HydrophobicContact CD1-CE2 4.12Å; I194-F201 HydrophobicContact CD1-CZ 4.29Å; I194-F201 HydrophobicContact CG1-CD2 3.94Å; I194-F201 HydrophobicContact CG1-CE2 3.92Å; I194-F201 HydrophobicContact CG1-CG 4.44Å; I194-F201 HydrophobicContact CG1-CZ 4.4Å; I194-F201 HydrophobicContact CG2-CD1 3.9Å; I194-F201 HydrophobicContact CG2-CD2 4.34Å; I194-F201 HydrophobicContact CG2-CE1 4.15Å; I194-F201 HydrophobicContact CG2-CG 4.01Å; I194-F201 HydrophobicContact CG2-CZ 4.47Å; N197-F201 PolarHBondContact O-N 2.86Å; L198-F201 PolarHBondContact O-N 2.95Å; F201-M203 PolarHBondContact O-N 2.64Å; F201-F212 AromaticContact CE2-CE1 3.92Å; F201-F212 HydrophobicContact CE2-CE1 3.92Å; F201-F212 HydrophobicContact CE2-CZ 4.35Å; F201-F212 AromaticContact CZ-CD1 4Å; F201-F212 HydrophobicContact CZ-CD1 4Å; F201-F212 AromaticContact CZ-CE1 3.75Å; F201-F212 HydrophobicContact CZ-CE1 3.75Å; F201-F212 HydrophobicContact CZ-CZ 4.47Å; F201-L235 HydrophobicContact CZ-CD2 4.27Å; F201-L245 HydrophobicContact CD1-CD2 3.87Å; F201-L245 HydrophobicContact CE1-CD1 4.06Å; F201-L245 HydrophobicContact CE1-CD2 3.71Å
202	I	95.9	Very high	92	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-69.6	-21.1	178.4	60.1	148.5	0	0	0	113.6	L198 E199 E200 L246 I263 V276 C436 A437 L438	L198-I202 HydrophobicContact CD1-CG2 3.91Å; L198-I202 HydrophobicContact CG-CG2 4.45Å; L198-I202 WeakPolarHBondContact O-CG1 3.19Å; L198-I202 WeakPolarHBondContact O-CG2 3.34Å; L198-I202 PolarHBondContact O-N 3.34Å; E199-I202 VanDerWaalsContact O-CG1 3.24Å; E199-I202 WeakPolarHBondContact O-CG1 3.45Å; E200-I202 VanDerWaalsContact C-N 3.33Å; E200-I202 PolarHBondContact O-N 3.34Å; I202-L246 HydrophobicContact CB-CD2 4.22Å; I202-L246 HydrophobicContact CD1-CD2 3.78Å; I202-L246 HydrophobicContact CG2-CD1 4.31Å; I202-L246 HydrophobicContact CG2-CD2 3.8Å; I202-L246 HydrophobicContact CG2-CG 3.92Å; I202-I263 HydrophobicContact CD1-CG2 3.76Å; I202-I263 HydrophobicContact CG1-CG2 4.37Å; I202-I263 HydrophobicContact CG2-CG2 4.5Å; I202-V276 HydrophobicContact CD1-CB 3.71Å; I202-V276 HydrophobicContact CD1-CG1 3.81Å; I202-V276 HydrophobicContact CD1-CG2 3.67Å; I202-C436 VanDerWaalsContact O-CB 3.27Å; I202-C436 WeakPolarHBondContact O-CB 3.28Å; I202-C436 PolarHBondContact O-SG 2.71Å; I202-A437 HydrophobicContact CB-CB 4.43Å; I202-A437 HydrophobicContact CG2-CB 4.43Å; I202-A437 PolarHBondContact O-N 3.47Å; I202-L438 WeakPolarHBondContact O-CB 3.46Å; I202-L438 PolarHBondContact O-N 3.14Å
203	M	94.8	Very high	92.7	Very high	61 Å²	61	63.1 Å²	63.1	30%	0.3	34%	0.335	S	S	.	.	H	α-helix	trans	-98.7	-31.3	-177.9	-74.1	-63	-78.5	0	0	112.7	E200 F201 L311 R347 C436 L438	E200-M203 CarbonylContact O-C 3.54Å; E200-M203 PolarHBondContact O-N 2.78Å; F201-M203 PolarHBondContact O-N 2.64Å; M203-L311 HydrophobicContact CE-CD1 4.12Å; M203-L311 HydrophobicContact CE-CD2 4.07Å; M203-L311 HydrophobicContact SD-CD1 4.15Å; M203-R347 PolarHBondContact O-NH1 3.45Å; M203-C436 WeakPolarHBondContact O-CB 3.43Å; M203-L438 HydrophobicContact SD-CB 4.46Å; M203-L438 HydrophobicContact SD-CD2 3.58Å; M203-L438 VanDerWaalsContact SD-CD2 3.58Å
204	K	93.4	Very high	93.2	Very high	116 Å²	116	58.9 Å²	58.9	50%	0.504	32%	0.315	S	S	.	.	S	Bend	trans	-60.9	131.8	179.9	-159.2	169.5	-162	155.1	0	111.2	E200 C436	E200-K204 WeakPolarHBondContact O-CB 3.39Å; E200-K204 PolarHBondContact O-N 2.76Å; E200-K204 WeakPolarHBondContact OE1-CD 3.39Å; E200-K204 WeakPolarHBondContact OE1-CE 3.45Å; E200-K204 IonicContact OE1-NZ 3.86Å; E200-K204 PolarHBondContact OE1-NZ 3.05Å; K204-C436 WeakPolarHBondContact O-CA 3.3Å; K204-C436 WeakPolarHBondContact O-CB 3.1Å
205	P	94.5	Very high	93.7	Very high	26 Å²	26	61 Å²	61	17%	0.169	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-55.9	143.6	169.3	-20.6	31.2	0	0	0	110.9	I339 I345 Y433	P205-I339 HydrophobicContact CB-CD1 3.89Å; P205-I339 HydrophobicContact CG-CD1 3.72Å; P205-I345 HydrophobicContact CG-CG2 3.97Å; P205-Y433 HydrophobicContact CB-CD2 4.26Å; P205-Y433 HydrophobicContact CB-CE2 4.35Å
206	A	93.9	Very high	94.2	Very high	4 Å²	4	56.8 Å²	56.8	3%	0.033	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-58.2	143.2	169.9	0	0	0	0	0	110.8	F212 Y431 Y433 L435	A206-F212 HydrophobicContact CB-CD2 3.68Å; A206-F212 HydrophobicContact CB-CE2 3.71Å; A206-Y431 HydrophobicContact CB-CD2 4.05Å; A206-Y431 HydrophobicContact CB-CE2 3.88Å; A206-Y433 WeakPolarHBondContact O-CB 3.36Å; A206-Y433 WeakPolarHBondContact O-CD2 3.01Å; A206-L435 PolarHBondContact N-O 3.17Å
207	V	91.3	Very high	94.5	Very high	72 Å²	72	52 Å²	52	44%	0.436	28%	0.278	S	S	.	.	P	Polyproline II helix	trans	-62.9	137.8	178.6	-176.7	0	0	0	0	109.8	G209 V210	V207-G209 PolarHBondContact O-N 2.84Å; V207-V210 HydrophobicContact CB-CB 4.14Å; V207-V210 HydrophobicContact CB-CG2 3.9Å; V207-V210 HydrophobicContact CG1-CG2 4.16Å; V207-V210 WeakPolarHBondContact O-CB 3.5Å; V207-V210 PolarHBondContact O-N 2.8Å
208	K	90.6	Very high	94.7	Very high	85 Å²	85	49.2 Å²	49.2	37%	0.37	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	132.9	176.3	-67.1	-176	-179.6	-177.3	0	109.9	V210 D341 Y433	K208-V210 VanDerWaalsContact C-N 3.29Å; K208-V210 PolarHBondContact O-N 3.44Å; K208-D341 VanDerWaalsContact CE-OD2 3.31Å; K208-D341 WeakPolarHBondContact CE-OD2 3.27Å; K208-D341 IonicContact NZ-OD1 2.65Å; K208-D341 IonicContact NZ-OD2 3.66Å; K208-D341 PolarHBondContact NZ-OD2 3.12Å; K208-Y433 HydrophobicContact CG-CD1 4.07Å; K208-Y433 HydrophobicContact CG-CD2 3.91Å; K208-Y433 HydrophobicContact CG-CE1 4.45Å; K208-Y433 HydrophobicContact CG-CE2 4.31Å; K208-Y433 HydrophobicContact CG-CG 3.79Å
209	G	91.6	Very high	94.6	Very high	75 Å²	75	49.4 Å²	49.4	77%	0.773	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.8	-7.1	-174.3	0	0	0	0	0	116	V207	V207-G209 PolarHBondContact O-N 2.84Å
210	V	93.1	Very high	94.3	Very high	42 Å²	42	47.5 Å²	47.5	26%	0.255	25%	0.253	S	S	.	.			trans	-105.5	129.8	178.3	-177.1	0	0	0	0	110.8	V207 K208 F212	V207-V210 HydrophobicContact CB-CB 4.14Å; V207-V210 HydrophobicContact CB-CG2 3.9Å; V207-V210 HydrophobicContact CG1-CG2 4.16Å; V207-V210 WeakPolarHBondContact O-CB 3.5Å; V207-V210 PolarHBondContact O-N 2.8Å; K208-V210 VanDerWaalsContact C-N 3.29Å; K208-V210 PolarHBondContact O-N 3.44Å; V210-F212 HydrophobicContact CB-CE2 4.48Å; V210-F212 HydrophobicContact CG1-CD2 4.26Å; V210-F212 HydrophobicContact CG1-CE2 3.89Å; V210-F212 HydrophobicContact CG1-CZ 4.15Å
211	T	95.6	Very high	93.5	Very high	69 Å²	69	49.9 Å²	49.9	42%	0.423	26%	0.264	S	S	.	.			trans	-108.9	115.8	170.5	-57.9	0	0	0	0	110	D430 Y431 S432	T211-D430 HydrophobicContact CG2-CB 3.99Å; T211-Y431 CarbonylContact C-O 3.59Å; T211-Y431 WeakPolarHBondContact CA-O 3.19Å; T211-S432 PolarHBondContact OG1-OG 3.15Å
212	F	95.8	Very high	92.4	Very high	28 Å²	28	51.3 Å²	51.3	12%	0.123	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	121.6	174.5	-70.2	-90.3	0	0	0	109.7	F201 A206 V210 L235 D430 Y431	F201-F212 AromaticContact CE2-CE1 3.92Å; F201-F212 HydrophobicContact CE2-CE1 3.92Å; F201-F212 HydrophobicContact CE2-CZ 4.35Å; F201-F212 AromaticContact CZ-CD1 4Å; F201-F212 HydrophobicContact CZ-CD1 4Å; F201-F212 AromaticContact CZ-CE1 3.75Å; F201-F212 HydrophobicContact CZ-CE1 3.75Å; F201-F212 HydrophobicContact CZ-CZ 4.47Å; A206-F212 HydrophobicContact CB-CD2 3.68Å; A206-F212 HydrophobicContact CB-CE2 3.71Å; V210-F212 HydrophobicContact CB-CE2 4.48Å; V210-F212 HydrophobicContact CG1-CD2 4.26Å; V210-F212 HydrophobicContact CG1-CE2 3.89Å; V210-F212 HydrophobicContact CG1-CZ 4.15Å; F212-L235 HydrophobicContact CB-CD1 4.09Å; F212-L235 HydrophobicContact CD1-CD1 3.9Å; F212-L235 HydrophobicContact CD1-CD2 4.45Å; F212-D430 VanDerWaalsContact O-CA 3.3Å; F212-D430 WeakPolarHBondContact O-CA 3.35Å; F212-Y431 HydrophobicContact CB-CD1 3.98Å; F212-Y431 HydrophobicContact CB-CE1 3.49Å; F212-Y431 VanDerWaalsContact CB-CE1 3.49Å; F212-Y431 HydrophobicContact CB-CE2 4.25Å; F212-Y431 HydrophobicContact CD2-CE2 4.04Å; F212-Y431 HydrophobicContact CG-CE1 4.28Å; F212-Y431 HydrophobicContact CG-CE2 4.37Å; F212-Y431 AromaticContact CG-CZ 3.9Å; F212-Y431 PolarHBondContact N-O 3.03Å; F212-Y431 PolarHBondContact O-N 3.14Å
213	K	96.7	Very high	91	Very high	93 Å²	93	59.7 Å²	59.7	40%	0.404	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	110.6	-179.6	-66.9	168.2	-170.7	161.3	0	109.8	E236 D430	K213-E236 WeakPolarHBondContact O-CB 3.42Å; K213-E236 PolarHBondContact O-N 2.88Å; K213-D430 WeakPolarHBondContact CA-OD1 3.33Å
214	C	97.7	Very high	90	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	165.1	-179.4	-57.3	0	0	0	0	112.5	L233 H234 R395 M429	C214-L233 HydrophobicContact CB-CD1 3.64Å; C214-L233 HydrophobicContact CB-CG 4.43Å; C214-H234 CarbonylContact C-O 3.23Å; C214-H234 WeakPolarHBondContact CA-O 3.24Å; C214-H234 WeakPolarHBondContact CB-O 3.36Å; C214-R395 PolarHBondContact O-NH2 3.11Å; C214-R395 VanDerWaalsContact O-NH2 3.08Å; C214-M429 CarbonylContact C-O 3.51Å; C214-M429 VanDerWaalsContact CA-O 3.24Å; C214-M429 WeakPolarHBondContact CA-O 3.17Å; C214-M429 HydrophobicContact CB-CE 4.28Å; C214-M429 WeakPolarHBondContact CB-O 3.11Å; C214-M429 PolarHBondContact N-O 3.27Å; C214-M429 PolarHBondContact O-N 2.65Å
215	R	97.4	Very high	88.8	Confident	47 Å²	47	58.6 Å²	58.6	18%	0.177	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	129.1	177	172.3	169.4	-98.4	146.4	-13.4	109.9	H234 E236 I426 F427	R215-H234 PolarHBondContact N-O 3.5Å; R215-H234 PolarHBondContact O-N 3.08Å; R215-E236 HydrophobicContact CB-CG 3.91Å; R215-E236 WeakPolarHBondContact CD-OE1 3.21Å; R215-E236 IonicContact CZ-OE1 2.67Å; R215-E236 IonicContact NE-OE1 3.45Å; R215-E236 IonicContact NH1-OE1 3.59Å; R215-E236 PolarHBondContact NH1-OE1 3.25Å; R215-E236 IonicContact NH1-OE2 3.34Å; R215-I426 HydrophobicContact CG-CG2 3.78Å; R215-F427 CarbonylContact C-O 3.52Å; R215-F427 WeakPolarHBondContact CA-O 3.21Å
216	I	97.9	Very high	87.8	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	127.8	174.6	-64.8	170.2	0	0	0	108.5	Y231 F232 L233 F419 I426 F427 M429 F441 A444 F448	I216-Y231 HydrophobicContact CG2-CD1 4.04Å; I216-F232 WeakPolarHBondContact CA-O 3.39Å; I216-L233 HydrophobicContact CD1-CD1 4.27Å; I216-L233 HydrophobicContact CG1-CD1 3.59Å; I216-F419 HydrophobicContact CD1-CD2 4.5Å; I216-F419 HydrophobicContact CD1-CE2 4.07Å; I216-I426 WeakPolarHBondContact O-CA 3.4Å; I216-F427 HydrophobicContact CB-CB 4.38Å; I216-F427 PolarHBondContact N-O 3.17Å; I216-F427 PolarHBondContact O-N 2.83Å; I216-M429 HydrophobicContact CD1-CB 3.94Å; I216-M429 HydrophobicContact CD1-CG 4.31Å; I216-M429 HydrophobicContact CD1-SD 3.85Å; I216-M429 HydrophobicContact CG1-CB 4.29Å; I216-F441 HydrophobicContact CD1-CD2 3.72Å; I216-F441 HydrophobicContact CD1-CE2 3.88Å; I216-F441 HydrophobicContact CG1-CD2 4.16Å; I216-F441 HydrophobicContact CG1-CE2 4.01Å; I216-F441 HydrophobicContact CG2-CE2 4.26Å; I216-A444 HydrophobicContact CD1-CB 3.71Å; I216-F448 HydrophobicContact CG2-CE2 4.26Å; I216-F448 HydrophobicContact CG2-CZ 4.17Å
217	T	97.1	Very high	87.2	Confident	45 Å²	45	66.3 Å²	66.3	28%	0.276	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	130.8	172.7	-52.6	0	0	0	0	109.9	Y231 F232 N425	T217-Y231 WeakPolarHBondContact O-CA 3.39Å; T217-F232 PolarHBondContact N-O 2.68Å; T217-F232 PolarHBondContact O-N 2.95Å; T217-N425 CarbonylContact C-O 3.57Å; T217-N425 WeakPolarHBondContact CA-O 3.45Å
218	R	95.2	Very high	87.1	Confident	23 Å²	23	66 Å²	66	9%	0.087	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	105.6	178.4	177.4	170.2	76.1	162.3	-3.3	110.2	E158 K220 P229 Y231 D424 N425 F427	E158-R218 IonicContact OE2-CZ 2.78Å; E158-R218 IonicContact OE2-NH1 3.44Å; E158-R218 PolarHBondContact OE2-NH1 2.91Å; E158-R218 IonicContact OE2-NH2 3.12Å; E158-R218 PolarHBondContact OE2-NH2 2.9Å; R218-K220 HydrophobicContact CG-CG 4.43Å; R218-P229 HydrophobicContact CG-CB 4.11Å; R218-Y231 HydrophobicContact CB-CD1 4.05Å; R218-Y231 HydrophobicContact CB-CE1 3.84Å; R218-Y231 WeakPolarHBondContact CD-OH 3.49Å; R218-Y231 HydrophobicContact CG-CD1 4.25Å; R218-Y231 HydrophobicContact CG-CE1 3.65Å; R218-D424 PolarHBondContact NE-O 3.38Å; R218-D424 PolarHBondContact NH2-O 2.84Å; R218-N425 HydrophobicContact CB-CB 4.17Å; R218-N425 PolarHBondContact N-O 2.98Å; R218-N425 PolarHBondContact NE-OD1 2.92Å; R218-N425 WeakPolarHBondContact O-CB 3.46Å; R218-N425 PolarHBondContact O-OD1 2.93Å; R218-F427 HydrophobicContact CB-CE2 4.13Å
219	D	93.3	Very high	87.2	Confident	28 Å²	28	62.5 Å²	62.5	15%	0.15	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	120.7	176.2	169.9	33	0	0	0	111.9	H221 R225 P229 T230 F232	D219-H221 WeakPolarHBondContact OD1-CB 3.38Å; D219-H221 IonicContact OD1-CD2 3.17Å; D219-H221 PolarHBondContact OD1-CD2 2.85Å; D219-H221 IonicContact OD1-CG 3.57Å; D219-H221 PolarHBondContact OD1-N 2.9Å; D219-R225 WeakPolarHBondContact OD2-CD 3.46Å; D219-R225 IonicContact OD2-CZ 3.05Å; D219-R225 IonicContact OD2-NE 2.86Å; D219-R225 IonicContact OD2-NH1 3.55Å; D219-R225 PolarHBondContact OD2-NH1 3.16Å; D219-P229 WeakPolarHBondContact O-CA 3.48Å; D219-P229 WeakPolarHBondContact O-CB 3.47Å; D219-T230 PolarHBondContact N-O 3.48Å; D219-T230 PolarHBondContact O-N 2.91Å; D219-F232 HydrophobicContact CB-CD2 4.35Å; D219-F232 HydrophobicContact CB-CE2 3.79Å
220	K	87.5	Confident	87.3	Confident	58 Å²	58	59 Å²	59	25%	0.252	30%	0.3	S	S	.	.			trans	-107	8.5	176.7	-63.8	-168.7	179.9	-171.9	0	113.9	E158 R218 R225 P229	E158-K220 IonicContact OE2-NZ 3.66Å; R218-K220 HydrophobicContact CG-CG 4.43Å; K220-R225 CarbonylContact O-C 3.49Å; K220-R225 WeakPolarHBondContact O-CB 3.41Å; K220-P229 HydrophobicContact CG-CB 4.24Å
221	H	76.2	Confident	87.5	Confident	154 Å²	154	57.4 Å²	57.4	71%	0.713	29%	0.289	S	S	*	.			trans	-79.6	128.2	-170	-67.4	-70.3	0	0	0	115.2	D219 R225	D219-H221 WeakPolarHBondContact OD1-CB 3.38Å; D219-H221 IonicContact OD1-CD2 3.17Å; D219-H221 PolarHBondContact OD1-CD2 2.85Å; D219-H221 IonicContact OD1-CG 3.57Å; D219-H221 PolarHBondContact OD1-N 2.9Å; H221-R225 WeakPolarHBondContact O-CB 3.34Å; H221-R225 WeakPolarHBondContact O-CD 3.07Å; H221-R225 VanDerWaalsContact O-CG 3.27Å; H221-R225 WeakPolarHBondContact O-CG 3.15Å; H221-R225 PolarHBondContact O-NE 2.87Å
222	G	71.1	Confident	87.6	Confident	51 Å²	51	55.8 Å²	55.8	53%	0.526	28%	0.276	S	S	.	.	S	Bend	trans	102.1	158.6	176.9	0	0	0	0	0	113.6	D224 R225	G222-D224 VanDerWaalsContact C-N 3.26Å; G222-D224 PolarHBondContact O-N 2.9Å; G222-R225 PolarHBondContact O-N 2.89Å
223	L	67.4	Low	87.7	Confident	176 Å²	176	54.4 Å²	54.4	92%	0.921	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43.9	-37.4	-160	-113.4	74.5	0	0	0	117.1
224	D	72	Confident	87.8	Confident	75 Å²	75	52.1 Å²	52.1	40%	0.401	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.6	-6.6	-178.9	-56.7	-94.1	0	0	0	114.9	G222 N226 F227 Y228 K252	G222-D224 VanDerWaalsContact C-N 3.26Å; G222-D224 PolarHBondContact O-N 2.9Å; D224-N226 PolarHBondContact O-N 2.84Å; D224-F227 PolarHBondContact O-N 2.82Å; D224-Y228 PolarHBondContact O-N 3.08Å; D224-K252 WeakPolarHBondContact OD1-CE 3.45Å; D224-K252 IonicContact OD1-NZ 2.74Å; D224-K252 PolarHBondContact OD1-NZ 3.21Å; D224-K252 IonicContact OD2-NZ 2.8Å; D224-K252 PolarHBondContact OD2-NZ 2.88Å
225	R	69.9	Low	87.7	Confident	80 Å²	80	52.5 Å²	52.5	30%	0.302	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-8.8	-172.1	-68.9	-159.6	-147.7	-153.7	-3.2	113.4	D219 K220 H221 G222 P229 T230	D219-R225 WeakPolarHBondContact OD2-CD 3.46Å; D219-R225 IonicContact OD2-CZ 3.05Å; D219-R225 IonicContact OD2-NE 2.86Å; D219-R225 IonicContact OD2-NH1 3.55Å; D219-R225 PolarHBondContact OD2-NH1 3.16Å; K220-R225 CarbonylContact O-C 3.49Å; K220-R225 WeakPolarHBondContact O-CB 3.41Å; H221-R225 WeakPolarHBondContact O-CB 3.34Å; H221-R225 WeakPolarHBondContact O-CD 3.07Å; H221-R225 VanDerWaalsContact O-CG 3.27Å; H221-R225 WeakPolarHBondContact O-CG 3.15Å; H221-R225 PolarHBondContact O-NE 2.87Å; G222-R225 PolarHBondContact O-N 2.89Å; R225-P229 VanDerWaalsContact O-CA 3.24Å; R225-P229 WeakPolarHBondContact O-CA 3.31Å; R225-P229 WeakPolarHBondContact O-CB 3.39Å; R225-P229 WeakPolarHBondContact O-CD 3.21Å; R225-P229 VanDerWaalsContact O-N 3.14Å; R225-T230 PolarHBondContact NH1-OG1 3.38Å
226	N	73.5	Confident	87.6	Confident	101 Å²	101	51.9 Å²	51.9	54%	0.54	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-47.6	164.9	-71.2	73	0	0	0	112.1	D224	D224-N226 PolarHBondContact O-N 2.84Å
227	F	80.7	Confident	87.2	Confident	90 Å²	90	54.3 Å²	54.3	40%	0.395	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-28.5	-178.6	-58	-84.2	0	0	0	113.3	D224 P229	D224-F227 PolarHBondContact O-N 2.82Å; F227-P229 WeakPolarHBondContact O-CD 3.12Å
228	Y	88.2	Confident	86.7	Confident	67 Å²	67	60.7 Å²	60.7	26%	0.263	30%	0.299	S	S	.	.	S	Bend	trans	-126.1	63.9	-179.6	-57.1	-77.9	0	0	0	110.5	D224 R249 K250 K252	D224-Y228 PolarHBondContact O-N 3.08Å; Y228-R249 PolarHBondContact O-NE 2.81Å; Y228-R249 PolarHBondContact O-NH2 3.25Å; Y228-K250 HydrophobicContact CD1-CB 4.2Å; Y228-K250 HydrophobicContact CD1-CG 4.26Å; Y228-K250 WeakPolarHBondContact CD1-O 3.36Å; Y228-K250 HydrophobicContact CE1-CG 4.49Å; Y228-K252 HydrophobicContact CD1-CG 4.27Å; Y228-K252 HydrophobicContact CD2-CD 4.43Å; Y228-K252 HydrophobicContact CD2-CG 3.82Å; Y228-K252 HydrophobicContact CE1-CG 4.32Å; Y228-K252 HydrophobicContact CE2-CD 4.49Å; Y228-K252 HydrophobicContact CE2-CG 3.87Å; Y228-K252 HydrophobicContact CG-CG 4.02Å
229	P	92.7	Very high	86.3	Confident	11 Å²	11	64.9 Å²	64.9	7%	0.071	32%	0.323	C	S	.	.			trans	-64.7	154.7	178.4	26.1	-34	0	0	0	111.9	R218 D219 K220 R225 F227 Y231	R218-P229 HydrophobicContact CG-CB 4.11Å; D219-P229 WeakPolarHBondContact O-CA 3.48Å; D219-P229 WeakPolarHBondContact O-CB 3.47Å; K220-P229 HydrophobicContact CG-CB 4.24Å; R225-P229 VanDerWaalsContact O-CA 3.24Å; R225-P229 WeakPolarHBondContact O-CA 3.31Å; R225-P229 WeakPolarHBondContact O-CB 3.39Å; R225-P229 WeakPolarHBondContact O-CD 3.21Å; R225-P229 VanDerWaalsContact O-N 3.14Å; F227-P229 WeakPolarHBondContact O-CD 3.12Å; P229-Y231 HydrophobicContact CB-CE2 4.34Å; P229-Y231 HydrophobicContact CG-CE2 3.83Å
230	T	94.8	Very high	85.9	Confident	2 Å²	2	66.4 Å²	66.4	1%	0.012	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	135.8	171.9	-51.1	0	0	0	0	109	D219 R225 F232 L268	D219-T230 PolarHBondContact N-O 3.48Å; D219-T230 PolarHBondContact O-N 2.91Å; R225-T230 PolarHBondContact NH1-OG1 3.38Å; T230-F232 HydrophobicContact CG2-CD1 4.4Å; T230-F232 HydrophobicContact CG2-CD2 4.27Å; T230-F232 HydrophobicContact CG2-CE1 3.79Å; T230-F232 HydrophobicContact CG2-CE2 3.66Å; T230-F232 HydrophobicContact CG2-CZ 3.39Å; T230-L268 HydrophobicContact CG2-CD1 3.6Å
231	Y	97.1	Very high	86	Confident	7 Å²	7	69.4 Å²	69.4	3%	0.027	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	131.6	177	-64.5	-91.9	0	0	0	109.1	I216 T217 R218 P229 A247 A248 Y259 L445 F448	I216-Y231 HydrophobicContact CG2-CD1 4.04Å; T217-Y231 WeakPolarHBondContact O-CA 3.39Å; R218-Y231 HydrophobicContact CB-CD1 4.05Å; R218-Y231 HydrophobicContact CB-CE1 3.84Å; R218-Y231 WeakPolarHBondContact CD-OH 3.49Å; R218-Y231 HydrophobicContact CG-CD1 4.25Å; R218-Y231 HydrophobicContact CG-CE1 3.65Å; P229-Y231 HydrophobicContact CB-CE2 4.34Å; P229-Y231 HydrophobicContact CG-CE2 3.83Å; Y231-A247 CarbonylContact O-C 3.46Å; Y231-A247 VanDerWaalsContact O-CA 3.3Å; Y231-A247 WeakPolarHBondContact O-CA 3.06Å; Y231-A248 PolarHBondContact N-O 2.96Å; Y231-A248 PolarHBondContact O-N 2.85Å; Y231-Y259 HydrophobicContact CD2-CE1 4.29Å; Y231-Y259 HydrophobicContact CE2-CE1 4.01Å; Y231-L445 HydrophobicContact CD1-CD2 4.44Å; Y231-L445 HydrophobicContact CD2-CD2 3.81Å; Y231-L445 HydrophobicContact CE2-CD2 4.45Å; Y231-L445 HydrophobicContact CG-CD2 3.8Å; Y231-F448 AromaticContact CD1-CD2 3.73Å; Y231-F448 HydrophobicContact CD1-CD2 3.73Å; Y231-F448 AromaticContact CD1-CE2 3.44Å; Y231-F448 HydrophobicContact CD1-CE2 3.44Å; Y231-F448 VanDerWaalsContact CD1-CE2 3.44Å; Y231-F448 AromaticContact CD1-CZ 3.99Å; Y231-F448 HydrophobicContact CD1-CZ 3.99Å; Y231-F448 HydrophobicContact CE1-CB 4.36Å; Y231-F448 HydrophobicContact CE1-CD1 4.04Å; Y231-F448 AromaticContact CE1-CD2 3.26Å; Y231-F448 HydrophobicContact CE1-CD2 3.26Å; Y231-F448 HydrophobicContact CE1-CE1 4.1Å; Y231-F448 AromaticContact CE1-CE2 3.36Å; Y231-F448 HydrophobicContact CE1-CE2 3.36Å; Y231-F448 AromaticContact CE1-CG 3.65Å; Y231-F448 HydrophobicContact CE1-CG 3.65Å; Y231-F448 AromaticContact CE1-CZ 3.78Å; Y231-F448 HydrophobicContact CE1-CZ 3.78Å; Y231-F448 HydrophobicContact CE2-CD2 4.41Å; Y231-F448 HydrophobicContact CG-CD2 4.47Å; Y231-F448 HydrophobicContact CG-CE2 4.34Å; Y231-F448 AromaticContact CZ-CD2 3.67Å; Y231-F448 AromaticContact CZ-CG 3.86Å
232	F	98	Very high	86.8	Confident	35 Å²	35	68.6 Å²	68.6	15%	0.154	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	114.5	179.8	-58	-85.1	0	0	0	110.7	I216 T217 D219 T230 H234 F244 A247 P265	I216-F232 WeakPolarHBondContact CA-O 3.39Å; T217-F232 PolarHBondContact N-O 2.68Å; T217-F232 PolarHBondContact O-N 2.95Å; D219-F232 HydrophobicContact CB-CD2 4.35Å; D219-F232 HydrophobicContact CB-CE2 3.79Å; T230-F232 HydrophobicContact CG2-CD1 4.4Å; T230-F232 HydrophobicContact CG2-CD2 4.27Å; T230-F232 HydrophobicContact CG2-CE1 3.79Å; T230-F232 HydrophobicContact CG2-CE2 3.66Å; T230-F232 HydrophobicContact CG2-CZ 3.39Å; F232-H234 PolarHBondContact O-ND1 2.86Å; F232-F244 HydrophobicContact CB-CE2 4.47Å; F232-F244 AromaticContact CD1-CE2 3.99Å; F232-F244 HydrophobicContact CD1-CE2 3.99Å; F232-A247 HydrophobicContact CD1-CB 3.83Å; F232-A247 HydrophobicContact CE1-CB 4.03Å; F232-P265 HydrophobicContact CD1-CB 4.23Å; F232-P265 HydrophobicContact CE1-CB 3.94Å
233	L	98.3	Very high	87.9	Confident	0 Å²	0	66.7 Å²	66.7	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	131	173.5	-177.9	71	0	0	0	110.5	C214 I216 L245 L246 M429 A437 F441	C214-L233 HydrophobicContact CB-CD1 3.64Å; C214-L233 HydrophobicContact CB-CG 4.43Å; I216-L233 HydrophobicContact CD1-CD1 4.27Å; I216-L233 HydrophobicContact CG1-CD1 3.59Å; L233-L245 HydrophobicContact CD2-CB 4.05Å; L233-L245 HydrophobicContact CD2-CD1 3.97Å; L233-L245 HydrophobicContact CG-CB 4.28Å; L233-L245 HydrophobicContact CG-CD1 4.32Å; L233-L245 PolarHBondContact O-N 3.3Å; L233-L246 HydrophobicContact CB-CB 4.13Å; L233-L246 HydrophobicContact CD2-CB 4.31Å; L233-L246 HydrophobicContact CD2-CD1 4.04Å; L233-L246 HydrophobicContact CD2-CG 4.39Å; L233-L246 PolarHBondContact N-O 3.03Å; L233-L246 PolarHBondContact O-N 3.34Å; L233-M429 HydrophobicContact CD1-CE 3.63Å; L233-M429 HydrophobicContact CD1-SD 4.09Å; L233-M429 HydrophobicContact CD2-CE 4.12Å; L233-A437 HydrophobicContact CD2-CB 4.31Å; L233-F441 HydrophobicContact CB-CD1 4.44Å; L233-F441 HydrophobicContact CB-CD2 4.14Å; L233-F441 HydrophobicContact CB-CE1 4.33Å; L233-F441 HydrophobicContact CB-CE2 4.05Å; L233-F441 HydrophobicContact CB-CG 4.35Å; L233-F441 HydrophobicContact CB-CZ 4.13Å; L233-F441 HydrophobicContact CD1-CD2 4.46Å; L233-F441 HydrophobicContact CD2-CB 4.12Å; L233-F441 HydrophobicContact CD2-CG 4.22Å
234	H	97.9	Very high	89.3	Confident	45 Å²	45	60.5 Å²	60.5	21%	0.208	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	138.1	171.5	-57.9	74.7	0	0	0	111	C214 R215 F232 R242 I243	C214-H234 CarbonylContact C-O 3.23Å; C214-H234 WeakPolarHBondContact CA-O 3.24Å; C214-H234 WeakPolarHBondContact CB-O 3.36Å; R215-H234 PolarHBondContact N-O 3.5Å; R215-H234 PolarHBondContact O-N 3.08Å; F232-H234 PolarHBondContact O-ND1 2.86Å; H234-R242 HydrophobicContact CB-CB 4.16Å; H234-I243 CarbonylContact C-O 3.57Å; H234-I243 WeakPolarHBondContact CA-O 3.21Å; H234-I243 WeakPolarHBondContact CB-O 3.17Å
235	L	96.6	Very high	90.5	Very high	8 Å²	8	57 Å²	57	4%	0.042	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	134.9	164.4	-177	64.5	0	0	0	109.5	I194 F201 F212 R242 I243 L245	I194-L235 HydrophobicContact CD1-CD2 3.87Å; F201-L235 HydrophobicContact CZ-CD2 4.27Å; F212-L235 HydrophobicContact CB-CD1 4.09Å; F212-L235 HydrophobicContact CD1-CD1 3.9Å; F212-L235 HydrophobicContact CD1-CD2 4.45Å; L235-R242 CarbonylContact O-C 3.58Å; L235-R242 VanDerWaalsContact O-CA 3.28Å; L235-R242 WeakPolarHBondContact O-CA 3.41Å; L235-I243 HydrophobicContact CB-CB 4.39Å; L235-I243 PolarHBondContact N-O 2.96Å; L235-I243 PolarHBondContact O-N 2.68Å; L235-L245 HydrophobicContact CB-CD1 4.03Å; L235-L245 HydrophobicContact CB-CD2 4.44Å; L235-L245 HydrophobicContact CB-CG 4.22Å
236	E	94.6	Very high	91.9	Very high	33 Å²	33	53.1 Å²	53.1	15%	0.154	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	121.2	174.6	-51.6	-162.6	110.3	0	0	109.7	K213 R215 R242 R395	K213-E236 WeakPolarHBondContact O-CB 3.42Å; K213-E236 PolarHBondContact O-N 2.88Å; R215-E236 HydrophobicContact CB-CG 3.91Å; R215-E236 WeakPolarHBondContact CD-OE1 3.21Å; R215-E236 IonicContact CZ-OE1 2.67Å; R215-E236 IonicContact NE-OE1 3.45Å; R215-E236 IonicContact NH1-OE1 3.59Å; R215-E236 PolarHBondContact NH1-OE1 3.25Å; R215-E236 IonicContact NH1-OE2 3.34Å; E236-R242 IonicContact OE1-NE 3.46Å; E236-R395 IonicContact OE2-CZ 3.97Å; E236-R395 IonicContact OE2-NH1 3.92Å; E236-R395 PolarHBondContact OE2-NH1 2.84Å; E236-R395 IonicContact OE2-NH2 3.76Å; E236-R395 PolarHBondContact OE2-NH2 2.9Å; E236-R395 VanDerWaalsContact OE2-NH2 3.12Å
237	K	90.5	Very high	93.1	Very high	51 Å²	51	48.3 Å²	48.3	22%	0.222	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-96.4	157.6	172	-73.4	-162.8	167.3	-174	0	111	V189 T190 V191 D239 G240 K241 I243	V189-K237 PolarHBondContact O-NZ 2.9Å; T190-K237 PolarHBondContact O-NZ 3.49Å; V191-K237 HydrophobicContact CG2-CD 4.19Å; K237-D239 PolarHBondContact O-N 3.13Å; K237-G240 PolarHBondContact O-N 3.5Å; K237-K241 PolarHBondContact N-O 2.83Å; K237-I243 HydrophobicContact CD-CD1 4Å; K237-I243 HydrophobicContact CG-CD1 4.44Å
238	E	85.7	Confident	93.8	Very high	180 Å²	180	44 Å²	44	84%	0.841	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-27.8	-174.3	-53.4	-164.4	140.4	0	0	112.5	G240	E238-G240 PolarHBondContact O-N 2.86Å
239	D	86.4	Confident	94.2	Very high	110 Å²	110	44 Å²	44	59%	0.588	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-6.7	165.2	-63	14.5	0	0	0	115.2	K237 K241	K237-D239 PolarHBondContact O-N 3.13Å; D239-K241 HydrophobicContact CB-CB 4.25Å; D239-K241 HydrophobicContact CB-CD 3.96Å; D239-K241 HydrophobicContact CB-CG 3.92Å; D239-K241 PolarHBondContact O-N 2.69Å; D239-K241 WeakPolarHBondContact OD2-CE 3.4Å; D239-K241 IonicContact OD2-NZ 2.65Å; D239-K241 PolarHBondContact OD2-NZ 2.69Å
240	G	85.8	Confident	94.2	Very high	60 Å²	60	46 Å²	46	62%	0.619	22%	0.222	S	C	*	.	S	Bend	trans	75.6	-8.1	-169	0	0	0	0	0	114.4	K237 E238	K237-G240 PolarHBondContact O-N 3.5Å; E238-G240 PolarHBondContact O-N 2.86Å
241	K	89.6	Confident	94.1	Very high	121 Å²	121	50.5 Å²	50.5	53%	0.526	24%	0.238	S	C	.	.			trans	-64.2	149.2	173.4	-65.9	172.3	-170.5	149.7	0	110.9	K237 D239	K237-K241 PolarHBondContact N-O 2.83Å; D239-K241 HydrophobicContact CB-CB 4.25Å; D239-K241 HydrophobicContact CB-CD 3.96Å; D239-K241 HydrophobicContact CB-CG 3.92Å; D239-K241 PolarHBondContact O-N 2.69Å; D239-K241 WeakPolarHBondContact OD2-CE 3.4Å; D239-K241 IonicContact OD2-NZ 2.65Å; D239-K241 PolarHBondContact OD2-NZ 2.69Å
242	R	92.4	Very high	93.6	Very high	137 Å²	137	54.5 Å²	54.5	52%	0.517	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	136.5	175.7	-63.7	-175.9	-171.4	145.8	9.4	110.4	H234 L235 E236	H234-R242 HydrophobicContact CB-CB 4.16Å; L235-R242 CarbonylContact O-C 3.58Å; L235-R242 VanDerWaalsContact O-CA 3.28Å; L235-R242 WeakPolarHBondContact O-CA 3.41Å; E236-R242 IonicContact OE1-NE 3.46Å
243	I	95	Very high	93.1	Very high	12 Å²	12	63 Å²	63	6%	0.062	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	123.7	175.3	-54.4	174.1	0	0	0	107	V191 I194 V195 H234 L235 K237	V191-I243 HydrophobicContact CB-CD1 4.31Å; V191-I243 HydrophobicContact CG1-CD1 3.92Å; V191-I243 HydrophobicContact CG1-CG1 4.2Å; V191-I243 HydrophobicContact CG2-CD1 4.21Å; I194-I243 HydrophobicContact CD1-CD1 4.16Å; I194-I243 HydrophobicContact CG2-CG2 4.19Å; V195-I243 HydrophobicContact CG2-CG2 4.04Å; H234-I243 CarbonylContact C-O 3.57Å; H234-I243 WeakPolarHBondContact CA-O 3.21Å; H234-I243 WeakPolarHBondContact CB-O 3.17Å; L235-I243 HydrophobicContact CB-CB 4.39Å; L235-I243 PolarHBondContact N-O 2.96Å; L235-I243 PolarHBondContact O-N 2.68Å; K237-I243 HydrophobicContact CD-CD1 4Å; K237-I243 HydrophobicContact CG-CD1 4.44Å
244	F	96.6	Very high	92.7	Very high	46 Å²	46	64.9 Å²	64.9	20%	0.202	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	138.2	173.5	170.4	-100.6	0	0	0	110.3	F232 L246 A247 I263 P265	F232-F244 HydrophobicContact CB-CE2 4.47Å; F232-F244 AromaticContact CD1-CE2 3.99Å; F232-F244 HydrophobicContact CD1-CE2 3.99Å; F244-L246 VanDerWaalsContact CE2-O 3.32Å; F244-L246 WeakPolarHBondContact CE2-O 3.24Å; F244-A247 HydrophobicContact CE2-CB 4.03Å; F244-A247 HydrophobicContact CZ-CB 3.8Å; F244-I263 WeakPolarHBondContact CE1-O 3.4Å; F244-P265 HydrophobicContact CD1-CG 4.45Å; F244-P265 HydrophobicContact CE1-CB 4.1Å; F244-P265 HydrophobicContact CE1-CG 4.14Å; F244-P265 HydrophobicContact CE2-CB 4Å; F244-P265 HydrophobicContact CZ-CB 3.76Å; F244-P265 HydrophobicContact CZ-CG 4.31Å
245	L	97.5	Very high	92.3	Very high	0 Å²	0	68 Å²	68	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	-51.8	179.2	-64.9	-176.1	0	0	0	113.3	I194 L198 F201 L233 L235 A437	I194-L245 HydrophobicContact CG2-CD2 4.01Å; L198-L245 HydrophobicContact CD1-CD2 3.79Å; F201-L245 HydrophobicContact CD1-CD2 3.87Å; F201-L245 HydrophobicContact CE1-CD1 4.06Å; F201-L245 HydrophobicContact CE1-CD2 3.71Å; L233-L245 HydrophobicContact CD2-CB 4.05Å; L233-L245 HydrophobicContact CD2-CD1 3.97Å; L233-L245 HydrophobicContact CG-CB 4.28Å; L233-L245 HydrophobicContact CG-CD1 4.32Å; L233-L245 PolarHBondContact O-N 3.3Å; L235-L245 HydrophobicContact CB-CD1 4.03Å; L235-L245 HydrophobicContact CB-CD2 4.44Å; L235-L245 HydrophobicContact CB-CG 4.22Å; L245-A437 HydrophobicContact CD1-CB 4.19Å
246	L	98.3	Very high	92.1	Very high	0 Å²	0	68.8 Å²	68.8	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	138.9	-170.4	-66.3	172.3	0	0	0	110.8	I202 L233 F244 I261 S262 I263 V276 L438 F441	I202-L246 HydrophobicContact CB-CD2 4.22Å; I202-L246 HydrophobicContact CD1-CD2 3.78Å; I202-L246 HydrophobicContact CG2-CD1 4.31Å; I202-L246 HydrophobicContact CG2-CD2 3.8Å; I202-L246 HydrophobicContact CG2-CG 3.92Å; L233-L246 HydrophobicContact CB-CB 4.13Å; L233-L246 HydrophobicContact CD2-CB 4.31Å; L233-L246 HydrophobicContact CD2-CD1 4.04Å; L233-L246 HydrophobicContact CD2-CG 4.39Å; L233-L246 PolarHBondContact N-O 3.03Å; L233-L246 PolarHBondContact O-N 3.34Å; F244-L246 VanDerWaalsContact CE2-O 3.32Å; F244-L246 WeakPolarHBondContact CE2-O 3.24Å; L246-I261 HydrophobicContact CB-CG2 4.2Å; L246-I261 HydrophobicContact CD1-CG2 4.33Å; L246-I261 HydrophobicContact CD2-CG2 4.04Å; L246-I261 HydrophobicContact CG-CG2 4.44Å; L246-S262 WeakPolarHBondContact CA-O 3.38Å; L246-I263 HydrophobicContact CD2-CG2 3.88Å; L246-V276 HydrophobicContact CD2-CG2 3.88Å; L246-L438 HydrophobicContact CD1-CB 4.26Å; L246-L438 HydrophobicContact CD1-CD1 3.98Å; L246-L438 HydrophobicContact CD2-CD1 4.47Å; L246-F441 HydrophobicContact CB-CD1 3.6Å; L246-F441 HydrophobicContact CB-CE1 3.62Å; L246-F441 HydrophobicContact CD1-CB 4.06Å; L246-F441 HydrophobicContact CD1-CD1 3.7Å; L246-F441 HydrophobicContact CD1-CG 4.28Å; L246-F441 HydrophobicContact CG-CD1 4.29Å
247	A	97.8	Very high	92.1	Very high	0 Å²	0	67.8 Å²	67.8	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	146.6	165.2	0	0	0	0	0	109.7	Y231 F232 F244 I261 S262 L268	Y231-A247 CarbonylContact O-C 3.46Å; Y231-A247 VanDerWaalsContact O-CA 3.3Å; Y231-A247 WeakPolarHBondContact O-CA 3.06Å; F232-A247 HydrophobicContact CD1-CB 3.83Å; F232-A247 HydrophobicContact CE1-CB 4.03Å; F244-A247 HydrophobicContact CE2-CB 4.03Å; F244-A247 HydrophobicContact CZ-CB 3.8Å; A247-I261 CarbonylContact O-C 3.4Å; A247-I261 WeakPolarHBondContact O-CA 3.45Å; A247-S262 PolarHBondContact N-O 2.83Å; A247-S262 PolarHBondContact O-N 2.93Å; A247-L268 HydrophobicContact CB-CD1 4.37Å; A247-L268 HydrophobicContact CB-CD2 3.92Å; A247-L268 HydrophobicContact CB-CG 4.42Å
248	A	97.3	Very high	92.3	Very high	0 Å²	0	66.3 Å²	66.3	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	147.7	175.6	0	0	0	0	0	112.9	Y231 L260 I261 F441 L445	Y231-A248 PolarHBondContact N-O 2.96Å; Y231-A248 PolarHBondContact O-N 2.85Å; A248-L260 CarbonylContact C-O 3.59Å; A248-L260 WeakPolarHBondContact CA-O 3.42Å; A248-L260 WeakPolarHBondContact CB-O 3.34Å; A248-I261 HydrophobicContact CB-CB 4.46Å; A248-I261 HydrophobicContact CB-CG1 4.01Å; A248-I261 HydrophobicContact CB-CG2 4.38Å; A248-F441 HydrophobicContact CB-CD1 4.42Å; A248-F441 HydrophobicContact CB-CE1 3.49Å; A248-F441 VanDerWaalsContact CB-CE1 3.49Å; A248-F441 HydrophobicContact CB-CZ 3.72Å; A248-L445 HydrophobicContact CB-CD1 3.52Å; A248-L445 HydrophobicContact CB-CD2 4.03Å; A248-L445 HydrophobicContact CB-CG 4.43Å
249	R	94.5	Very high	92.8	Very high	65 Å²	65	58 Å²	58	25%	0.245	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	134.5	178.9	-169.4	170.8	-170.5	-158.5	-1.7	112.8	Y228 R251 Y259 L260 L268	Y228-R249 PolarHBondContact O-NE 2.81Å; Y228-R249 PolarHBondContact O-NH2 3.25Å; R249-R251 PolarHBondContact O-N 2.66Å; R249-Y259 WeakPolarHBondContact O-CA 3.3Å; R249-L260 PolarHBondContact N-O 3.35Å; R249-L260 PolarHBondContact O-N 2.82Å; R249-L260 VanDerWaalsContact O-N 3.1Å; R249-L268 HydrophobicContact CB-CD1 4.13Å; R249-L268 HydrophobicContact CB-CD2 4.48Å
250	K	93.9	Very high	93.3	Very high	55 Å²	55	53.1 Å²	53.1	24%	0.239	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	125.1	173.9	-169.2	169.8	177	174.3	0	109.5	Y228 S257 Y259 D449	Y228-K250 HydrophobicContact CD1-CB 4.2Å; Y228-K250 HydrophobicContact CD1-CG 4.26Å; Y228-K250 WeakPolarHBondContact CD1-O 3.36Å; Y228-K250 HydrophobicContact CE1-CG 4.49Å; K250-S257 VanDerWaalsContact CE-OG 3.27Å; K250-S257 WeakPolarHBondContact CE-OG 3.3Å; K250-Y259 HydrophobicContact CB-CD1 3.97Å; K250-Y259 HydrophobicContact CB-CE1 3.71Å; K250-Y259 HydrophobicContact CB-CE2 4.39Å; K250-Y259 HydrophobicContact CB-CG 4.41Å; K250-Y259 HydrophobicContact CD-CE2 4.32Å; K250-Y259 HydrophobicContact CG-CE1 4.48Å; K250-Y259 HydrophobicContact CG-CE2 4.32Å; K250-D449 IonicContact NZ-OD1 3.66Å; K250-D449 PolarHBondContact NZ-OD1 3.28Å
251	R	92	Very high	93.9	Very high	95 Å²	95	50.3 Å²	50.3	36%	0.358	24%	0.241	S	C	.	.	P	Polyproline II helix	trans	-72.5	127.6	-178.4	-71.2	176.6	62.9	110.8	5.9	111.6	R249 S254 N258 L260	R249-R251 PolarHBondContact O-N 2.66Å; R251-S254 WeakPolarHBondContact CB-OG 3.24Å; R251-N258 HydrophobicContact CB-CB 4.48Å; R251-N258 WeakPolarHBondContact CB-O 3.29Å; R251-N258 WeakPolarHBondContact CG-O 3.2Å; R251-N258 PolarHBondContact N-O 3.45Å; R251-L260 HydrophobicContact CG-CD1 3.91Å; R251-L260 HydrophobicContact CG-CG 3.79Å
252	K	87.6	Confident	94.2	Very high	91 Å²	91	44.6 Å²	44.6	40%	0.396	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	156.6	160.1	-57.1	-167.5	-173.3	-174.3	0	110.9	D224 Y228 S254	D224-K252 WeakPolarHBondContact OD1-CE 3.45Å; D224-K252 IonicContact OD1-NZ 2.74Å; D224-K252 PolarHBondContact OD1-NZ 3.21Å; D224-K252 IonicContact OD2-NZ 2.8Å; D224-K252 PolarHBondContact OD2-NZ 2.88Å; Y228-K252 HydrophobicContact CD1-CG 4.27Å; Y228-K252 HydrophobicContact CD2-CD 4.43Å; Y228-K252 HydrophobicContact CD2-CG 3.82Å; Y228-K252 HydrophobicContact CE1-CG 4.32Å; Y228-K252 HydrophobicContact CE2-CD 4.49Å; Y228-K252 HydrophobicContact CE2-CG 3.87Å; Y228-K252 HydrophobicContact CG-CG 4.02Å; K252-S254 PolarHBondContact O-N 2.7Å
253	K	87	Confident	94.4	Very high	214 Å²	214	39.8 Å²	39.8	93%	0.93	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.2	29	173.9	-53.7	-175.8	179.8	-176.9	0	115
254	S	89.6	Confident	94.4	Very high	40 Å²	40	41.3 Å²	41.3	28%	0.28	21%	0.209	S	C	.	.			trans	-102.6	135.5	171.3	-59.4	0	0	0	0	110.5	R251 K252 T256 N258	R251-S254 WeakPolarHBondContact CB-OG 3.24Å; K252-S254 PolarHBondContact O-N 2.7Å; S254-T256 VanDerWaalsContact C-N 3.31Å; S254-T256 WeakPolarHBondContact CB-O 3.19Å; S254-N258 PolarHBondContact OG-ND2 2.66Å
255	A	90	Very high	94.3	Very high	110 Å²	110	42 Å²	42	91%	0.909	22%	0.218	S	C	*	.	S	Bend	trans	-76.3	-16.6	-178.9	0	0	0	0	0	114.1
256	T	92.6	Very high	94	Very high	25 Å²	25	47.8 Å²	47.8	15%	0.153	25%	0.254	C	S	.	.	S	Bend	trans	-130	166.9	165.6	70.8	0	0	0	0	108.1	S254 R280 S281 A283	S254-T256 VanDerWaalsContact C-N 3.31Å; S254-T256 WeakPolarHBondContact CB-O 3.19Å; T256-R280 VanDerWaalsContact OG1-CZ 3.31Å; T256-R280 PolarHBondContact OG1-NH1 2.98Å; T256-S281 VanDerWaalsContact CB-O 3.28Å; T256-S281 WeakPolarHBondContact CB-O 3.33Å; T256-S281 PolarHBondContact OG1-O 3.03Å; T256-A283 HydrophobicContact CG2-CB 4.47Å
257	S	93.1	Very high	93.6	Very high	12 Å²	12	50.4 Å²	50.4	8%	0.084	27%	0.268	C	S	.	.			trans	-63.2	140.7	177.4	-159.9	0	0	0	0	111.3	K250 Y259 R280 S281 D449	K250-S257 VanDerWaalsContact CE-OG 3.27Å; K250-S257 WeakPolarHBondContact CE-OG 3.3Å; S257-Y259 WeakPolarHBondContact OG-CE2 3.49Å; S257-R280 CarbonylContact O-C 3.56Å; S257-R280 WeakPolarHBondContact O-CA 3.32Å; S257-S281 VanDerWaalsContact CB-OG 3.27Å; S257-S281 WeakPolarHBondContact CB-OG 3.41Å; S257-S281 PolarHBondContact N-OG 3.48Å; S257-S281 PolarHBondContact O-N 2.83Å; S257-D449 WeakPolarHBondContact CB-OD2 3.43Å; S257-D449 PolarHBondContact OG-OD2 3.48Å
258	N	95	Very high	93.1	Very high	20 Å²	20	52 Å²	52	11%	0.107	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.5	92.8	-163	-170.1	-3.6	0	0	0	108.8	R251 S254 K278 L279	R251-N258 HydrophobicContact CB-CB 4.48Å; R251-N258 WeakPolarHBondContact CB-O 3.29Å; R251-N258 WeakPolarHBondContact CG-O 3.2Å; R251-N258 PolarHBondContact N-O 3.45Å; S254-N258 PolarHBondContact OG-ND2 2.66Å; N258-K278 WeakPolarHBondContact OD1-CG 3.35Å; N258-L279 CarbonylContact C-O 3.6Å; N258-L279 WeakPolarHBondContact CA-O 3.08Å
259	Y	96.6	Very high	92.6	Very high	5 Å²	5	54.1 Å²	54.1	2%	0.02	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	131.9	176.3	-64.1	-106.7	0	0	0	109.1	Y231 R249 K250 S257 K278 L279 L445	Y231-Y259 HydrophobicContact CD2-CE1 4.29Å; Y231-Y259 HydrophobicContact CE2-CE1 4.01Å; R249-Y259 WeakPolarHBondContact O-CA 3.3Å; K250-Y259 HydrophobicContact CB-CD1 3.97Å; K250-Y259 HydrophobicContact CB-CE1 3.71Å; K250-Y259 HydrophobicContact CB-CE2 4.39Å; K250-Y259 HydrophobicContact CB-CG 4.41Å; K250-Y259 HydrophobicContact CD-CE2 4.32Å; K250-Y259 HydrophobicContact CG-CE1 4.48Å; K250-Y259 HydrophobicContact CG-CE2 4.32Å; S257-Y259 WeakPolarHBondContact OG-CE2 3.49Å; Y259-K278 VanDerWaalsContact O-CA 3.25Å; Y259-K278 WeakPolarHBondContact O-CA 3.46Å; Y259-L279 HydrophobicContact CD2-CD2 4.13Å; Y259-L279 PolarHBondContact N-O 3.44Å; Y259-L279 PolarHBondContact O-N 2.92Å; Y259-L279 VanDerWaalsContact O-N 3.12Å; Y259-L445 HydrophobicContact CD1-CD2 4.02Å; Y259-L445 HydrophobicContact CE1-CD2 4.1Å
260	L	96.8	Very high	92.1	Very high	8 Å²	8	56.1 Å²	56.1	4%	0.042	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	144.8	160.4	-61.1	171.5	0	0	0	108.2	A248 R249 R251 L268 R270 F275 K278	A248-L260 CarbonylContact C-O 3.59Å; A248-L260 WeakPolarHBondContact CA-O 3.42Å; A248-L260 WeakPolarHBondContact CB-O 3.34Å; R249-L260 PolarHBondContact N-O 3.35Å; R249-L260 PolarHBondContact O-N 2.82Å; R249-L260 VanDerWaalsContact O-N 3.1Å; R251-L260 HydrophobicContact CG-CD1 3.91Å; R251-L260 HydrophobicContact CG-CG 3.79Å; L260-L268 WeakPolarHBondContact CD1-O 3.37Å; L260-R270 HydrophobicContact CD1-CB 4.11Å; L260-R270 HydrophobicContact CD2-CB 4.16Å; L260-R270 HydrophobicContact CD2-CG 4.47Å; L260-F275 HydrophobicContact CB-CE2 4.42Å; L260-F275 HydrophobicContact CD2-CD2 4.12Å; L260-F275 HydrophobicContact CD2-CE2 3.51Å; L260-F275 HydrophobicContact CD2-CZ 4.23Å; L260-K278 HydrophobicContact CD2-CG 4.5Å
261	I	97.9	Very high	91.8	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	132.2	178.1	-46.5	178.5	0	0	0	108	L246 A247 A248 V276 G277 L290 L438 F441 L445	L246-I261 HydrophobicContact CB-CG2 4.2Å; L246-I261 HydrophobicContact CD1-CG2 4.33Å; L246-I261 HydrophobicContact CD2-CG2 4.04Å; L246-I261 HydrophobicContact CG-CG2 4.44Å; A247-I261 CarbonylContact O-C 3.4Å; A247-I261 WeakPolarHBondContact O-CA 3.45Å; A248-I261 HydrophobicContact CB-CB 4.46Å; A248-I261 HydrophobicContact CB-CG1 4.01Å; A248-I261 HydrophobicContact CB-CG2 4.38Å; I261-V276 HydrophobicContact CG2-CG2 4.37Å; I261-V276 PolarHBondContact O-N 2.8Å; I261-V276 VanDerWaalsContact O-N 3.11Å; I261-G277 WeakPolarHBondContact CA-O 3.42Å; I261-G277 WeakPolarHBondContact CB-O 3.16Å; I261-G277 PolarHBondContact N-O 2.85Å; I261-G277 PolarHBondContact O-N 3.48Å; I261-L290 HydrophobicContact CD1-CD1 3.8Å; I261-L438 HydrophobicContact CB-CD1 4.11Å; I261-L438 HydrophobicContact CD1-CD1 3.79Å; I261-L438 HydrophobicContact CG2-CD1 3.66Å; I261-F441 HydrophobicContact CG2-CD1 3.92Å; I261-F441 HydrophobicContact CG2-CE1 4.06Å; I261-L445 HydrophobicContact CD1-CD1 3.97Å; I261-L445 HydrophobicContact CG1-CD1 4.26Å
262	S	97.4	Very high	91.6	Very high	1 Å²	1	57.4 Å²	57.4	1%	0.007	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	147.7	-172.3	-172.8	0	0	0	0	111	L246 A247 D264 D267 S274	L246-S262 WeakPolarHBondContact CA-O 3.38Å; A247-S262 PolarHBondContact N-O 2.83Å; A247-S262 PolarHBondContact O-N 2.93Å; S262-D264 PolarHBondContact OG-N 2.9Å; S262-D264 PolarHBondContact OG-O 2.86Å; S262-D267 VanDerWaalsContact CB-O 3.3Å; S262-D267 WeakPolarHBondContact CB-O 3.45Å; S262-D267 PolarHBondContact OG-O 2.94Å; S262-S274 CarbonylContact C-O 3.57Å; S262-S274 WeakPolarHBondContact CA-O 3.32Å; S262-S274 WeakPolarHBondContact OG-CB 3.31Å; S262-S274 PolarHBondContact OG-O 2.81Å
263	I	96.7	Very high	91.7	Very high	37 Å²	37	58.4 Å²	58.4	19%	0.19	34%	0.335	C	S	.	.	S	Bend	trans	-84.6	4.4	164.8	56.4	172.4	0	0	0	112.7	L198 E199 I202 F244 L246 S274 V276	L198-I263 HydrophobicContact CD2-CB 4.01Å; L198-I263 HydrophobicContact CD2-CG2 4.22Å; L198-I263 HydrophobicContact CG-CB 4.41Å; L198-I263 HydrophobicContact CG-CG2 4.14Å; E199-I263 HydrophobicContact CB-CD1 4.19Å; I202-I263 HydrophobicContact CD1-CG2 3.76Å; I202-I263 HydrophobicContact CG1-CG2 4.37Å; I202-I263 HydrophobicContact CG2-CG2 4.5Å; F244-I263 WeakPolarHBondContact CE1-O 3.4Å; L246-I263 HydrophobicContact CD2-CG2 3.88Å; I263-S274 PolarHBondContact N-O 3.02Å; I263-V276 HydrophobicContact CD1-CG1 4.3Å; I263-V276 HydrophobicContact CG1-CG1 4.09Å; I263-V276 HydrophobicContact CG2-CG1 3.82Å; I263-V276 HydrophobicContact CG2-CG2 4.14Å
264	D	94.6	Very high	92	Very high	43 Å²	43	49 Å²	49	23%	0.23	30%	0.297	C	S	.	.			trans	-109.7	127.5	171.7	-170.4	-44.8	0	0	0	109.7	S262 T266 D267 S274	S262-D264 PolarHBondContact OG-N 2.9Å; S262-D264 PolarHBondContact OG-O 2.86Å; D264-T266 VanDerWaalsContact C-N 3.26Å; D264-T266 PolarHBondContact O-N 2.91Å; D264-T266 VanDerWaalsContact OD1-CA 3.3Å; D264-T266 WeakPolarHBondContact OD1-CA 3.15Å; D264-T266 WeakPolarHBondContact OD1-CB 3.3Å; D264-T266 PolarHBondContact OD1-N 2.7Å; D264-T266 PolarHBondContact OD1-OG1 2.76Å; D264-D267 PolarHBondContact OD1-N 2.8Å; D264-S274 VanDerWaalsContact CB-CB 3.48Å
265	P	93.2	Very high	92.3	Very high	60 Å²	60	47.8 Å²	47.8	39%	0.39	29%	0.286	S	S	.	.	S	Bend	trans	-76.1	-13	178.5	31.1	-33.4	0	0	0	113.6	F232 F244	F232-P265 HydrophobicContact CD1-CB 4.23Å; F232-P265 HydrophobicContact CE1-CB 3.94Å; F244-P265 HydrophobicContact CD1-CG 4.45Å; F244-P265 HydrophobicContact CE1-CB 4.1Å; F244-P265 HydrophobicContact CE1-CG 4.14Å; F244-P265 HydrophobicContact CE2-CB 4Å; F244-P265 HydrophobicContact CZ-CB 3.76Å; F244-P265 HydrophobicContact CZ-CG 4.31Å
266	T	91	Very high	92.6	Very high	123 Å²	123	42.8 Å²	42.8	76%	0.755	25%	0.245	S	C	*	.	S	Bend	trans	-101.4	-46	-177.4	74.1	0	0	0	0	112.3	D264	D264-T266 VanDerWaalsContact C-N 3.26Å; D264-T266 PolarHBondContact O-N 2.91Å; D264-T266 VanDerWaalsContact OD1-CA 3.3Å; D264-T266 WeakPolarHBondContact OD1-CA 3.15Å; D264-T266 WeakPolarHBondContact OD1-CB 3.3Å; D264-T266 PolarHBondContact OD1-N 2.7Å; D264-T266 PolarHBondContact OD1-OG1 2.76Å
267	D	89.9	Confident	92.8	Very high	55 Å²	55	41.6 Å²	41.6	29%	0.294	24%	0.237	S	C	.	.			trans	-97.6	114	176.6	-164.6	-1	0	0	0	112.6	S262 D264 S269 C272	S262-D267 VanDerWaalsContact CB-O 3.3Å; S262-D267 WeakPolarHBondContact CB-O 3.45Å; S262-D267 PolarHBondContact OG-O 2.94Å; D264-D267 PolarHBondContact OD1-N 2.8Å; D267-S269 WeakPolarHBondContact OD1-CA 3.33Å; D267-S269 WeakPolarHBondContact OD1-CB 3.31Å; D267-S269 PolarHBondContact OD1-N 3.29Å; D267-S269 PolarHBondContact OD1-OG 3.23Å; D267-S269 PolarHBondContact OD2-OG 3.2Å; D267-C272 HydrophobicContact CB-CB 4.4Å; D267-C272 WeakPolarHBondContact OD2-CB 3.38Å; D267-C272 PolarHBondContact OD2-SG 3.12Å
268	L	88.3	Confident	93	Very high	32 Å²	32	42.2 Å²	42.2	17%	0.168	24%	0.238	C	C	.	.			trans	-117.1	23.5	176.6	-75.2	154.7	0	0	0	111.3	T230 A247 R249 L260	T230-L268 HydrophobicContact CG2-CD1 3.6Å; A247-L268 HydrophobicContact CB-CD1 4.37Å; A247-L268 HydrophobicContact CB-CD2 3.92Å; A247-L268 HydrophobicContact CB-CG 4.42Å; R249-L268 HydrophobicContact CB-CD1 4.13Å; R249-L268 HydrophobicContact CB-CD2 4.48Å; L260-L268 WeakPolarHBondContact CD1-O 3.37Å
269	S	86.6	Confident	93.2	Very high	46 Å²	46	41.3 Å²	41.3	32%	0.322	23%	0.234	S	C	.	.			trans	-75.1	163	172.2	79.9	0	0	0	0	111.5	D267 C272	D267-S269 WeakPolarHBondContact OD1-CA 3.33Å; D267-S269 WeakPolarHBondContact OD1-CB 3.31Å; D267-S269 PolarHBondContact OD1-N 3.29Å; D267-S269 PolarHBondContact OD1-OG 3.23Å; D267-S269 PolarHBondContact OD2-OG 3.2Å; S269-C272 PolarHBondContact OG-N 2.83Å
270	R	85.1	Confident	93.2	Very high	107 Å²	107	45.8 Å²	45.8	40%	0.404	25%	0.251	S	S	.	.	S	Bend	trans	-83	-14.6	177.4	177.8	168.9	179.2	-102.5	-10	112.9	L260 F275	L260-R270 HydrophobicContact CD1-CB 4.11Å; L260-R270 HydrophobicContact CD2-CB 4.16Å; L260-R270 HydrophobicContact CD2-CG 4.47Å; R270-F275 HydrophobicContact CG-CE1 4.49Å
271	N	87.1	Confident	93.1	Very high	151 Å²	151	45.9 Å²	45.9	81%	0.807	25%	0.252	S	S	*	.	S	Bend	trans	-107.3	4.6	-172.2	-61.3	21	0	0	0	111.8
272	C	86.7	Confident	92.9	Very high	25 Å²	25	47.8 Å²	47.8	17%	0.169	26%	0.262	C	S	.	.	S	Bend	trans	-70.3	147.2	171.4	-162.9	0	0	0	0	110.6	D267 S269 S274 F275	D267-C272 HydrophobicContact CB-CB 4.4Å; D267-C272 WeakPolarHBondContact OD2-CB 3.38Å; D267-C272 PolarHBondContact OD2-SG 3.12Å; S269-C272 PolarHBondContact OG-N 2.83Å; C272-S274 PolarHBondContact O-N 2.83Å; C272-S274 PolarHBondContact SG-N 3.13Å; C272-S274 VanDerWaalsContact SG-N 3.42Å; C272-F275 WeakPolarHBondContact O-CB 3.4Å; C272-F275 PolarHBondContact O-N 3.32Å
273	S	90.5	Very high	92.5	Very high	112 Å²	112	51.5 Å²	51.5	78%	0.783	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-31.7	165.6	46.8	0	0	0	0	112.2	F275	S273-F275 PolarHBondContact O-N 3.09Å
274	S	93.6	Very high	92.1	Very high	18 Å²	18	54.1 Å²	54.1	13%	0.126	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-1.2	-177.9	-47.5	0	0	0	0	114.2	S262 I263 D264 C272 V276	S262-S274 CarbonylContact C-O 3.57Å; S262-S274 WeakPolarHBondContact CA-O 3.32Å; S262-S274 WeakPolarHBondContact OG-CB 3.31Å; S262-S274 PolarHBondContact OG-O 2.81Å; I263-S274 PolarHBondContact N-O 3.02Å; D264-S274 VanDerWaalsContact CB-CB 3.48Å; C272-S274 PolarHBondContact O-N 2.83Å; C272-S274 PolarHBondContact SG-N 3.13Å; C272-S274 VanDerWaalsContact SG-N 3.42Å; S274-V276 PolarHBondContact O-N 2.85Å
275	F	95.9	Very high	91.8	Very high	13 Å²	13	52.4 Å²	52.4	6%	0.057	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	113.1	177.1	168.8	-109.7	0	0	0	110.7	L260 R270 C272 S273 G277 K278 N293	L260-F275 HydrophobicContact CB-CE2 4.42Å; L260-F275 HydrophobicContact CD2-CD2 4.12Å; L260-F275 HydrophobicContact CD2-CE2 3.51Å; L260-F275 HydrophobicContact CD2-CZ 4.23Å; R270-F275 HydrophobicContact CG-CE1 4.49Å; C272-F275 WeakPolarHBondContact O-CB 3.4Å; C272-F275 PolarHBondContact O-N 3.32Å; S273-F275 PolarHBondContact O-N 3.09Å; F275-G277 WeakPolarHBondContact CE2-O 3.4Å; F275-K278 HydrophobicContact CE2-CB 4.14Å; F275-K278 HydrophobicContact CZ-CB 4.04Å; F275-N293 HydrophobicContact CD1-CB 3.82Å; F275-N293 HydrophobicContact CE1-CB 3.85Å; F275-N293 WeakPolarHBondContact O-CB 3.35Å; F275-N293 PolarHBondContact O-ND2 3.29Å
276	V	96.6	Very high	91.7	Very high	5 Å²	5	50.4 Å²	50.4	3%	0.03	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	-20.9	-173.1	-69.1	0	0	0	0	114.2	E199 I202 L246 I261 I263 S274 D292 N293 L438	E199-V276 HydrophobicContact CG-CG1 4.27Å; I202-V276 HydrophobicContact CD1-CB 3.71Å; I202-V276 HydrophobicContact CD1-CG1 3.81Å; I202-V276 HydrophobicContact CD1-CG2 3.67Å; L246-V276 HydrophobicContact CD2-CG2 3.88Å; I261-V276 HydrophobicContact CG2-CG2 4.37Å; I261-V276 PolarHBondContact O-N 2.8Å; I261-V276 VanDerWaalsContact O-N 3.11Å; I263-V276 HydrophobicContact CD1-CG1 4.3Å; I263-V276 HydrophobicContact CG1-CG1 4.09Å; I263-V276 HydrophobicContact CG2-CG1 3.82Å; I263-V276 HydrophobicContact CG2-CG2 4.14Å; S274-V276 PolarHBondContact O-N 2.85Å; V276-D292 CarbonylContact O-C 3.49Å; V276-N293 PolarHBondContact O-N 3.36Å; V276-L438 HydrophobicContact CG2-CD1 4.38Å
277	G	96.9	Very high	91.9	Very high	0 Å²	0	47 Å²	47	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171	167.3	-177.3	0	0	0	0	0	115.5	I261 F275 Y291	I261-G277 WeakPolarHBondContact CA-O 3.42Å; I261-G277 WeakPolarHBondContact CB-O 3.16Å; I261-G277 PolarHBondContact N-O 2.85Å; I261-G277 PolarHBondContact O-N 3.48Å; F275-G277 WeakPolarHBondContact CE2-O 3.4Å; G277-Y291 CarbonylContact C-O 3.55Å; G277-Y291 WeakPolarHBondContact CA-O 3.45Å
278	K	97.2	Very high	92.2	Very high	25 Å²	25	44.4 Å²	44.4	11%	0.109	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	116.9	-175.1	173.1	-160	69.9	-87.4	0	111.6	N258 Y259 L260 F275 Y291	N258-K278 WeakPolarHBondContact OD1-CG 3.35Å; Y259-K278 VanDerWaalsContact O-CA 3.25Å; Y259-K278 WeakPolarHBondContact O-CA 3.46Å; L260-K278 HydrophobicContact CD2-CG 4.5Å; F275-K278 HydrophobicContact CE2-CB 4.14Å; F275-K278 HydrophobicContact CZ-CB 4.04Å; K278-Y291 PolarHBondContact N-O 2.96Å; K278-Y291 VanDerWaalsContact NZ-CB 3.26Å; K278-Y291 PolarHBondContact O-N 3.32Å
279	L	97.8	Very high	92.7	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.005	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	130	169.2	-173.6	76.1	0	0	0	109.8	N258 Y259 F288 L290 I314 G442 L445	N258-L279 CarbonylContact C-O 3.6Å; N258-L279 WeakPolarHBondContact CA-O 3.08Å; Y259-L279 HydrophobicContact CD2-CD2 4.13Å; Y259-L279 PolarHBondContact N-O 3.44Å; Y259-L279 PolarHBondContact O-N 2.92Å; Y259-L279 VanDerWaalsContact O-N 3.12Å; L279-F288 HydrophobicContact CD1-CB 3.99Å; L279-F288 HydrophobicContact CD2-CD1 4.09Å; L279-F288 HydrophobicContact CG-CB 4.45Å; L279-F288 HydrophobicContact CG-CD1 4.19Å; L279-L290 HydrophobicContact CB-CD1 4.29Å; L279-L290 HydrophobicContact CD1-CB 4.11Å; L279-L290 HydrophobicContact CD1-CD1 4.46Å; L279-I314 HydrophobicContact CD1-CD1 4.15Å; L279-G442 WeakPolarHBondContact CD2-O 3.43Å; L279-L445 HydrophobicContact CD2-CB 3.78Å
280	R	96.5	Very high	93.3	Very high	100 Å²	100	41.5 Å²	41.5	38%	0.377	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	134	178.3	174	175.1	176.2	68.1	3.9	111.1	T256 S257 F288 T289 Y291	T256-R280 VanDerWaalsContact OG1-CZ 3.31Å; T256-R280 PolarHBondContact OG1-NH1 2.98Å; S257-R280 CarbonylContact O-C 3.56Å; S257-R280 WeakPolarHBondContact O-CA 3.32Å; R280-F288 CarbonylContact O-C 3.59Å; R280-F288 VanDerWaalsContact O-CA 3.29Å; R280-F288 WeakPolarHBondContact O-CA 3.46Å; R280-T289 PolarHBondContact N-O 3.01Å; R280-T289 PolarHBondContact O-N 3.45Å; R280-Y291 HydrophobicContact CB-CE2 4.37Å
281	S	95.5	Very high	93.8	Very high	9 Å²	9	37.1 Å²	37.1	6%	0.063	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	160.2	172.2	79.6	0	0	0	0	113.1	T256 S257 Q287	T256-S281 VanDerWaalsContact CB-O 3.28Å; T256-S281 WeakPolarHBondContact CB-O 3.33Å; T256-S281 PolarHBondContact OG1-O 3.03Å; S257-S281 VanDerWaalsContact CB-OG 3.27Å; S257-S281 WeakPolarHBondContact CB-OG 3.41Å; S257-S281 PolarHBondContact N-OG 3.48Å; S257-S281 PolarHBondContact O-N 2.83Å; S281-Q287 CarbonylContact C-O 3.58Å; S281-Q287 VanDerWaalsContact CA-O 3.27Å; S281-Q287 WeakPolarHBondContact CA-O 3.47Å
282	N	93.7	Very high	94.3	Very high	40 Å²	40	30.4 Å²	30.4	21%	0.214	18%	0.177	C	C	.	.			trans	-66.9	-179.2	154.5	75.9	-4.7	0	0	0	111.2	L284 G285 T286 Q287	N282-L284 VanDerWaalsContact C-N 3.34Å; N282-L284 PolarHBondContact O-N 2.76Å; N282-L284 PolarHBondContact OD1-N 3.1Å; N282-G285 PolarHBondContact OD1-N 3.03Å; N282-T286 PolarHBondContact ND2-OG1 2.68Å; N282-T286 PolarHBondContact OD1-N 2.77Å; N282-T286 VanDerWaalsContact OD1-N 3.08Å; N282-Q287 HydrophobicContact CB-CB 4.19Å; N282-Q287 PolarHBondContact N-O 3Å; N282-Q287 WeakPolarHBondContact ND2-CB 3.45Å; N282-Q287 PolarHBondContact ND2-N 2.66Å; N282-Q287 PolarHBondContact ND2-OE1 2.66Å; N282-Q287 PolarHBondContact OD1-N 2.88Å
283	A	89.5	Confident	94.6	Very high	80 Å²	80	32.7 Å²	32.7	66%	0.661	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-25.7	-177.8	0	0	0	0	0	114.5	T256	T256-A283 HydrophobicContact CG2-CB 4.47Å
284	L	87.9	Confident	94.7	Very high	92 Å²	92	28.2 Å²	28.2	48%	0.482	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-13.8	-175.5	-60.1	176.8	0	0	0	113.8	N282 T286 L452 A453	N282-L284 VanDerWaalsContact C-N 3.34Å; N282-L284 PolarHBondContact O-N 2.76Å; N282-L284 PolarHBondContact OD1-N 3.1Å; L284-T286 VanDerWaalsContact C-N 3.27Å; L284-T286 HydrophobicContact CB-CG2 3.99Å; L284-L452 PolarHBondContact O-N 3.26Å; L284-L452 VanDerWaalsContact O-N 3.15Å; L284-A453 HydrophobicContact CB-CB 4.4Å
285	G	88.6	Confident	94.5	Very high	6 Å²	6	31.6 Å²	31.6	6%	0.062	17%	0.172	C	C	.	.	S	Bend	trans	75.1	14.6	-169.8	0	0	0	0	0	113.6	N282 F288 K451	N282-G285 PolarHBondContact OD1-N 3.03Å; G285-F288 WeakPolarHBondContact O-CE2 3.32Å; G285-K451 WeakPolarHBondContact O-CG 3.27Å
286	T	90.9	Very high	94.3	Very high	18 Å²	18	33.3 Å²	33.3	11%	0.11	18%	0.182	C	C	.	.	S	Bend	trans	-93.3	-25.9	-179.1	54.8	0	0	0	0	113.3	N282 L284 Y316 A453	N282-T286 PolarHBondContact ND2-OG1 2.68Å; N282-T286 PolarHBondContact OD1-N 2.77Å; N282-T286 VanDerWaalsContact OD1-N 3.08Å; L284-T286 VanDerWaalsContact C-N 3.27Å; L284-T286 HydrophobicContact CB-CG2 3.99Å; T286-Y316 PolarHBondContact O-N 2.89Å; T286-A453 HydrophobicContact CG2-CB 3.96Å
287	Q	94.8	Very high	93.9	Very high	51 Å²	51	34.2 Å²	34.2	24%	0.238	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	134.6	-179.8	-69.2	157.9	6	0	0	109.6	S281 N282 I314 I315 I360	S281-Q287 CarbonylContact C-O 3.58Å; S281-Q287 VanDerWaalsContact CA-O 3.27Å; S281-Q287 WeakPolarHBondContact CA-O 3.47Å; N282-Q287 HydrophobicContact CB-CB 4.19Å; N282-Q287 PolarHBondContact N-O 3Å; N282-Q287 WeakPolarHBondContact ND2-CB 3.45Å; N282-Q287 PolarHBondContact ND2-N 2.66Å; N282-Q287 PolarHBondContact ND2-OE1 2.66Å; N282-Q287 PolarHBondContact OD1-N 2.88Å; Q287-I314 CarbonylContact C-O 3.59Å; Q287-I314 WeakPolarHBondContact CA-O 3.42Å; Q287-I315 HydrophobicContact CG-CG1 4.35Å; Q287-I315 HydrophobicContact CG-CG2 4.1Å; Q287-I360 HydrophobicContact CB-CD1 4.13Å
288	F	97.3	Very high	93.3	Very high	1 Å²	1	42.6 Å²	42.6	0%	0.004	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	146.4	177.5	-60.4	-103.4	0	0	0	110.5	L279 R280 G285 A313 I314 Y316 D449	L279-F288 HydrophobicContact CD1-CB 3.99Å; L279-F288 HydrophobicContact CD2-CD1 4.09Å; L279-F288 HydrophobicContact CG-CB 4.45Å; L279-F288 HydrophobicContact CG-CD1 4.19Å; R280-F288 CarbonylContact O-C 3.59Å; R280-F288 VanDerWaalsContact O-CA 3.29Å; R280-F288 WeakPolarHBondContact O-CA 3.46Å; G285-F288 WeakPolarHBondContact O-CE2 3.32Å; F288-A313 CarbonylContact O-C 3.59Å; F288-A313 VanDerWaalsContact O-CA 3.31Å; F288-A313 WeakPolarHBondContact O-CA 3.48Å; F288-I314 HydrophobicContact CB-CB 4.35Å; F288-I314 HydrophobicContact CB-CD1 4.35Å; F288-I314 PolarHBondContact N-O 3.2Å; F288-I314 PolarHBondContact O-N 2.84Å; F288-Y316 HydrophobicContact CD2-CD2 4.09Å; F288-Y316 HydrophobicContact CD2-CE2 4.02Å; F288-Y316 AromaticContact CE2-CD2 3.86Å; F288-Y316 HydrophobicContact CE2-CD2 3.86Å; F288-Y316 AromaticContact CE2-CE2 3.86Å; F288-Y316 HydrophobicContact CE2-CE2 3.86Å; F288-D449 HydrophobicContact CE1-CB 4.18Å; F288-D449 WeakPolarHBondContact CE1-OD2 3.4Å; F288-D449 HydrophobicContact CZ-CB 3.96Å
289	T	97.9	Very high	92.7	Very high	17 Å²	17	49.1 Å²	49.1	10%	0.104	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	128.6	173.3	-41.4	0	0	0	0	109.5	R280 Y291 E310 I360	R280-T289 PolarHBondContact N-O 3.01Å; R280-T289 PolarHBondContact O-N 3.45Å; T289-Y291 HydrophobicContact CG2-CE1 4.09Å; T289-Y291 HydrophobicContact CG2-CE2 3.82Å; T289-E310 HydrophobicContact CG2-CB 4.23Å; T289-E310 VanDerWaalsContact CG2-CD 3.45Å; T289-E310 HydrophobicContact CG2-CG 3.68Å; T289-I360 WeakPolarHBondContact OG1-CD1 3.05Å
290	L	98.3	Very high	91.7	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	125	173.9	-179.8	67.2	0	0	0	109.3	I261 L279 L311 A312 L438 Q439	I261-L290 HydrophobicContact CD1-CD1 3.8Å; L279-L290 HydrophobicContact CB-CD1 4.29Å; L279-L290 HydrophobicContact CD1-CB 4.11Å; L279-L290 HydrophobicContact CD1-CD1 4.46Å; L290-L311 HydrophobicContact CD2-CB 4.06Å; L290-L311 HydrophobicContact CG-CB 4.17Å; L290-L311 PolarHBondContact O-N 2.96Å; L290-A312 HydrophobicContact CB-CB 4.17Å; L290-A312 HydrophobicContact CD2-CB 4.3Å; L290-A312 PolarHBondContact N-O 3.33Å; L290-L438 HydrophobicContact CD2-CG 4.49Å; L290-L438 WeakPolarHBondContact CD2-O 3.37Å; L290-Q439 HydrophobicContact CD2-CB 4.49Å; L290-Q439 HydrophobicContact CD2-CG 4.36Å
291	Y	97.3	Very high	90.5	Very high	16 Å²	16	53.5 Å²	53.5	6%	0.063	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	155.4	174.9	-62.5	-81.2	0	0	0	110.9	G277 K278 R280 T289 R308 R309 E310	G277-Y291 CarbonylContact C-O 3.55Å; G277-Y291 WeakPolarHBondContact CA-O 3.45Å; K278-Y291 PolarHBondContact N-O 2.96Å; K278-Y291 VanDerWaalsContact NZ-CB 3.26Å; K278-Y291 PolarHBondContact O-N 3.32Å; R280-Y291 HydrophobicContact CB-CE2 4.37Å; T289-Y291 HydrophobicContact CG2-CE1 4.09Å; T289-Y291 HydrophobicContact CG2-CE2 3.82Å; Y291-R308 HydrophobicContact CD1-CB 4.41Å; Y291-R308 HydrophobicContact CD1-CG 3.86Å; Y291-R308 VanDerWaalsContact CD1-NH1 3.31Å; Y291-R308 HydrophobicContact CE1-CG 4.35Å; Y291-R308 PolarHBondContact OH-NH1 2.93Å; Y291-R309 WeakPolarHBondContact CA-O 3.46Å; Y291-R309 WeakPolarHBondContact CD1-O 3.36Å; Y291-E310 HydrophobicContact CD1-CG 3.79Å; Y291-E310 HydrophobicContact CE1-CG 3.23Å; Y291-E310 WeakPolarHBondContact CE1-OE1 3.11Å; Y291-E310 PolarHBondContact OH-OE1 2.95Å
292	D	95.7	Very high	89.3	Confident	10 Å²	10	58.2 Å²	58.2	5%	0.053	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	-166.3	160.7	65.3	7.9	0	0	0	111.9	V276 G294 R308 R309 L311	V276-D292 CarbonylContact O-C 3.49Å; D292-G294 VanDerWaalsContact C-N 3.33Å; D292-G294 PolarHBondContact OD1-N 3.02Å; D292-R308 WeakPolarHBondContact OD1-CA 3.47Å; D292-R308 VanDerWaalsContact OD1-CB 3.23Å; D292-R308 WeakPolarHBondContact OD1-CB 3.48Å; D292-R309 VanDerWaalsContact CG-N 3.25Å; D292-R309 PolarHBondContact N-O 3.18Å; D292-R309 PolarHBondContact OD1-N 2.69Å; D292-R309 WeakPolarHBondContact OD2-CB 3.42Å; D292-R309 WeakPolarHBondContact OD2-CD 3.35Å; D292-R309 WeakPolarHBondContact OD2-CG 3.36Å; D292-R309 PolarHBondContact OD2-N 3.38Å; D292-R309 IonicContact OD2-NE 3.72Å; D292-L311 HydrophobicContact CB-CD1 4.04Å; D292-L311 HydrophobicContact CB-CD2 4.44Å; D292-L311 HydrophobicContact CB-CG 4.32Å
293	N	94	Very high	88.2	Confident	73 Å²	73	62.2 Å²	62.2	39%	0.39	32%	0.323	S	S	.	.	S	Bend	trans	-80.3	-5	178.5	57.9	3.4	0	0	0	114.9	F275 V276	F275-N293 HydrophobicContact CD1-CB 3.82Å; F275-N293 HydrophobicContact CE1-CB 3.85Å; F275-N293 WeakPolarHBondContact O-CB 3.35Å; F275-N293 PolarHBondContact O-ND2 3.29Å; V276-N293 PolarHBondContact O-N 3.36Å
294	G	92.4	Very high	87.5	Confident	17 Å²	17	63.7 Å²	63.7	18%	0.175	32%	0.32	C	S	.	.			trans	-67.7	174.6	-173.1	0	0	0	0	0	116	D292	D292-G294 VanDerWaalsContact C-N 3.33Å; D292-G294 PolarHBondContact OD1-N 3.02Å
295	E	90.3	Very high	86.9	Confident	89 Å²	89	62.9 Å²	62.9	42%	0.416	33%	0.327	S	S	.	.	B	Isolated β-bridge	trans	-74.6	150.5	-178.2	-64.1	-131.4	105.5	0	0	112.8	T300 G306 R308	E295-T300 HydrophobicContact CB-CG2 4.07Å; E295-T300 WeakPolarHBondContact OE2-CB 3.44Å; E295-T300 PolarHBondContact OE2-OG1 2.98Å; E295-G306 PolarHBondContact N-O 3.09Å; E295-R308 VanDerWaalsContact O-CB 3.25Å; E295-R308 WeakPolarHBondContact O-CB 3.17Å; E295-R308 WeakPolarHBondContact O-CD 3.5Å; E295-R308 WeakPolarHBondContact O-CG 3.34Å; E295-R308 PolarHBondContact O-N 3.45Å
296	N	90.8	Very high	86.7	Confident	49 Å²	49	64.7 Å²	64.7	26%	0.262	35%	0.345	S	S	.	.			trans	-80.3	123.8	171.7	-179.1	-7.4	0	0	0	108.8	R298 K299 T300	N296-R298 PolarHBondContact O-N 2.76Å; N296-R298 VanDerWaalsContact O-N 3.08Å; N296-R298 PolarHBondContact OD1-N 3Å; N296-R298 VanDerWaalsContact OD1-N 3.17Å; N296-K299 HydrophobicContact CB-CB 4.47Å; N296-K299 HydrophobicContact CB-CD 4.49Å; N296-K299 WeakPolarHBondContact O-CB 3.3Å; N296-K299 PolarHBondContact O-N 3.3Å; N296-T300 PolarHBondContact O-N 3.05Å
297	P	88.1	Confident	86.7	Confident	25 Å²	25	64 Å²	64	16%	0.162	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-55.9	-30.1	-179.2	21.7	-33.4	0	0	0	112.9	K299 V307 P352	P297-K299 PolarHBondContact O-N 3.15Å; P297-V307 HydrophobicContact CB-CG1 4.28Å; P297-V307 HydrophobicContact CG-CG1 4.4Å; P297-P352 WeakPolarHBondContact CG-O 3.42Å
298	R	85.2	Confident	86.6	Confident	176 Å²	176	63 Å²	63	66%	0.664	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-72.6	10.6	173.9	-56.6	-167.2	-169.8	-175.6	6.1	114.9	N296 E355	N296-R298 PolarHBondContact O-N 2.76Å; N296-R298 VanDerWaalsContact O-N 3.08Å; N296-R298 PolarHBondContact OD1-N 3Å; N296-R298 VanDerWaalsContact OD1-N 3.17Å; R298-E355 IonicContact CZ-OE2 3.91Å; R298-E355 IonicContact NH1-OE2 3.68Å; R298-E355 IonicContact NH2-OE2 2.65Å; R298-E355 PolarHBondContact NH2-OE2 2.94Å
299	K	84.2	Confident	86.5	Confident	162 Å²	162	67.4 Å²	67.4	70%	0.704	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	-136.5	-6.1	-178.4	-74.7	-175.4	164.6	-81	0	114.2	N296 P297	N296-K299 HydrophobicContact CB-CB 4.47Å; N296-K299 HydrophobicContact CB-CD 4.49Å; N296-K299 WeakPolarHBondContact O-CB 3.3Å; N296-K299 PolarHBondContact O-N 3.3Å; P297-K299 PolarHBondContact O-N 3.15Å
300	T	77.4	Confident	86.4	Confident	25 Å²	25	66.8 Å²	66.8	15%	0.153	35%	0.348	C	S	.	.			trans	-128.2	141.1	-176.1	-164	0	0	0	0	109.3	E295 N296 V307	E295-T300 HydrophobicContact CB-CG2 4.07Å; E295-T300 WeakPolarHBondContact OE2-CB 3.44Å; E295-T300 PolarHBondContact OE2-OG1 2.98Å; N296-T300 PolarHBondContact O-N 3.05Å; T300-V307 HydrophobicContact CG2-CG2 4.48Å
301	N	70.8	Confident	86.4	Confident	167 Å²	167	67.2 Å²	67.2	89%	0.893	35%	0.35	S	S	*	.	S	Bend	trans	-87.2	0.9	178.5	-63.3	-11.2	0	0	0	111.7
302	I	69.5	Low	86.4	Confident	109 Å²	109	66.5 Å²	66.5	56%	0.559	35%	0.347	S	S	*	.			trans	-107.4	108.2	-173	-61.3	169.6	0	0	0	108.8	D304 V307	I302-D304 VanDerWaalsContact C-N 3.3Å; I302-D304 HydrophobicContact CG2-CB 3.8Å; I302-D304 PolarHBondContact O-N 2.85Å; I302-V307 VanDerWaalsContact O-CG2 3.31Å; I302-V307 WeakPolarHBondContact O-CG2 3.33Å
303	I	70.8	Confident	86.5	Confident	123 Å²	123	66 Å²	66	63%	0.631	34%	0.344	S	S	*	.			trans	-93.4	57.2	-176.6	-44.6	-178.6	0	0	0	110	I353	I303-I353 HydrophobicContact CG2-CD1 3.45Å; I303-I353 VanDerWaalsContact CG2-CD1 3.45Å; I303-I353 HydrophobicContact CG2-CG1 3.8Å; I303-I353 HydrophobicContact CG2-CG2 4.36Å
304	D	74.8	Confident	86.6	Confident	112 Å²	112	62.5 Å²	62.5	60%	0.599	33%	0.326	S	S	*	.	S	Bend	trans	-143.4	-154.3	-167.3	-170	15.8	0	0	0	112.8	I302 G306 V307 K351	I302-D304 VanDerWaalsContact C-N 3.3Å; I302-D304 HydrophobicContact CG2-CB 3.8Å; I302-D304 PolarHBondContact O-N 2.85Å; D304-G306 PolarHBondContact O-N 2.84Å; D304-V307 WeakPolarHBondContact O-CB 3.46Å; D304-V307 PolarHBondContact O-N 3.48Å; D304-K351 PolarHBondContact O-NZ 2.86Å; D304-K351 VanDerWaalsContact O-NZ 3.12Å
305	A	75	Confident	86.8	Confident	75 Å²	75	62 Å²	62	62%	0.62	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-42.8	-38.1	-177.4	0	0	0	0	0	114.8	V307 K351	A305-V307 PolarHBondContact O-N 3.39Å; A305-K351 PolarHBondContact O-NZ 3.15Å
306	G	84.5	Confident	86.8	Confident	43 Å²	43	58.5 Å²	58.5	44%	0.443	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-13.7	179.4	0	0	0	0	0	116.4	E295 D304 R308	E295-G306 PolarHBondContact N-O 3.09Å; D304-G306 PolarHBondContact O-N 2.84Å; G306-R308 PolarHBondContact O-N 3.32Å
307	V	90.7	Very high	86.4	Confident	5 Å²	5	58.8 Å²	58.8	3%	0.03	31%	0.306	C	S	.	.	B	Isolated β-bridge	trans	-68.6	130.1	177.6	179.2	0	0	0	0	110.6	P297 T300 I302 D304 A305 K351	P297-V307 HydrophobicContact CB-CG1 4.28Å; P297-V307 HydrophobicContact CG-CG1 4.4Å; T300-V307 HydrophobicContact CG2-CG2 4.48Å; I302-V307 VanDerWaalsContact O-CG2 3.31Å; I302-V307 WeakPolarHBondContact O-CG2 3.33Å; D304-V307 WeakPolarHBondContact O-CB 3.46Å; D304-V307 PolarHBondContact O-N 3.48Å; A305-V307 PolarHBondContact O-N 3.39Å; V307-K351 HydrophobicContact CB-CD 4.45Å; V307-K351 HydrophobicContact CG1-CB 4.36Å; V307-K351 WeakPolarHBondContact O-CD 3.21Å; V307-K351 WeakPolarHBondContact O-CE 3.17Å; V307-K351 PolarHBondContact O-NZ 3.45Å; V307-K351 VanDerWaalsContact O-NZ 3.14Å
308	R	93.8	Very high	85.5	Confident	30 Å²	30	60 Å²	60	11%	0.113	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-55.8	146.4	178.8	69.8	-168.2	177.9	136.4	7.8	114	Y291 D292 E295 G306	Y291-R308 HydrophobicContact CD1-CB 4.41Å; Y291-R308 HydrophobicContact CD1-CG 3.86Å; Y291-R308 VanDerWaalsContact CD1-NH1 3.31Å; Y291-R308 HydrophobicContact CE1-CG 4.35Å; Y291-R308 PolarHBondContact OH-NH1 2.93Å; D292-R308 WeakPolarHBondContact OD1-CA 3.47Å; D292-R308 VanDerWaalsContact OD1-CB 3.23Å; D292-R308 WeakPolarHBondContact OD1-CB 3.48Å; E295-R308 VanDerWaalsContact O-CB 3.25Å; E295-R308 WeakPolarHBondContact O-CB 3.17Å; E295-R308 WeakPolarHBondContact O-CD 3.5Å; E295-R308 WeakPolarHBondContact O-CG 3.34Å; E295-R308 PolarHBondContact O-N 3.45Å; G306-R308 PolarHBondContact O-N 3.32Å
309	R	94.6	Very high	84.4	Confident	93 Å²	93	55.3 Å²	55.3	35%	0.351	29%	0.294	S	S	.	.	P	Polyproline II helix	trans	-95	151.9	171.2	-54.5	160.4	-163.9	-128.8	-9.1	111	Y291 D292 L311 D349 L350 K351	Y291-R309 WeakPolarHBondContact CA-O 3.46Å; Y291-R309 WeakPolarHBondContact CD1-O 3.36Å; D292-R309 VanDerWaalsContact CG-N 3.25Å; D292-R309 PolarHBondContact N-O 3.18Å; D292-R309 PolarHBondContact OD1-N 2.69Å; D292-R309 WeakPolarHBondContact OD2-CB 3.42Å; D292-R309 WeakPolarHBondContact OD2-CD 3.35Å; D292-R309 WeakPolarHBondContact OD2-CG 3.36Å; D292-R309 PolarHBondContact OD2-N 3.38Å; D292-R309 IonicContact OD2-NE 3.72Å; R309-L311 HydrophobicContact CB-CD2 4.14Å; R309-D349 IonicContact CZ-OD1 2.9Å; R309-D349 IonicContact NH1-OD1 2.69Å; R309-D349 PolarHBondContact NH1-OD1 3.16Å; R309-D349 IonicContact NH2-OD1 3.16Å; R309-L350 CarbonylContact C-O 3.58Å; R309-L350 VanDerWaalsContact CA-O 3.27Å; R309-L350 WeakPolarHBondContact CA-O 3.42Å; R309-K351 HydrophobicContact CG-CG 3.89Å
310	E	96.7	Very high	83	Confident	4 Å²	4	54.8 Å²	54.8	2%	0.019	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	109.7	164.4	-73.4	-173.2	172.2	0	0	109.2	T289 Y291 L350 P352 S358 M359	T289-E310 HydrophobicContact CG2-CB 4.23Å; T289-E310 VanDerWaalsContact CG2-CD 3.45Å; T289-E310 HydrophobicContact CG2-CG 3.68Å; Y291-E310 HydrophobicContact CD1-CG 3.79Å; Y291-E310 HydrophobicContact CE1-CG 3.23Å; Y291-E310 WeakPolarHBondContact CE1-OE1 3.11Å; Y291-E310 PolarHBondContact OH-OE1 2.95Å; E310-L350 PolarHBondContact N-O 2.82Å; E310-P352 VanDerWaalsContact CD-CG 3.5Å; E310-P352 HydrophobicContact CG-CG 3.85Å; E310-S358 WeakPolarHBondContact OE2-CA 3.46Å; E310-M359 HydrophobicContact CB-CB 4.44Å; E310-M359 HydrophobicContact CB-CE 4.28Å; E310-M359 WeakPolarHBondContact O-CE 3.23Å; E310-M359 WeakPolarHBondContact OE2-CB 3.4Å; E310-M359 PolarHBondContact OE2-N 3.15Å
311	L	97.1	Very high	81.7	Confident	9 Å²	9	57.7 Å²	57.7	5%	0.047	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	-27.5	-173.6	-59.2	-178.5	0	0	0	112.8	M203 L290 D292 R309 P337 L438 Q439	M203-L311 HydrophobicContact CE-CD1 4.12Å; M203-L311 HydrophobicContact CE-CD2 4.07Å; M203-L311 HydrophobicContact SD-CD1 4.15Å; L290-L311 HydrophobicContact CD2-CB 4.06Å; L290-L311 HydrophobicContact CG-CB 4.17Å; L290-L311 PolarHBondContact O-N 2.96Å; D292-L311 HydrophobicContact CB-CD1 4.04Å; D292-L311 HydrophobicContact CB-CD2 4.44Å; D292-L311 HydrophobicContact CB-CG 4.32Å; R309-L311 HydrophobicContact CB-CD2 4.14Å; L311-P337 VanDerWaalsContact O-CD 3.24Å; L311-P337 WeakPolarHBondContact O-CD 3.22Å; L311-L438 HydrophobicContact CD1-CD2 3.7Å; L311-L438 HydrophobicContact CD1-CG 4.42Å; L311-Q439 HydrophobicContact CB-CG 4.36Å; L311-Q439 PolarHBondContact O-NE2 2.88Å
312	A	98	Very high	80.9	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.8	155.1	173.4	0	0	0	0	0	110.1	L290 I335 L336 M359	L290-A312 HydrophobicContact CB-CB 4.17Å; L290-A312 HydrophobicContact CD2-CB 4.3Å; L290-A312 PolarHBondContact N-O 3.33Å; A312-I335 CarbonylContact C-O 3.59Å; A312-I335 VanDerWaalsContact CA-O 3.28Å; A312-I335 WeakPolarHBondContact CA-O 3.36Å; A312-L336 HydrophobicContact CB-CD2 3.72Å; A312-M359 VanDerWaalsContact C-SD 3.55Å
313	A	97.8	Very high	80.1	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	145.5	163.9	0	0	0	0	0	109.8	F288 V334 I335 M359 I360	F288-A313 CarbonylContact O-C 3.59Å; F288-A313 VanDerWaalsContact O-CA 3.31Å; F288-A313 WeakPolarHBondContact O-CA 3.48Å; A313-V334 CarbonylContact O-C 3.55Å; A313-V334 WeakPolarHBondContact O-CA 3.38Å; A313-I335 HydrophobicContact CB-CB 4.28Å; A313-I335 PolarHBondContact N-O 2.86Å; A313-I335 PolarHBondContact O-N 2.8Å; A313-M359 HydrophobicContact CB-CB 4.38Å; A313-M359 HydrophobicContact CB-CG 4.01Å; A313-M359 HydrophobicContact CB-SD 3.59Å; A313-M359 VanDerWaalsContact CB-SD 3.59Å; A313-M359 PolarHBondContact N-SD 2.99Å; A313-I360 HydrophobicContact CB-CD1 4.05Å; A313-I360 HydrophobicContact CB-CG1 3.58Å
314	I	97.1	Very high	79.5	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	125.2	177.3	-53.9	90.8	0	0	0	107.9	L279 Q287 F288 Y316 M332 T333 V334 I443	L279-I314 HydrophobicContact CD1-CD1 4.15Å; Q287-I314 CarbonylContact C-O 3.59Å; Q287-I314 WeakPolarHBondContact CA-O 3.42Å; F288-I314 HydrophobicContact CB-CB 4.35Å; F288-I314 HydrophobicContact CB-CD1 4.35Å; F288-I314 PolarHBondContact N-O 3.2Å; F288-I314 PolarHBondContact O-N 2.84Å; I314-Y316 HydrophobicContact CG2-CD2 4.17Å; I314-Y316 HydrophobicContact CG2-CE2 3.51Å; I314-M332 HydrophobicContact CG2-CE 3.86Å; I314-M332 HydrophobicContact CG2-CG 4.2Å; I314-T333 WeakPolarHBondContact CA-O 3.28Å; I314-V334 HydrophobicContact CG1-CG2 4.24Å; I314-V334 HydrophobicContact CG2-CG2 4.28Å; I314-I443 HydrophobicContact CD1-CG1 4.06Å; I314-I443 HydrophobicContact CG1-CB 4.4Å; I314-I443 HydrophobicContact CG1-CG1 3.92Å; I314-I443 HydrophobicContact CG1-CG2 4.47Å
315	I	95	Very high	78.5	Confident	5 Å²	5	55.4 Å²	55.4	3%	0.026	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	117.1	-176.8	-53.9	177.9	0	0	0	107.8	Q287 V317 T333 I360 W363	Q287-I315 HydrophobicContact CG-CG1 4.35Å; Q287-I315 HydrophobicContact CG-CG2 4.1Å; I315-V317 HydrophobicContact CG2-CG2 3.93Å; I315-T333 PolarHBondContact N-O 3.11Å; I315-T333 PolarHBondContact O-N 3.41Å; I315-I360 HydrophobicContact CD1-CG1 4.39Å; I315-I360 HydrophobicContact CD1-CG2 4.18Å; I315-W363 HydrophobicContact CD1-CD2 4.13Å; I315-W363 HydrophobicContact CD1-CE3 3.36Å; I315-W363 HydrophobicContact CD1-CH2 4.27Å; I315-W363 HydrophobicContact CD1-CZ3 3.44Å; I315-W363 VanDerWaalsContact CD1-CZ3 3.44Å; I315-W363 HydrophobicContact CG2-CZ3 4.45Å
316	Y	91.4	Very high	77.5	Confident	16 Å²	16	57.4 Å²	57.4	6%	0.063	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	113	172.4	-68.4	-75.5	0	0	0	108.8	T286 F288 I314 K331 M332 S446 K451	T286-Y316 PolarHBondContact O-N 2.89Å; F288-Y316 HydrophobicContact CD2-CD2 4.09Å; F288-Y316 HydrophobicContact CD2-CE2 4.02Å; F288-Y316 AromaticContact CE2-CD2 3.86Å; F288-Y316 HydrophobicContact CE2-CD2 3.86Å; F288-Y316 AromaticContact CE2-CE2 3.86Å; F288-Y316 HydrophobicContact CE2-CE2 3.86Å; I314-Y316 HydrophobicContact CG2-CD2 4.17Å; I314-Y316 HydrophobicContact CG2-CE2 3.51Å; Y316-K331 WeakPolarHBondContact CA-O 3.48Å; Y316-M332 HydrophobicContact CD1-CB 4Å; Y316-M332 HydrophobicContact CD1-CG 4.1Å; Y316-M332 HydrophobicContact CE1-CB 3.78Å; Y316-M332 HydrophobicContact CE1-CE 4.4Å; Y316-M332 HydrophobicContact CE1-CG 3.5Å; Y316-M332 HydrophobicContact CE1-SD 3.44Å; Y316-M332 WeakPolarHBondContact CE1-SD 3.38Å; Y316-M332 WeakPolarHBondContact OH-CE 3.44Å; Y316-M332 PolarHBondContact OH-SD 3.1Å; Y316-M332 VanDerWaalsContact OH-SD 3.38Å; Y316-S446 PolarHBondContact OH-OG 3.25Å; Y316-K451 HydrophobicContact CD2-CD 4.07Å; Y316-K451 VanDerWaalsContact CD2-NZ 3.25Å; Y316-K451 VanDerWaalsContact CE1-NZ 3.26Å; Y316-K451 HydrophobicContact CG-CD 4.08Å
317	V	82.5	Confident	76.2	Confident	56 Å²	56	61 Å²	61	34%	0.339	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	124.2	174.7	-177.9	0	0	0	0	107.1	I315 K331	I315-V317 HydrophobicContact CG2-CG2 3.93Å; V317-K331 HydrophobicContact CB-CB 4.33Å; V317-K331 PolarHBondContact N-O 3.33Å; V317-K331 PolarHBondContact O-N 2.85Å
318	Q	68.1	Low	74.6	Confident	51 Å²	51	61.2 Å²	61.2	24%	0.238	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-77.4	120.4	157.4	-179.1	148.3	66.2	0	0	105.4	D320 K327	Q318-D320 PolarHBondContact O-N 2.99Å; Q318-K327 HydrophobicContact CG-CG 4.45Å; Q318-K327 VanDerWaalsContact OE1-CE 3.25Å
319	E	62.1	Low	73.1	Confident	76 Å²	76	63 Å²	63	36%	0.355	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-61.8	135.1	175.9	-63.1	-167.3	139.9	0	0	108.4	K331	E319-K331 HydrophobicContact CG-CB 4.11Å; E319-K331 HydrophobicContact CG-CD 4.43Å; E319-K331 IonicContact OE1-NZ 3.55Å
320	D	54.6	Low	72	Confident	151 Å²	151	63 Å²	63	81%	0.807	34%	0.342	S	S	*	.	P	Polyproline II helix	trans	-53.5	144.8	-178.7	-77.5	-55.3	0	0	0	110.2	Q318 N322	Q318-D320 PolarHBondContact O-N 2.99Å; D320-N322 PolarHBondContact O-N 3.28Å
321	T	50.1	Low	71.6	Confident	86 Å²	86	67.3 Å²	67.3	53%	0.528	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-52.6	116.6	-177.1	-48.4	0	0	0	0	109.9	G325	T321-G325 VanDerWaalsContact CG2-CA 3.46Å; T321-G325 VanDerWaalsContact CG2-O 3.32Å; T321-G325 WeakPolarHBondContact CG2-O 3.49Å
322	N	54.1	Low	71.3	Confident	103 Å²	103	67.2 Å²	67.2	55%	0.551	36%	0.36	S	S	*	.	P	Polyproline II helix	trans	-53.8	155.9	174.9	-81.8	-35	0	0	0	109.8	D320 L324 G325 F326	D320-N322 PolarHBondContact O-N 3.28Å; N322-L324 PolarHBondContact O-N 3.49Å; N322-G325 PolarHBondContact O-N 3.25Å; N322-F326 PolarHBondContact N-O 3.02Å
323	V	52.3	Low	71.2	Confident	163 Å²	163	67.4 Å²	67.4	99%	0.988	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49	-25.9	-176.5	-174.7	0	0	0	0	113.6
324	L	58.3	Low	71.2	Confident	143 Å²	143	67.4 Å²	67.4	75%	0.749	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	9.1	179.2	-158.2	60	0	0	0	115.2	N322 F326	N322-L324 PolarHBondContact O-N 3.49Å; L324-F326 HydrophobicContact CB-CD2 4.07Å; L324-F326 HydrophobicContact CB-CE2 4.27Å; L324-F326 HydrophobicContact CD2-CD2 4.24Å; L324-F326 HydrophobicContact CD2-CE2 3.84Å; L324-F326 HydrophobicContact CG-CD2 4.16Å; L324-F326 HydrophobicContact CG-CE2 3.84Å
325	G	54.3	Low	71.2	Confident	54 Å²	54	67.4 Å²	67.4	56%	0.557	36%	0.362	S	S	*	.	S	Bend	trans	89.9	2.5	176	0	0	0	0	0	116.2	T321 N322	T321-G325 VanDerWaalsContact CG2-CA 3.46Å; T321-G325 VanDerWaalsContact CG2-O 3.32Å; T321-G325 WeakPolarHBondContact CG2-O 3.49Å; N322-G325 PolarHBondContact O-N 3.25Å
326	F	54.9	Low	71.3	Confident	117 Å²	117	67.2 Å²	67.2	51%	0.513	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-95.7	127.4	-176.3	-61.4	-64.4	0	0	0	113.2	N322 L324	N322-F326 PolarHBondContact N-O 3.02Å; L324-F326 HydrophobicContact CB-CD2 4.07Å; L324-F326 HydrophobicContact CB-CE2 4.27Å; L324-F326 HydrophobicContact CD2-CD2 4.24Å; L324-F326 HydrophobicContact CD2-CE2 3.84Å; L324-F326 HydrophobicContact CG-CD2 4.16Å; L324-F326 HydrophobicContact CG-CE2 3.84Å
327	K	57.4	Low	71.5	Confident	118 Å²	118	66.7 Å²	66.7	51%	0.513	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-67	125.8	167.8	-76.4	168.7	156.6	-177	0	109.7	Q318 E455	Q318-K327 HydrophobicContact CG-CG 4.45Å; Q318-K327 VanDerWaalsContact OE1-CE 3.25Å; K327-E455 PolarHBondContact NZ-O 3.38Å
328	G	56.7	Low	72	Confident	10 Å²	10	65.8 Å²	65.8	10%	0.103	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-69.7	165.9	176.7	0	0	0	0	0	113.7	R330	G328-R330 PolarHBondContact O-N 3.41Å
329	P	62.4	Low	73	Confident	69 Å²	69	63.4 Å²	63.4	45%	0.448	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-54.7	136.2	172.2	-22.5	34.1	0	0	0	111.1	T19 K331	T19-P329 HydrophobicContact CG2-CB 4Å; T19-P329 HydrophobicContact CG2-CG 3.85Å; P329-K331 PolarHBondContact O-N 3.31Å
330	R	72	Confident	73.9	Confident	92 Å²	92	63 Å²	63	35%	0.347	35%	0.348	S	S	.	.			trans	-65.4	108.1	-173.7	-168.8	-167.8	-58.6	121.3	-5.8	111.3	G328 C454	G328-R330 PolarHBondContact O-N 3.41Å; R330-C454 PolarHBondContact NH2-O 3.34Å
331	K	86.5	Confident	74.8	Confident	94 Å²	94	57.5 Å²	57.5	41%	0.409	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	138.3	177.1	-169.3	175.7	-161.9	155.4	0	111.2	Y316 V317 E319 P329	Y316-K331 WeakPolarHBondContact CA-O 3.48Å; V317-K331 HydrophobicContact CB-CB 4.33Å; V317-K331 PolarHBondContact N-O 3.33Å; V317-K331 PolarHBondContact O-N 2.85Å; E319-K331 HydrophobicContact CG-CB 4.11Å; E319-K331 HydrophobicContact CG-CD 4.43Å; E319-K331 IonicContact OE1-NZ 3.55Å; P329-K331 PolarHBondContact O-N 3.31Å
332	M	92	Very high	75.8	Confident	7 Å²	7	62.1 Å²	62.1	3%	0.034	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	105.3	179.6	175.3	176.5	170.5	0	0	108.7	I314 Y316 V334 G375 N376 F404 I406 I443	I314-M332 HydrophobicContact CG2-CE 3.86Å; I314-M332 HydrophobicContact CG2-CG 4.2Å; Y316-M332 HydrophobicContact CD1-CB 4Å; Y316-M332 HydrophobicContact CD1-CG 4.1Å; Y316-M332 HydrophobicContact CE1-CB 3.78Å; Y316-M332 HydrophobicContact CE1-CE 4.4Å; Y316-M332 HydrophobicContact CE1-CG 3.5Å; Y316-M332 HydrophobicContact CE1-SD 3.44Å; Y316-M332 WeakPolarHBondContact CE1-SD 3.38Å; Y316-M332 WeakPolarHBondContact OH-CE 3.44Å; Y316-M332 PolarHBondContact OH-SD 3.1Å; Y316-M332 VanDerWaalsContact OH-SD 3.38Å; M332-V334 HydrophobicContact CE-CG2 3.78Å; M332-V334 HydrophobicContact CG-CG2 4.39Å; M332-G375 WeakPolarHBondContact O-CA 3.48Å; M332-N376 HydrophobicContact CB-CB 4.27Å; M332-N376 PolarHBondContact N-OD1 3.36Å; M332-N376 PolarHBondContact O-N 2.94Å; M332-N376 VanDerWaalsContact O-N 3.08Å; M332-F404 HydrophobicContact CE-CD2 4.42Å; M332-F404 HydrophobicContact CE-CE1 4.36Å; M332-F404 HydrophobicContact CE-CE2 3.86Å; M332-F404 HydrophobicContact CE-CZ 3.83Å; M332-F404 HydrophobicContact SD-CD1 4.29Å; M332-F404 HydrophobicContact SD-CD2 4.29Å; M332-F404 HydrophobicContact SD-CE1 4.28Å; M332-F404 HydrophobicContact SD-CE2 4.28Å; M332-F404 HydrophobicContact SD-CG 4.31Å; M332-F404 HydrophobicContact SD-CZ 4.27Å; M332-I406 HydrophobicContact CE-CD1 3.93Å; M332-I406 HydrophobicContact CG-CD1 4.43Å; M332-I406 HydrophobicContact SD-CD1 4.09Å; M332-I443 HydrophobicContact CE-CG2 3.38Å
333	T	95.2	Very high	76.6	Confident	4 Å²	4	62.1 Å²	62.1	3%	0.025	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	135.2	171.2	-61.7	0	0	0	0	109	I314 I315 I335 W363 E373 L374	I314-T333 WeakPolarHBondContact CA-O 3.28Å; I315-T333 PolarHBondContact N-O 3.11Å; I315-T333 PolarHBondContact O-N 3.41Å; T333-I335 HydrophobicContact CG2-CD1 3.57Å; T333-I335 HydrophobicContact CG2-CG1 4.38Å; T333-W363 HydrophobicContact CG2-CZ2 4.01Å; T333-E373 HydrophobicContact CG2-CG 3.57Å; T333-L374 WeakPolarHBondContact CA-O 3.32Å
334	V	97.4	Very high	77.8	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	121.6	174.1	175	0	0	0	0	108.1	A313 I314 M332 L336 L374 I406 I443	A313-V334 CarbonylContact O-C 3.55Å; A313-V334 WeakPolarHBondContact O-CA 3.38Å; I314-V334 HydrophobicContact CG1-CG2 4.24Å; I314-V334 HydrophobicContact CG2-CG2 4.28Å; M332-V334 HydrophobicContact CE-CG2 3.78Å; M332-V334 HydrophobicContact CG-CG2 4.39Å; V334-L336 HydrophobicContact CG1-CD2 4.06Å; V334-L336 HydrophobicContact CG1-CG 4.34Å; V334-L374 HydrophobicContact CB-CB 4.28Å; V334-L374 PolarHBondContact N-O 2.95Å; V334-L374 PolarHBondContact O-N 3.1Å; V334-I406 HydrophobicContact CG2-CD1 4.26Å; V334-I443 HydrophobicContact CG1-CD1 3.67Å; V334-I443 HydrophobicContact CG1-CG1 4.03Å; V334-I443 HydrophobicContact CG2-CG2 4.17Å
335	I	97.5	Very high	78.8	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	135.7	176	-46	-58.4	0	0	0	109	A312 A313 T333 M359 W363 L371 I372 E373	A312-I335 CarbonylContact C-O 3.59Å; A312-I335 VanDerWaalsContact CA-O 3.28Å; A312-I335 WeakPolarHBondContact CA-O 3.36Å; A313-I335 HydrophobicContact CB-CB 4.28Å; A313-I335 PolarHBondContact N-O 2.86Å; A313-I335 PolarHBondContact O-N 2.8Å; T333-I335 HydrophobicContact CG2-CD1 3.57Å; T333-I335 HydrophobicContact CG2-CG1 4.38Å; I335-M359 HydrophobicContact CB-CG 3.86Å; I335-M359 HydrophobicContact CB-SD 3.75Å; I335-M359 HydrophobicContact CG2-CG 3.46Å; I335-M359 VanDerWaalsContact CG2-CG 3.46Å; I335-M359 HydrophobicContact CG2-SD 3.73Å; I335-M359 VanDerWaalsContact O-SD 3.37Å; I335-W363 HydrophobicContact CD1-CB 4.4Å; I335-W363 VanDerWaalsContact CD1-CD1 3.44Å; I335-W363 HydrophobicContact CD1-CD2 4.17Å; I335-W363 HydrophobicContact CD1-CG 3.74Å; I335-W363 HydrophobicContact CG1-CB 4.38Å; I335-W363 HydrophobicContact CG1-CG 4.15Å; I335-L371 HydrophobicContact CG2-CB 3.92Å; I335-L371 HydrophobicContact CG2-CD1 4.04Å; I335-L371 HydrophobicContact CG2-CD2 4.07Å; I335-L371 HydrophobicContact CG2-CG 4.24Å; I335-I372 WeakPolarHBondContact CA-O 3.43Å; I335-E373 HydrophobicContact CD1-CB 4.04Å; I335-E373 HydrophobicContact CD1-CG 3.71Å
336	L	97.1	Very high	80.2	Confident	2 Å²	2	61.7 Å²	61.7	1%	0.01	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	156.2	175.4	-55.2	175.4	0	0	0	110.3	A312 V334 L371 I372 L374 P434 L435	A312-L336 HydrophobicContact CB-CD2 3.72Å; V334-L336 HydrophobicContact CG1-CD2 4.06Å; V334-L336 HydrophobicContact CG1-CG 4.34Å; L336-L371 CarbonylContact O-C 3.56Å; L336-L371 WeakPolarHBondContact O-CA 3.49Å; L336-I372 HydrophobicContact CB-CB 4.4Å; L336-I372 PolarHBondContact N-O 3.35Å; L336-I372 PolarHBondContact O-N 3.49Å; L336-L374 HydrophobicContact CD1-CD1 3.67Å; L336-L374 HydrophobicContact CD1-CG 4.47Å; L336-L374 HydrophobicContact CG-CD1 4.39Å; L336-P434 HydrophobicContact CD1-CG 3.91Å; L336-L435 HydrophobicContact CD1-CD2 3.63Å; L336-L435 HydrophobicContact CD1-CG 4.27Å; L336-L435 HydrophobicContact CD2-CD2 3.76Å; L336-L435 HydrophobicContact CG-CD2 4.36Å
337	P	95.8	Very high	81.9	Confident	4 Å²	4	57.8 Å²	57.8	3%	0.026	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	143	164.9	-10.3	24.5	0	0	0	110.7	L311 R347 A348 L350 M359	L311-P337 VanDerWaalsContact O-CD 3.24Å; L311-P337 WeakPolarHBondContact O-CD 3.22Å; P337-R347 HydrophobicContact CB-CB 4.43Å; P337-A348 HydrophobicContact CB-CB 4.15Å; P337-L350 HydrophobicContact CB-CD1 3.75Å; P337-L350 HydrophobicContact CB-CG 4.12Å; P337-L350 HydrophobicContact CG-CD1 3.93Å; P337-L350 HydrophobicContact CG-CG 4.44Å; P337-M359 HydrophobicContact CG-CE 3.94Å
338	V	92.7	Very high	83.3	Confident	37 Å²	37	53.4 Å²	53.4	22%	0.224	28%	0.278	C	S	.	.			trans	-57	148.8	168.2	165.8	0	0	0	0	111.1	R347 A348 D370 I372	V338-R347 CarbonylContact O-C 3.43Å; V338-R347 WeakPolarHBondContact O-CA 3.5Å; V338-A348 PolarHBondContact O-N 3.22Å; V338-D370 VanDerWaalsContact CG2-C 3.45Å; V338-D370 PolarHBondContact N-O 2.98Å; V338-I372 HydrophobicContact CG2-CG1 3.85Å
339	I	89.5	Confident	84.8	Confident	1 Å²	1	56.1 Å²	56.1	1%	0.005	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	118.6	172.6	-61.4	-175.6	0	0	0	108.7	P205 D341 I345 K346 R347 Y433 P434	P205-I339 HydrophobicContact CB-CD1 3.89Å; P205-I339 HydrophobicContact CG-CD1 3.72Å; I339-D341 PolarHBondContact O-N 3.02Å; I339-I345 HydrophobicContact CG2-CG2 3.6Å; I339-K346 WeakPolarHBondContact CA-O 3.37Å; I339-R347 HydrophobicContact CD1-CG 4.25Å; I339-R347 HydrophobicContact CG1-CG 3.69Å; I339-Y433 WeakPolarHBondContact CB-OH 3.4Å; I339-Y433 HydrophobicContact CD1-CE2 3.79Å; I339-Y433 HydrophobicContact CG2-CE2 4.45Å; I339-Y433 WeakPolarHBondContact CG2-OH 3.47Å; I339-P434 HydrophobicContact CD1-CB 3.49Å; I339-P434 VanDerWaalsContact CD1-CB 3.49Å; I339-P434 HydrophobicContact CG1-CB 4.33Å
340	C	81.7	Confident	86.1	Confident	69 Å²	69	53.3 Å²	53.3	47%	0.466	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	113.1	164.6	-56.1	0	0	0	0	107.8	F342 I345 K346	C340-F342 VanDerWaalsContact C-N 3.32Å; C340-I345 CarbonylContact O-C 3.5Å; C340-I345 WeakPolarHBondContact O-CA 3.36Å; C340-K346 PolarHBondContact N-O 3.02Å; C340-K346 PolarHBondContact O-N 3.38Å
341	D	73.5	Confident	87.1	Confident	35 Å²	35	51.5 Å²	51.5	19%	0.187	27%	0.266	C	S	.	.			trans	-82	-7.8	-179.8	-78.3	-46.8	0	0	0	113.8	K208 I339 Y433	K208-D341 VanDerWaalsContact CE-OD2 3.31Å; K208-D341 WeakPolarHBondContact CE-OD2 3.27Å; K208-D341 IonicContact NZ-OD1 2.65Å; K208-D341 IonicContact NZ-OD2 3.66Å; K208-D341 PolarHBondContact NZ-OD2 3.12Å; I339-D341 PolarHBondContact O-N 3.02Å; D341-Y433 PolarHBondContact OD1-OH 2.65Å; D341-Y433 PolarHBondContact OD2-OH 3.26Å; D341-Y433 VanDerWaalsContact OD2-OH 3.13Å
342	F	69.8	Low	87.3	Confident	182 Å²	182	47.4 Å²	47.4	80%	0.798	25%	0.249	S	C	*	.	S	Bend	trans	-134.8	140.5	-175.2	-173.3	-92.6	0	0	0	111.4	C340 N344	C340-F342 VanDerWaalsContact C-N 3.32Å; F342-N344 VanDerWaalsContact C-N 3.29Å
343	P	71.4	Confident	87.1	Confident	103 Å²	103	51.3 Å²	51.3	67%	0.669	27%	0.269	S	S	*	.	S	Bend	cis	-75.7	-11.7	-5.9	32.8	-36.7	0	0	0	113.6
344	N	77.6	Confident	86.8	Confident	129 Å²	129	54.6 Å²	54.6	69%	0.69	29%	0.289	S	S	*	.	S	Bend	trans	-137.6	142.6	175.4	-71.7	-69.4	0	0	0	109.2	F342 K346	F342-N344 VanDerWaalsContact C-N 3.29Å; N344-K346 PolarHBondContact O-N 3.35Å
345	I	80	Confident	86.4	Confident	105 Å²	105	60.5 Å²	60.5	54%	0.538	32%	0.317	S	S	.	.			trans	-61.4	103.9	178	-56.2	-179.4	0	0	0	110	P205 I339 C340	P205-I345 HydrophobicContact CG-CG2 3.97Å; I339-I345 HydrophobicContact CG2-CG2 3.6Å; C340-I345 CarbonylContact O-C 3.5Å; C340-I345 WeakPolarHBondContact O-CA 3.36Å
346	K	84.1	Confident	86.1	Confident	117 Å²	117	69.9 Å²	69.9	51%	0.509	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	133.5	-178.8	-166.6	-163.4	168.1	-169.6	0	111.3	I339 C340 N344 D349	I339-K346 WeakPolarHBondContact CA-O 3.37Å; C340-K346 PolarHBondContact N-O 3.02Å; C340-K346 PolarHBondContact O-N 3.38Å; N344-K346 PolarHBondContact O-N 3.35Å; K346-D349 WeakPolarHBondContact CE-OD2 2.88Å; K346-D349 IonicContact NZ-OD2 3.8Å; K346-D349 PolarHBondContact NZ-OD2 3Å
347	R	89.5	Confident	85.8	Confident	35 Å²	35	72.1 Å²	72.1	13%	0.132	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	149.1	169.8	-79.4	175.7	-170.5	133.2	5.2	112	M203 P337 V338 I339 D349 P434 C436	M203-R347 PolarHBondContact O-NH1 3.45Å; P337-R347 HydrophobicContact CB-CB 4.43Å; V338-R347 CarbonylContact O-C 3.43Å; V338-R347 WeakPolarHBondContact O-CA 3.5Å; I339-R347 HydrophobicContact CD1-CG 4.25Å; I339-R347 HydrophobicContact CG1-CG 3.69Å; R347-D349 PolarHBondContact O-N 3.37Å; R347-P434 PolarHBondContact NH2-O 3Å; R347-C436 PolarHBondContact NH1-SG 2.95Å; R347-C436 VanDerWaalsContact NH1-SG 3.38Å; R347-C436 VanDerWaalsContact NH2-N 3.18Å
348	A	87.6	Confident	85.7	Confident	26 Å²	26	72.6 Å²	72.6	22%	0.215	37%	0.368	C	S	.	.			trans	-57.5	132.6	167.2	0	0	0	0	0	111.1	P337 V338 L350 D370	P337-A348 HydrophobicContact CB-CB 4.15Å; V338-A348 PolarHBondContact O-N 3.22Å; A348-L350 VanDerWaalsContact C-N 3.29Å; A348-L350 HydrophobicContact CB-CD2 4.37Å; A348-L350 HydrophobicContact CB-CG 4.4Å; A348-L350 PolarHBondContact O-N 3.2Å; A348-D370 HydrophobicContact CB-CB 4.34Å
349	D	87	Confident	85.8	Confident	68 Å²	68	70.9 Å²	70.9	36%	0.364	36%	0.357	S	S	.	.			trans	-83.3	66	-174.8	-73.5	-44.9	0	0	0	111.7	R309 K346 R347 K351	R309-D349 IonicContact CZ-OD1 2.9Å; R309-D349 IonicContact NH1-OD1 2.69Å; R309-D349 PolarHBondContact NH1-OD1 3.16Å; R309-D349 IonicContact NH2-OD1 3.16Å; K346-D349 WeakPolarHBondContact CE-OD2 2.88Å; K346-D349 IonicContact NZ-OD2 3.8Å; K346-D349 PolarHBondContact NZ-OD2 3Å; R347-D349 PolarHBondContact O-N 3.37Å; D349-K351 PolarHBondContact O-N 3.09Å
350	L	91.1	Very high	86.1	Confident	10 Å²	10	71.3 Å²	71.3	5%	0.052	36%	0.36	C	S	.	.			trans	-68.6	89.5	-176.9	-59.7	-177.3	0	0	0	112.3	R309 E310 P337 A348 P352 M359 D370 L371	R309-L350 CarbonylContact C-O 3.58Å; R309-L350 VanDerWaalsContact CA-O 3.27Å; R309-L350 WeakPolarHBondContact CA-O 3.42Å; E310-L350 PolarHBondContact N-O 2.82Å; P337-L350 HydrophobicContact CB-CD1 3.75Å; P337-L350 HydrophobicContact CB-CG 4.12Å; P337-L350 HydrophobicContact CG-CD1 3.93Å; P337-L350 HydrophobicContact CG-CG 4.44Å; A348-L350 VanDerWaalsContact C-N 3.29Å; A348-L350 HydrophobicContact CB-CD2 4.37Å; A348-L350 HydrophobicContact CB-CG 4.4Å; A348-L350 PolarHBondContact O-N 3.2Å; L350-P352 WeakPolarHBondContact O-CD 3.27Å; L350-M359 HydrophobicContact CD1-CE 3.49Å; L350-M359 VanDerWaalsContact CD1-CE 3.49Å; L350-D370 HydrophobicContact CD2-CB 4.27Å; L350-D370 VanDerWaalsContact CD2-CG 3.5Å; L350-D370 WeakPolarHBondContact CD2-OD2 3.46Å; L350-L371 HydrophobicContact CD1-CD2 3.57Å
351	K	92.4	Very high	86.7	Confident	54 Å²	54	70.9 Å²	70.9	24%	0.235	35%	0.351	C	S	.	.			trans	-109.9	82.5	178.7	-69.1	-176.7	166.2	-154.7	0	111.5	D304 A305 V307 R309 D349 I353	D304-K351 PolarHBondContact O-NZ 2.86Å; D304-K351 VanDerWaalsContact O-NZ 3.12Å; A305-K351 PolarHBondContact O-NZ 3.15Å; V307-K351 HydrophobicContact CB-CD 4.45Å; V307-K351 HydrophobicContact CG1-CB 4.36Å; V307-K351 WeakPolarHBondContact O-CD 3.21Å; V307-K351 WeakPolarHBondContact O-CE 3.17Å; V307-K351 PolarHBondContact O-NZ 3.45Å; V307-K351 VanDerWaalsContact O-NZ 3.14Å; R309-K351 HydrophobicContact CG-CG 3.89Å; D349-K351 PolarHBondContact O-N 3.09Å; K351-I353 PolarHBondContact O-N 2.79Å
352	P	90.2	Very high	87.7	Confident	8 Å²	8	71.8 Å²	71.8	5%	0.052	35%	0.351	C	S	.	.			trans	-71	118.3	-176.5	28.3	-35.1	0	0	0	112	P297 E310 L350 D357	P297-P352 WeakPolarHBondContact CG-O 3.42Å; E310-P352 VanDerWaalsContact CD-CG 3.5Å; E310-P352 HydrophobicContact CG-CG 3.85Å; L350-P352 WeakPolarHBondContact O-CD 3.27Å; P352-D357 HydrophobicContact CB-CB 3.81Å
353	I	88.1	Confident	88.9	Confident	89 Å²	89	65.7 Å²	65.7	46%	0.456	32%	0.323	S	S	.	.	S	Bend	trans	-81.2	-49.7	175.6	-57.9	162.7	0	0	0	109.3	I303 K351	I303-I353 HydrophobicContact CG2-CD1 3.45Å; I303-I353 VanDerWaalsContact CG2-CD1 3.45Å; I303-I353 HydrophobicContact CG2-CG1 3.8Å; I303-I353 HydrophobicContact CG2-CG2 4.36Å; K351-I353 PolarHBondContact O-N 2.79Å
354	T	89	Confident	89.9	Confident	73 Å²	73	65.3 Å²	65.3	45%	0.448	31%	0.311	S	S	.	.	S	Bend	trans	-97.9	168.1	175.1	84.5	0	0	0	0	111.7	R356 D357	T354-R356 VanDerWaalsContact C-N 3.3Å; T354-R356 PolarHBondContact O-N 3.44Å; T354-R356 PolarHBondContact OG1-N 2.51Å; T354-D357 WeakPolarHBondContact CA-OD2 3.16Å; T354-D357 VanDerWaalsContact CB-OD2 3.22Å; T354-D357 WeakPolarHBondContact CB-OD2 3.38Å; T354-D357 WeakPolarHBondContact CG2-OD2 3.15Å; T354-D357 PolarHBondContact N-OD2 2.81Å; T354-D357 PolarHBondContact O-N 2.81Å; T354-D357 VanDerWaalsContact OG1-CG 3.24Å; T354-D357 PolarHBondContact OG1-OD2 3.34Å
355	E	88.7	Confident	90.7	Very high	123 Å²	123	62.2 Å²	62.2	58%	0.575	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-67.6	-32.1	177.5	-160.4	153.2	-177.4	0	0	112.1	R298 D357 S358 E361	R298-E355 IonicContact CZ-OE2 3.91Å; R298-E355 IonicContact NH1-OE2 3.68Å; R298-E355 IonicContact NH2-OE2 2.65Å; R298-E355 PolarHBondContact NH2-OE2 2.94Å; E355-D357 PolarHBondContact O-N 3.41Å; E355-S358 WeakPolarHBondContact O-CB 3.33Å; E355-S358 PolarHBondContact O-N 3.17Å; E355-S358 PolarHBondContact O-OG 2.8Å; E355-E361 VanDerWaalsContact O-CG 3.3Å; E355-E361 WeakPolarHBondContact O-CG 3.44Å
356	R	91.2	Very high	91.2	Very high	197 Å²	197	64.1 Å²	64.1	74%	0.743	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-66.9	-20.3	175.4	-62.6	179.9	179.2	173.2	-1.1	113.4	T354 R367	T354-R356 VanDerWaalsContact C-N 3.3Å; T354-R356 PolarHBondContact O-N 3.44Å; T354-R356 PolarHBondContact OG1-N 2.51Å; R356-R367 PolarHBondContact O-NH2 3.03Å
357	D	91.4	Very high	91.6	Very high	49 Å²	49	63.4 Å²	63.4	26%	0.262	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-88.4	-10.8	179.9	-52.7	-48.4	0	0	0	112.5	P352 T354 E355 R362	P352-D357 HydrophobicContact CB-CB 3.81Å; T354-D357 WeakPolarHBondContact CA-OD2 3.16Å; T354-D357 VanDerWaalsContact CB-OD2 3.22Å; T354-D357 WeakPolarHBondContact CB-OD2 3.38Å; T354-D357 WeakPolarHBondContact CG2-OD2 3.15Å; T354-D357 PolarHBondContact N-OD2 2.81Å; T354-D357 PolarHBondContact O-N 2.81Å; T354-D357 VanDerWaalsContact OG1-CG 3.24Å; T354-D357 PolarHBondContact OG1-OD2 3.34Å; E355-D357 PolarHBondContact O-N 3.41Å; D357-R362 WeakPolarHBondContact O-CD 3.49Å; D357-R362 PolarHBondContact O-NE 2.92Å
358	S	93.9	Very high	91.5	Very high	15 Å²	15	63.8 Å²	63.8	11%	0.105	31%	0.312	C	S	.	.	S	Bend	trans	-64.5	150.3	-179	69.6	0	0	0	0	111.9	E310 E355 I360 E361 R362	E310-S358 WeakPolarHBondContact OE2-CA 3.46Å; E355-S358 WeakPolarHBondContact O-CB 3.33Å; E355-S358 PolarHBondContact O-N 3.17Å; E355-S358 PolarHBondContact O-OG 2.8Å; S358-I360 PolarHBondContact O-N 3.11Å; S358-I360 VanDerWaalsContact O-N 3.12Å; S358-E361 PolarHBondContact O-N 2.85Å; S358-E361 VanDerWaalsContact O-N 3.15Å; S358-E361 WeakPolarHBondContact OG-CG 3.39Å; S358-E361 PolarHBondContact OG-N 2.92Å; S358-R362 WeakPolarHBondContact O-CB 3.25Å; S358-R362 WeakPolarHBondContact O-CG 3.39Å; S358-R362 PolarHBondContact O-N 3.12Å
359	M	94.8	Very high	91.5	Very high	1 Å²	1	70 Å²	70	1%	0.005	34%	0.342	C	S	.	.	H	α-helix	trans	-54.8	-33.8	-177.8	-177.3	-178.7	-76.4	0	0	112.6	E310 A312 A313 I335 P337 L350 W363 L371	E310-M359 HydrophobicContact CB-CB 4.44Å; E310-M359 HydrophobicContact CB-CE 4.28Å; E310-M359 WeakPolarHBondContact O-CE 3.23Å; E310-M359 WeakPolarHBondContact OE2-CB 3.4Å; E310-M359 PolarHBondContact OE2-N 3.15Å; A312-M359 VanDerWaalsContact C-SD 3.55Å; A313-M359 HydrophobicContact CB-CB 4.38Å; A313-M359 HydrophobicContact CB-CG 4.01Å; A313-M359 HydrophobicContact CB-SD 3.59Å; A313-M359 VanDerWaalsContact CB-SD 3.59Å; A313-M359 PolarHBondContact N-SD 2.99Å; I335-M359 HydrophobicContact CB-CG 3.86Å; I335-M359 HydrophobicContact CB-SD 3.75Å; I335-M359 HydrophobicContact CG2-CG 3.46Å; I335-M359 VanDerWaalsContact CG2-CG 3.46Å; I335-M359 HydrophobicContact CG2-SD 3.73Å; I335-M359 VanDerWaalsContact O-SD 3.37Å; P337-M359 HydrophobicContact CG-CE 3.94Å; L350-M359 HydrophobicContact CD1-CE 3.49Å; L350-M359 VanDerWaalsContact CD1-CE 3.49Å; M359-W363 WeakPolarHBondContact O-CB 3.11Å; M359-W363 PolarHBondContact O-N 2.93Å; M359-W363 VanDerWaalsContact O-N 3.16Å; M359-L371 HydrophobicContact CE-CD2 4.5Å; M359-L371 HydrophobicContact CG-CD2 3.96Å
360	I	94.9	Very high	91.7	Very high	10 Å²	10	68.9 Å²	68.9	5%	0.051	34%	0.336	C	S	.	.	H	α-helix	trans	-75.3	-45.6	179.6	-62.9	179.2	0	0	0	111.6	Q287 T289 A313 I315 S358 W363 K364	Q287-I360 HydrophobicContact CB-CD1 4.13Å; T289-I360 WeakPolarHBondContact OG1-CD1 3.05Å; A313-I360 HydrophobicContact CB-CD1 4.05Å; A313-I360 HydrophobicContact CB-CG1 3.58Å; I315-I360 HydrophobicContact CD1-CG1 4.39Å; I315-I360 HydrophobicContact CD1-CG2 4.18Å; S358-I360 PolarHBondContact O-N 3.11Å; S358-I360 VanDerWaalsContact O-N 3.12Å; I360-W363 PolarHBondContact O-N 3.42Å; I360-K364 HydrophobicContact CG2-CD 4.21Å; I360-K364 WeakPolarHBondContact O-CB 3.48Å; I360-K364 VanDerWaalsContact O-CG 3.3Å; I360-K364 WeakPolarHBondContact O-CG 3.17Å; I360-K364 PolarHBondContact O-N 3.33Å
361	E	94.7	Very high	91.9	Very high	59 Å²	59	69.1 Å²	69.1	28%	0.276	34%	0.337	S	S	.	.	H	α-helix	trans	-73.9	-28	179	-59.9	-46.1	122.3	0	0	112.4	E355 S358 K364 S365	E355-E361 VanDerWaalsContact O-CG 3.3Å; E355-E361 WeakPolarHBondContact O-CG 3.44Å; S358-E361 PolarHBondContact O-N 2.85Å; S358-E361 VanDerWaalsContact O-N 3.15Å; S358-E361 WeakPolarHBondContact OG-CG 3.39Å; S358-E361 PolarHBondContact OG-N 2.92Å; E361-K364 IonicContact OE1-NZ 3.08Å; E361-K364 PolarHBondContact OE1-NZ 2.85Å; E361-K364 WeakPolarHBondContact OE2-CD 3.5Å; E361-K364 IonicContact OE2-NZ 2.68Å; E361-S365 WeakPolarHBondContact O-CB 3.19Å; E361-S365 PolarHBondContact O-N 3.35Å; E361-S365 PolarHBondContact O-OG 2.83Å
362	R	94.7	Very high	92	Very high	54 Å²	54	67.2 Å²	67.2	20%	0.204	33%	0.33	C	S	.	.	H	α-helix	trans	-60.3	-54.8	167.4	-76.6	179.7	-178	-131.5	2.4	111.6	D357 S358 K364 S365 D366 R367 D370 L371	D357-R362 WeakPolarHBondContact O-CD 3.49Å; D357-R362 PolarHBondContact O-NE 2.92Å; S358-R362 WeakPolarHBondContact O-CB 3.25Å; S358-R362 WeakPolarHBondContact O-CG 3.39Å; S358-R362 PolarHBondContact O-N 3.12Å; R362-K364 PolarHBondContact O-N 3.35Å; R362-S365 CarbonylContact O-C 3.5Å; R362-S365 WeakPolarHBondContact O-CA 3.42Å; R362-S365 PolarHBondContact O-N 2.9Å; R362-D366 PolarHBondContact O-N 3.34Å; R362-R367 HydrophobicContact CB-CB 4.49Å; R362-R367 PolarHBondContact O-N 3.11Å; R362-D370 IonicContact CZ-OD1 3.42Å; R362-D370 IonicContact CZ-OD2 2.68Å; R362-D370 IonicContact NH1-OD1 2.66Å; R362-D370 PolarHBondContact NH1-OD1 3.34Å; R362-D370 IonicContact NH1-OD2 2.78Å; R362-D370 PolarHBondContact NH1-OD2 2.99Å; R362-L371 HydrophobicContact CB-CD1 3.87Å
363	W	94.5	Very high	92.3	Very high	55 Å²	55	69.1 Å²	69.1	21%	0.208	34%	0.338	C	S	.	.	H	α-helix	trans	-60	-42	179	176	76.5	0	0	0	112.8	I315 T333 I335 M359 I360 S365 D366 L371 E373	I315-W363 HydrophobicContact CD1-CD2 4.13Å; I315-W363 HydrophobicContact CD1-CE3 3.36Å; I315-W363 HydrophobicContact CD1-CH2 4.27Å; I315-W363 HydrophobicContact CD1-CZ3 3.44Å; I315-W363 VanDerWaalsContact CD1-CZ3 3.44Å; I315-W363 HydrophobicContact CG2-CZ3 4.45Å; T333-W363 HydrophobicContact CG2-CZ2 4.01Å; I335-W363 HydrophobicContact CD1-CB 4.4Å; I335-W363 VanDerWaalsContact CD1-CD1 3.44Å; I335-W363 HydrophobicContact CD1-CD2 4.17Å; I335-W363 HydrophobicContact CD1-CG 3.74Å; I335-W363 HydrophobicContact CG1-CB 4.38Å; I335-W363 HydrophobicContact CG1-CG 4.15Å; M359-W363 WeakPolarHBondContact O-CB 3.11Å; M359-W363 PolarHBondContact O-N 2.93Å; M359-W363 VanDerWaalsContact O-N 3.16Å; I360-W363 PolarHBondContact O-N 3.42Å; W363-S365 PolarHBondContact O-N 3.08Å; W363-S365 VanDerWaalsContact O-N 3.17Å; W363-D366 PolarHBondContact O-N 3.24Å; W363-L371 HydrophobicContact CB-CD1 4.27Å; W363-E373 PolarHBondContact NE1-OE2 2.99Å
364	K	93.1	Very high	92.7	Very high	95 Å²	95	64.9 Å²	64.9	41%	0.413	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-15.6	172.5	-72.7	171.2	-178	170	0	114.8	I360 E361 R362	I360-K364 HydrophobicContact CG2-CD 4.21Å; I360-K364 WeakPolarHBondContact O-CB 3.48Å; I360-K364 VanDerWaalsContact O-CG 3.3Å; I360-K364 WeakPolarHBondContact O-CG 3.17Å; I360-K364 PolarHBondContact O-N 3.33Å; E361-K364 IonicContact OE1-NZ 3.08Å; E361-K364 PolarHBondContact OE1-NZ 2.85Å; E361-K364 WeakPolarHBondContact OE2-CD 3.5Å; E361-K364 IonicContact OE2-NZ 2.68Å; R362-K364 PolarHBondContact O-N 3.35Å
365	S	93.2	Very high	93	Very high	64 Å²	64	62.1 Å²	62.1	45%	0.448	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.4	14.4	179.7	-49.3	0	0	0	0	112.2	E361 R362 W363 R367	E361-S365 WeakPolarHBondContact O-CB 3.19Å; E361-S365 PolarHBondContact O-N 3.35Å; E361-S365 PolarHBondContact O-OG 2.83Å; R362-S365 CarbonylContact O-C 3.5Å; R362-S365 WeakPolarHBondContact O-CA 3.42Å; R362-S365 PolarHBondContact O-N 2.9Å; W363-S365 PolarHBondContact O-N 3.08Å; W363-S365 VanDerWaalsContact O-N 3.17Å; S365-R367 PolarHBondContact O-N 3.24Å
366	D	91.5	Very high	93.2	Very high	145 Å²	145	58.2 Å²	58.2	78%	0.775	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.9	15.3	-173.9	-60.1	-52.7	0	0	0	115.6	R362 W363 C368	R362-D366 PolarHBondContact O-N 3.34Å; W363-D366 PolarHBondContact O-N 3.24Å; D366-C368 VanDerWaalsContact C-N 3.29Å; D366-C368 PolarHBondContact O-N 3.34Å
367	R	91.2	Very high	93.2	Very high	102 Å²	102	49.9 Å²	49.9	39%	0.385	25%	0.254	S	S	.	.			trans	-83.6	73.5	176.1	-71.5	-175.9	-65	130.9	7	110	R356 R362 S365	R356-R367 PolarHBondContact O-NH2 3.03Å; R362-R367 HydrophobicContact CB-CB 4.49Å; R362-R367 PolarHBondContact O-N 3.11Å; S365-R367 PolarHBondContact O-N 3.24Å
368	C	87.9	Confident	93.1	Very high	43 Å²	43	51.7 Å²	51.7	29%	0.291	27%	0.271	S	S	.	.			trans	-106	9.8	-168.4	-67.7	0	0	0	0	114.8	D366 D370 L371	D366-C368 VanDerWaalsContact C-N 3.29Å; D366-C368 PolarHBondContact O-N 3.34Å; C368-D370 PolarHBondContact O-N 2.85Å; C368-D370 VanDerWaalsContact O-N 3.15Å; C368-L371 HydrophobicContact CB-CB 4.34Å; C368-L371 PolarHBondContact O-N 3.14Å
369	D	89	Confident	92.7	Very high	155 Å²	155	52.4 Å²	52.4	83%	0.829	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-32.5	-172.4	-46.5	-60.6	0	0	0	114.1
370	D	90.9	Very high	92.2	Very high	45 Å²	45	57.8 Å²	57.8	24%	0.241	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106	16.3	176.1	59.6	10.3	0	0	0	114	V338 A348 L350 R362 C368	V338-D370 VanDerWaalsContact CG2-C 3.45Å; V338-D370 PolarHBondContact N-O 2.98Å; A348-D370 HydrophobicContact CB-CB 4.34Å; L350-D370 HydrophobicContact CD2-CB 4.27Å; L350-D370 VanDerWaalsContact CD2-CG 3.5Å; L350-D370 WeakPolarHBondContact CD2-OD2 3.46Å; R362-D370 IonicContact CZ-OD1 3.42Å; R362-D370 IonicContact CZ-OD2 2.68Å; R362-D370 IonicContact NH1-OD1 2.66Å; R362-D370 PolarHBondContact NH1-OD1 3.34Å; R362-D370 IonicContact NH1-OD2 2.78Å; R362-D370 PolarHBondContact NH1-OD2 2.99Å; C368-D370 PolarHBondContact O-N 2.85Å; C368-D370 VanDerWaalsContact O-N 3.15Å
371	L	94.6	Very high	91.7	Very high	16 Å²	16	61 Å²	61	8%	0.084	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	139.7	-175.1	-54.3	-175.8	0	0	0	113.1	I335 L336 L350 M359 R362 W363 C368	I335-L371 HydrophobicContact CG2-CB 3.92Å; I335-L371 HydrophobicContact CG2-CD1 4.04Å; I335-L371 HydrophobicContact CG2-CD2 4.07Å; I335-L371 HydrophobicContact CG2-CG 4.24Å; L336-L371 CarbonylContact O-C 3.56Å; L336-L371 WeakPolarHBondContact O-CA 3.49Å; L350-L371 HydrophobicContact CD1-CD2 3.57Å; M359-L371 HydrophobicContact CE-CD2 4.5Å; M359-L371 HydrophobicContact CG-CD2 3.96Å; R362-L371 HydrophobicContact CB-CD1 3.87Å; W363-L371 HydrophobicContact CB-CD1 4.27Å; C368-L371 HydrophobicContact CB-CB 4.34Å; C368-L371 PolarHBondContact O-N 3.14Å
372	I	94.5	Very high	91.2	Very high	14 Å²	14	60.3 Å²	60.3	7%	0.072	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	118.7	168	-56.1	171.2	0	0	0	108	Y49 I335 L336 V338 L374 P434	Y49-I372 HydrophobicContact CD1-CD1 4.04Å; Y49-I372 HydrophobicContact CE1-CD1 4.45Å; I335-I372 WeakPolarHBondContact CA-O 3.43Å; L336-I372 HydrophobicContact CB-CB 4.4Å; L336-I372 PolarHBondContact N-O 3.35Å; L336-I372 PolarHBondContact O-N 3.49Å; V338-I372 HydrophobicContact CG2-CG1 3.85Å; I372-L374 HydrophobicContact CG2-CD2 3.74Å; I372-L374 HydrophobicContact CG2-CG 4.23Å; I372-P434 HydrophobicContact CD1-CG 4.21Å
373	E	95.9	Very high	90.9	Very high	47 Å²	47	63.2 Å²	63.2	22%	0.22	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	120.4	170.7	-168.4	-168.4	147	0	0	111.3	T333 I335 W363 H408 K409	T333-E373 HydrophobicContact CG2-CG 3.57Å; I335-E373 HydrophobicContact CD1-CB 4.04Å; I335-E373 HydrophobicContact CD1-CG 3.71Å; W363-E373 PolarHBondContact NE1-OE2 2.99Å; E373-H408 PolarHBondContact O-CD2 2.99Å; E373-K409 WeakPolarHBondContact OE1-CE 3.43Å; E373-K409 IonicContact OE1-NZ 2.62Å; E373-K409 PolarHBondContact OE1-NZ 3.38Å; E373-K409 IonicContact OE2-NZ 3.36Å; E373-K409 PolarHBondContact OE2-NZ 3.17Å
374	L	96.9	Very high	90.5	Very high	0 Å²	0	67.7 Å²	67.7	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	153.7	170.1	-51.5	-177.1	0	0	0	110.5	T333 V334 L336 I372 I406 I407 H408 I416	T333-L374 WeakPolarHBondContact CA-O 3.32Å; V334-L374 HydrophobicContact CB-CB 4.28Å; V334-L374 PolarHBondContact N-O 2.95Å; V334-L374 PolarHBondContact O-N 3.1Å; L336-L374 HydrophobicContact CD1-CD1 3.67Å; L336-L374 HydrophobicContact CD1-CG 4.47Å; L336-L374 HydrophobicContact CG-CD1 4.39Å; I372-L374 HydrophobicContact CG2-CD2 3.74Å; I372-L374 HydrophobicContact CG2-CG 4.23Å; L374-I406 HydrophobicContact CB-CG2 3.55Å; L374-I406 HydrophobicContact CD1-CG2 3.9Å; L374-I406 HydrophobicContact CG-CG2 4.36Å; L374-I407 WeakPolarHBondContact CA-O 3.43Å; L374-H408 HydrophobicContact CD2-CB 3.84Å; L374-I416 HydrophobicContact CD1-CD1 3.94Å; L374-I416 HydrophobicContact CD1-CG2 3.94Å; L374-I416 HydrophobicContact CD2-CD1 3.52Å; L374-I416 HydrophobicContact CG-CD1 4.37Å
375	G	94.9	Very high	90	Very high	15 Å²	15	65.7 Å²	65.7	16%	0.155	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	163.3	176.3	0	0	0	0	0	112.2	M332 I406 I407	M332-G375 WeakPolarHBondContact O-CA 3.48Å; G375-I406 WeakPolarHBondContact O-CA 3.38Å; G375-I407 PolarHBondContact N-O 3.4Å; G375-I407 WeakPolarHBondContact O-CG1 3.26Å; G375-I407 PolarHBondContact O-N 2.8Å
376	N	93.2	Very high	89.6	Confident	41 Å²	41	68.2 Å²	68.2	22%	0.219	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	140.2	167.6	65.3	-83.5	0	0	0	111.2	M332 S378 Q405 I406	M332-N376 HydrophobicContact CB-CB 4.27Å; M332-N376 PolarHBondContact N-OD1 3.36Å; M332-N376 PolarHBondContact O-N 2.94Å; M332-N376 VanDerWaalsContact O-N 3.08Å; N376-S378 PolarHBondContact O-N 2.84Å; N376-Q405 CarbonylContact C-O 3.6Å; N376-Q405 VanDerWaalsContact CA-O 3.22Å; N376-Q405 WeakPolarHBondContact CA-O 3.38Å; N376-I406 HydrophobicContact CB-CD1 4.38Å
377	K	92.7	Very high	89	Confident	23 Å²	23	61.8 Å²	61.8	10%	0.1	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-67.1	127.9	169.3	-169.2	164.6	-172.4	159.9	0	108.5	L390 Q405 I407 P412 E413	K377-L390 HydrophobicContact CB-CD2 4.24Å; K377-L390 HydrophobicContact CD-CD2 4.43Å; K377-L390 HydrophobicContact CG-CD2 4.09Å; K377-Q405 HydrophobicContact CB-CB 4.17Å; K377-Q405 PolarHBondContact N-O 2.74Å; K377-I407 HydrophobicContact CB-CD1 3.89Å; K377-I407 HydrophobicContact CB-CG1 4.06Å; K377-I407 HydrophobicContact CB-CG2 4.09Å; K377-I407 HydrophobicContact CD-CG2 4.24Å; K377-I407 HydrophobicContact CG-CD1 3.99Å; K377-P412 WeakPolarHBondContact CE-O 3.42Å; K377-P412 PolarHBondContact NZ-O 2.66Å; K377-E413 IonicContact NZ-OE1 2.71Å; K377-E413 PolarHBondContact NZ-OE1 3.36Å; K377-E413 IonicContact NZ-OE2 3.34Å; K377-E413 PolarHBondContact NZ-OE2 3.17Å
378	S	88.2	Confident	88.4	Confident	87 Å²	87	59.9 Å²	59.9	61%	0.608	32%	0.321	S	S	*	.	P	Polyproline II helix	trans	-64.6	136.6	172.5	-58.8	0	0	0	0	109.7	N376	N376-S378 PolarHBondContact O-N 2.84Å
379	P	85.4	Confident	88.1	Confident	30 Å²	30	59.4 Å²	59.4	20%	0.195	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-69.4	149.4	177.1	32.6	-36.8	0	0	0	110.6	Y388 I389 L390	P379-Y388 HydrophobicContact CG-CD1 4.24Å; P379-Y388 HydrophobicContact CG-CG 4.37Å; P379-I389 CarbonylContact C-O 3.46Å; P379-I389 WeakPolarHBondContact CA-O 3.37Å; P379-I389 WeakPolarHBondContact CB-O 3.24Å; P379-L390 HydrophobicContact CB-CD2 4.45Å; P379-L390 HydrophobicContact CB-CG 4.14Å
380	I	85	Confident	88	Confident	113 Å²	113	52.6 Å²	52.6	58%	0.579	28%	0.279	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.3	135.8	-179.5	-59.4	173.8	0	0	0	108.2	N382 Y388 I389	I380-N382 PolarHBondContact O-N 3.37Å; I380-Y388 WeakPolarHBondContact O-CA 3.43Å; I380-I389 PolarHBondContact N-O 3.08Å; I380-I389 PolarHBondContact O-N 3.29Å
381	W	84	Confident	87.9	Confident	79 Å²	79	54.8 Å²	54.8	30%	0.299	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	124.6	171.9	178	-95.1	0	0	0	110.4	Q386 Y388	W381-Q386 WeakPolarHBondContact CH2-O 2.99Å; W381-Y388 HydrophobicContact CB-CD1 4.19Å; W381-Y388 HydrophobicContact CB-CE1 4Å; W381-Y388 HydrophobicContact CE3-CD1 4.49Å; W381-Y388 AromaticContact CE3-CD2 3.71Å; W381-Y388 HydrophobicContact CE3-CD2 3.71Å; W381-Y388 HydrophobicContact CE3-CE1 4.41Å; W381-Y388 AromaticContact CE3-CE2 3.62Å; W381-Y388 HydrophobicContact CE3-CE2 3.62Å; W381-Y388 HydrophobicContact CE3-CG 4.16Å; W381-Y388 AromaticContact CE3-CZ 4Å; W381-Y388 HydrophobicContact CZ3-CD2 4.08Å; W381-Y388 HydrophobicContact CZ3-CE2 4.04Å
382	N	83.2	Confident	87.7	Confident	43 Å²	43	54.4 Å²	54.4	23%	0.23	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	127.1	170.9	173.7	-94.1	0	0	0	109.7	I380 D384 A385 Q386 S387 I389	I380-N382 PolarHBondContact O-N 3.37Å; N382-D384 PolarHBondContact ND2-OD2 3.24Å; N382-D384 PolarHBondContact OD1-N 3.24Å; N382-A385 WeakPolarHBondContact OD1-CB 3.27Å; N382-A385 PolarHBondContact OD1-N 3.46Å; N382-Q386 PolarHBondContact O-N 3.46Å; N382-Q386 VanDerWaalsContact O-N 3.14Å; N382-S387 PolarHBondContact N-O 2.88Å; N382-S387 PolarHBondContact O-N 2.97Å; N382-S387 VanDerWaalsContact O-N 3.15Å; N382-I389 HydrophobicContact CB-CD1 3.57Å; N382-I389 HydrophobicContact CB-CG1 3.86Å
383	E	88.4	Confident	87.5	Confident	115 Å²	115	60.5 Å²	60.5	54%	0.537	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-39.2	-176	-55.8	-156.9	102.8	0	0	112.6	R23 A385 Q386	R23-E383 IonicContact CZ-OE1 3.85Å; R23-E383 IonicContact NH1-OE1 3.5Å; R23-E383 PolarHBondContact NH1-OE1 3.3Å; R23-E383 IonicContact NH2-OE1 3.59Å; R23-E383 PolarHBondContact NH2-OE1 2.95Å; E383-A385 VanDerWaalsContact C-N 3.29Å; E383-A385 PolarHBondContact O-N 2.92Å; E383-Q386 PolarHBondContact O-N 3.15Å; E383-Q386 VanDerWaalsContact O-N 3.14Å; E383-Q386 PolarHBondContact O-NE2 2.89Å
384	D	86.2	Confident	87.2	Confident	150 Å²	150	60.9 Å²	60.9	80%	0.802	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-37.7	-178.5	-45.9	-71	0	0	0	112.1	N382	N382-D384 PolarHBondContact ND2-OD2 3.24Å; N382-D384 PolarHBondContact OD1-N 3.24Å
385	A	83.6	Confident	87.1	Confident	52 Å²	52	63.3 Å²	63.3	43%	0.43	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	1.5	178.8	0	0	0	0	0	113.4	N382 E383 S387	N382-A385 WeakPolarHBondContact OD1-CB 3.27Å; N382-A385 PolarHBondContact OD1-N 3.46Å; E383-A385 VanDerWaalsContact C-N 3.29Å; E383-A385 PolarHBondContact O-N 2.92Å; A385-S387 WeakPolarHBondContact CB-OG 3.49Å; A385-S387 WeakPolarHBondContact O-CB 3.22Å; A385-S387 PolarHBondContact O-N 2.85Å; A385-S387 VanDerWaalsContact O-N 3.11Å; A385-S387 PolarHBondContact O-OG 2.97Å
386	Q	83.7	Confident	86.8	Confident	117 Å²	117	62.6 Å²	62.6	55%	0.547	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	41.8	45.8	-175.7	-71	-67.5	-64.9	0	0	113.2	W381 N382 E383	W381-Q386 WeakPolarHBondContact CH2-O 2.99Å; N382-Q386 PolarHBondContact O-N 3.46Å; N382-Q386 VanDerWaalsContact O-N 3.14Å; E383-Q386 PolarHBondContact O-N 3.15Å; E383-Q386 VanDerWaalsContact O-N 3.14Å; E383-Q386 PolarHBondContact O-NE2 2.89Å
387	S	78.6	Confident	86.7	Confident	10 Å²	10	63.9 Å²	63.9	7%	0.07	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160	156.4	-170.6	49.6	0	0	0	0	114.2	N382 A385	N382-S387 PolarHBondContact N-O 2.88Å; N382-S387 PolarHBondContact O-N 2.97Å; N382-S387 VanDerWaalsContact O-N 3.15Å; A385-S387 WeakPolarHBondContact CB-OG 3.49Å; A385-S387 WeakPolarHBondContact O-CB 3.22Å; A385-S387 PolarHBondContact O-N 2.85Å; A385-S387 VanDerWaalsContact O-N 3.11Å; A385-S387 PolarHBondContact O-OG 2.97Å
388	Y	80	Confident	86.3	Confident	62 Å²	62	65.9 Å²	65.9	24%	0.243	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	126.3	166.6	-71.5	-82.5	0	0	0	110.2	V17 T19 P379 I380 W381	V17-Y388 PolarHBondContact N-O 2.82Å; V17-Y388 WeakPolarHBondContact O-CB 3.49Å; V17-Y388 VanDerWaalsContact O-O 3.13Å; T19-Y388 WeakPolarHBondContact O-CD2 3.33Å; T19-Y388 WeakPolarHBondContact O-CE2 3.42Å; T19-Y388 WeakPolarHBondContact OG1-CD2 3.4Å; P379-Y388 HydrophobicContact CG-CD1 4.24Å; P379-Y388 HydrophobicContact CG-CG 4.37Å; I380-Y388 WeakPolarHBondContact O-CA 3.43Å; W381-Y388 HydrophobicContact CB-CD1 4.19Å; W381-Y388 HydrophobicContact CB-CE1 4Å; W381-Y388 HydrophobicContact CE3-CD1 4.49Å; W381-Y388 AromaticContact CE3-CD2 3.71Å; W381-Y388 HydrophobicContact CE3-CD2 3.71Å; W381-Y388 HydrophobicContact CE3-CE1 4.41Å; W381-Y388 AromaticContact CE3-CE2 3.62Å; W381-Y388 HydrophobicContact CE3-CE2 3.62Å; W381-Y388 HydrophobicContact CE3-CG 4.16Å; W381-Y388 AromaticContact CE3-CZ 4Å; W381-Y388 HydrophobicContact CZ3-CD2 4.08Å; W381-Y388 HydrophobicContact CZ3-CE2 4.04Å
389	I	82.1	Confident	86.1	Confident	33 Å²	33	64.6 Å²	64.6	17%	0.169	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	158.5	-177.2	67	170.1	0	0	0	112.2	M15 P379 I380 N382	M15-I389 WeakPolarHBondContact O-CG2 3.43Å; P379-I389 CarbonylContact C-O 3.46Å; P379-I389 WeakPolarHBondContact CA-O 3.37Å; P379-I389 WeakPolarHBondContact CB-O 3.24Å; I380-I389 PolarHBondContact N-O 3.08Å; I380-I389 PolarHBondContact O-N 3.29Å; N382-I389 HydrophobicContact CB-CD1 3.57Å; N382-I389 HydrophobicContact CB-CG1 3.86Å
390	L	86.8	Confident	86	Confident	12 Å²	12	63.6 Å²	63.6	6%	0.063	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	141	162.6	-73.4	171.9	0	0	0	108.7	K377 P379 F392 Q405	K377-L390 HydrophobicContact CB-CD2 4.24Å; K377-L390 HydrophobicContact CD-CD2 4.43Å; K377-L390 HydrophobicContact CG-CD2 4.09Å; P379-L390 HydrophobicContact CB-CD2 4.45Å; P379-L390 HydrophobicContact CB-CG 4.14Å; L390-F392 HydrophobicContact CB-CD2 4.23Å; L390-F392 HydrophobicContact CB-CE2 3.64Å; L390-F392 HydrophobicContact CB-CZ 3.87Å; L390-F392 HydrophobicContact CD1-CZ 4.1Å; L390-F392 WeakPolarHBondContact O-CD2 3.33Å; L390-F392 PolarHBondContact O-N 2.93Å; L390-Q405 HydrophobicContact CD1-CB 4.44Å; L390-Q405 HydrophobicContact CD1-CG 4.5Å
391	N	88.9	Confident	85.7	Confident	92 Å²	92	63 Å²	63	49%	0.492	34%	0.344	S	S	.	.			trans	-82	99.2	177	178	12	0	0	0	110.4	H393 Q405	N391-H393 VanDerWaalsContact C-N 3.29Å; N391-H393 PolarHBondContact ND2-CE1 3.44Å; N391-H393 PolarHBondContact ND2-NE2 3.47Å; N391-H393 VanDerWaalsContact ND2-NE2 3.11Å; N391-H393 PolarHBondContact O-CE1 2.82Å; N391-H393 PolarHBondContact O-N 2.82Å; N391-H393 PolarHBondContact O-ND1 2.91Å; N391-H393 VanDerWaalsContact O-ND1 3.13Å; N391-H393 PolarHBondContact OD1-N 2.87Å; N391-Q405 PolarHBondContact O-NE2 2.74Å
392	F	90.4	Very high	85.7	Confident	8 Å²	8	60.6 Å²	60.6	4%	0.035	34%	0.336	C	S	.	.			trans	-84.3	6.9	178.1	-68.5	-78.1	0	0	0	114.6	M15 L390 G394 R395 V396 N403 Q405 Q418	M15-F392 HydrophobicContact CE-CD2 4.47Å; L390-F392 HydrophobicContact CB-CD2 4.23Å; L390-F392 HydrophobicContact CB-CE2 3.64Å; L390-F392 HydrophobicContact CB-CZ 3.87Å; L390-F392 HydrophobicContact CD1-CZ 4.1Å; L390-F392 WeakPolarHBondContact O-CD2 3.33Å; L390-F392 PolarHBondContact O-N 2.93Å; F392-G394 PolarHBondContact O-N 2.92Å; F392-R395 WeakPolarHBondContact O-CB 3.39Å; F392-R395 PolarHBondContact O-N 2.87Å; F392-V396 HydrophobicContact CB-CB 3.74Å; F392-V396 HydrophobicContact CB-CG2 3.74Å; F392-V396 HydrophobicContact CD1-CB 4.05Å; F392-V396 HydrophobicContact CD1-CG2 3.34Å; F392-V396 HydrophobicContact CD2-CB 4.21Å; F392-V396 HydrophobicContact CD2-CG2 4.38Å; F392-V396 HydrophobicContact CE1-CG2 4Å; F392-V396 HydrophobicContact CG-CB 3.75Å; F392-V396 HydrophobicContact CG-CG2 3.57Å; F392-N403 HydrophobicContact CE2-CB 4.26Å; F392-N403 HydrophobicContact CZ-CB 3.82Å; F392-Q405 HydrophobicContact CD1-CG 4.46Å; F392-Q405 HydrophobicContact CE1-CG 4.06Å; F392-Q418 HydrophobicContact CD1-CG 3.67Å; F392-Q418 HydrophobicContact CE1-CG 4.13Å
393	H	89.4	Confident	86.1	Confident	141 Å²	141	59 Å²	59	65%	0.653	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.3	33.8	178.5	-58.8	87.8	0	0	0	114.1	N391 R395	N391-H393 VanDerWaalsContact C-N 3.29Å; N391-H393 PolarHBondContact ND2-CE1 3.44Å; N391-H393 PolarHBondContact ND2-NE2 3.47Å; N391-H393 VanDerWaalsContact ND2-NE2 3.11Å; N391-H393 PolarHBondContact O-CE1 2.82Å; N391-H393 PolarHBondContact O-N 2.82Å; N391-H393 PolarHBondContact O-ND1 2.91Å; N391-H393 VanDerWaalsContact O-ND1 3.13Å; N391-H393 PolarHBondContact OD1-N 2.87Å; H393-R395 VanDerWaalsContact C-N 3.25Å; H393-R395 PolarHBondContact O-N 2.82Å
394	G	89.5	Confident	86.4	Confident	55 Å²	55	54.4 Å²	54.4	57%	0.567	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.4	4.7	-177.6	0	0	0	0	0	115.9	F392	F392-G394 PolarHBondContact O-N 2.92Å
395	R	94	Very high	86.8	Confident	51 Å²	51	47.7 Å²	47.7	19%	0.192	27%	0.269	C	S	.	.	S	Bend	trans	-72.2	-32.1	175.6	-66.1	-71.8	-65.9	150.2	2.2	112.6	C214 E236 F392 H393 I422 S428 D430	C214-R395 PolarHBondContact O-NH2 3.11Å; C214-R395 VanDerWaalsContact O-NH2 3.08Å; E236-R395 IonicContact OE2-CZ 3.97Å; E236-R395 IonicContact OE2-NH1 3.92Å; E236-R395 PolarHBondContact OE2-NH1 2.84Å; E236-R395 IonicContact OE2-NH2 3.76Å; E236-R395 PolarHBondContact OE2-NH2 2.9Å; E236-R395 VanDerWaalsContact OE2-NH2 3.12Å; F392-R395 WeakPolarHBondContact O-CB 3.39Å; F392-R395 PolarHBondContact O-N 2.87Å; H393-R395 VanDerWaalsContact C-N 3.25Å; H393-R395 PolarHBondContact O-N 2.82Å; R395-I422 WeakPolarHBondContact O-CD1 3.44Å; R395-I422 WeakPolarHBondContact O-CG1 3.46Å; R395-S428 WeakPolarHBondContact O-CB 3.31Å; R395-S428 PolarHBondContact O-OG 2.86Å; R395-D430 WeakPolarHBondContact CG-OD2 3.37Å; R395-D430 IonicContact CZ-OD1 3.24Å; R395-D430 IonicContact NE-OD1 3.67Å; R395-D430 PolarHBondContact NE-OD1 2.93Å; R395-D430 IonicContact NE-OD2 2.66Å; R395-D430 PolarHBondContact NE-OD2 2.77Å; R395-D430 VanDerWaalsContact NE-OD2 3.08Å; R395-D430 IonicContact NH2-OD1 3.46Å; R395-D430 PolarHBondContact NH2-OD1 3.43Å
396	V	90.5	Very high	87.5	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.006	25%	0.249	C	C	.	.			trans	-111.4	140.7	179	-167.3	0	0	0	0	109.5	M15 F392 R421 S428	M15-V396 HydrophobicContact CE-CB 4.11Å; M15-V396 HydrophobicContact CE-CG1 3.36Å; M15-V396 VanDerWaalsContact SD-C 3.59Å; M15-V396 HydrophobicContact SD-CB 4.28Å; M15-V396 HydrophobicContact SD-CG1 3.93Å; F392-V396 HydrophobicContact CB-CB 3.74Å; F392-V396 HydrophobicContact CB-CG2 3.74Å; F392-V396 HydrophobicContact CD1-CB 4.05Å; F392-V396 HydrophobicContact CD1-CG2 3.34Å; F392-V396 HydrophobicContact CD2-CB 4.21Å; F392-V396 HydrophobicContact CD2-CG2 4.38Å; F392-V396 HydrophobicContact CE1-CG2 4Å; F392-V396 HydrophobicContact CG-CB 3.75Å; F392-V396 HydrophobicContact CG-CG2 3.57Å; V396-R421 WeakPolarHBondContact CG1-O 3.35Å; V396-S428 VanDerWaalsContact CG2-OG 3.31Å; V396-S428 WeakPolarHBondContact CG2-OG 3.16Å
397	T	89.6	Confident	88.1	Confident	68 Å²	68	40.5 Å²	40.5	42%	0.417	23%	0.227	S	C	.	.			trans	-136.8	-2.5	-173.4	59.1	0	0	0	0	115.9	M15 R421 I422	M15-T397 WeakPolarHBondContact SD-CA 3.19Å; T397-R421 PolarHBondContact N-O 2.96Å; T397-R421 VanDerWaalsContact N-O 3.15Å; T397-I422 WeakPolarHBondContact OG1-CA 3.28Å; T397-I422 WeakPolarHBondContact OG1-CG2 3.39Å; T397-I422 PolarHBondContact OG1-O 3.28Å; T397-I422 VanDerWaalsContact OG1-O 3.12Å
398	Q	85.7	Confident	88.9	Confident	65 Å²	65	41.5 Å²	41.5	30%	0.304	23%	0.23	S	C	.	.	S	Bend	trans	-125.7	127.7	172.9	-77.9	-174.3	-20.3	0	0	111.9	M15 S400 N403 R421 I422 S423	M15-Q398 VanDerWaalsContact CE-C 3.41Å; M15-Q398 WeakPolarHBondContact CE-O 3.49Å; M15-Q398 PolarHBondContact SD-N 3.4Å; M15-Q398 VanDerWaalsContact SD-N 3.36Å; Q398-S400 PolarHBondContact O-N 2.85Å; Q398-N403 PolarHBondContact O-ND2 2.8Å; Q398-R421 HydrophobicContact CB-CB 4.14Å; Q398-R421 HydrophobicContact CB-CG 3.9Å; Q398-R421 PolarHBondContact N-O 3.02Å; Q398-I422 WeakPolarHBondContact CG-O 3.46Å; Q398-S423 VanDerWaalsContact OE1-CA 3.23Å
399	A	83	Confident	89.5	Confident	59 Å²	59	44.4 Å²	44.4	49%	0.488	24%	0.244	S	C	.	.			trans	-56.8	136.1	172.1	0	0	0	0	0	111.3
400	S	83.1	Confident	90	Very high	10 Å²	10	49.5 Å²	49.5	7%	0.07	27%	0.272	C	S	.	.			trans	-170.9	146.7	177.2	-170.4	0	0	0	0	110.3	Q398 K402 N403	Q398-S400 PolarHBondContact O-N 2.85Å; S400-K402 PolarHBondContact O-N 3.22Å; S400-K402 PolarHBondContact OG-N 2.8Å; S400-N403 PolarHBondContact N-ND2 2.93Å; S400-N403 VanDerWaalsContact N-ND2 3.11Å; S400-N403 WeakPolarHBondContact O-CB 3.27Å; S400-N403 PolarHBondContact O-N 2.82Å; S400-N403 VanDerWaalsContact O-N 3.14Å; S400-N403 PolarHBondContact O-ND2 3.17Å
401	V	78.6	Confident	90.4	Very high	100 Å²	100	51.1 Å²	51.1	61%	0.606	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-5.6	170.8	-60.6	0	0	0	0	114
402	K	85	Confident	90.5	Very high	29 Å²	29	49.6 Å²	49.6	13%	0.126	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-3.8	176.7	-54	-174.7	-176.9	74.5	0	113.1	E158 S400 F404 F419 F448	E158-K402 IonicContact OE1-NZ 2.68Å; E158-K402 PolarHBondContact OE1-NZ 3.12Å; S400-K402 PolarHBondContact O-N 3.22Å; S400-K402 PolarHBondContact OG-N 2.8Å; K402-F404 VanDerWaalsContact O-CD1 3.32Å; K402-F404 WeakPolarHBondContact O-CD1 3.29Å; K402-F419 HydrophobicContact CB-CE1 4.44Å; K402-F419 WeakPolarHBondContact O-CD1 3.07Å; K402-F419 VanDerWaalsContact O-CE1 3.29Å; K402-F419 WeakPolarHBondContact O-CE1 3.45Å; K402-F448 HydrophobicContact CD-CD1 4.44Å
403	N	91.5	Very high	90.6	Very high	10 Å²	10	55.8 Å²	55.8	5%	0.053	31%	0.305	C	S	.	.			trans	-86.7	128.2	-178.8	-57	-26.1	0	0	0	110.9	M15 F392 Q398 S400 F419 G420 R421	M15-N403 WeakPolarHBondContact CE-ND2 3.39Å; F392-N403 HydrophobicContact CE2-CB 4.26Å; F392-N403 HydrophobicContact CZ-CB 3.82Å; Q398-N403 PolarHBondContact O-ND2 2.8Å; S400-N403 PolarHBondContact N-ND2 2.93Å; S400-N403 VanDerWaalsContact N-ND2 3.11Å; S400-N403 WeakPolarHBondContact O-CB 3.27Å; S400-N403 PolarHBondContact O-N 2.82Å; S400-N403 VanDerWaalsContact O-N 3.14Å; S400-N403 PolarHBondContact O-ND2 3.17Å; N403-F419 WeakPolarHBondContact CA-O 3.41Å; N403-G420 WeakPolarHBondContact OD1-CA 3.5Å; N403-R421 PolarHBondContact OD1-N 3.01Å
404	F	93.6	Very high	90.9	Very high	18 Å²	18	52 Å²	52	8%	0.079	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	160.5	-179.6	60.5	-95.8	0	0	0	113.4	M332 K402 I406 M417 F419 I443	M332-F404 HydrophobicContact CE-CD2 4.42Å; M332-F404 HydrophobicContact CE-CE1 4.36Å; M332-F404 HydrophobicContact CE-CE2 3.86Å; M332-F404 HydrophobicContact CE-CZ 3.83Å; M332-F404 HydrophobicContact SD-CD1 4.29Å; M332-F404 HydrophobicContact SD-CD2 4.29Å; M332-F404 HydrophobicContact SD-CE1 4.28Å; M332-F404 HydrophobicContact SD-CE2 4.28Å; M332-F404 HydrophobicContact SD-CG 4.31Å; M332-F404 HydrophobicContact SD-CZ 4.27Å; K402-F404 VanDerWaalsContact O-CD1 3.32Å; K402-F404 WeakPolarHBondContact O-CD1 3.29Å; F404-I406 HydrophobicContact CD2-CD1 3.6Å; F404-I406 HydrophobicContact CD2-CG1 3.76Å; F404-I406 HydrophobicContact CE2-CD1 3.89Å; F404-I406 HydrophobicContact CE2-CG1 3.78Å; F404-M417 HydrophobicContact CE2-CE 4.31Å; F404-M417 HydrophobicContact CE2-SD 4.33Å; F404-M417 HydrophobicContact CZ-CE 4.4Å; F404-F419 AromaticContact CD1-CD1 3.97Å; F404-F419 HydrophobicContact CD1-CD1 3.97Å; F404-F419 HydrophobicContact CD2-CB 4.4Å; F404-F419 HydrophobicContact CE1-CB 4.06Å; F404-F419 AromaticContact CE1-CD1 3.37Å; F404-F419 HydrophobicContact CE1-CD1 3.37Å; F404-F419 HydrophobicContact CE1-CE1 4.19Å; F404-F419 HydrophobicContact CE1-CG 4.04Å; F404-F419 HydrophobicContact CE2-CB 3.93Å; F404-F419 HydrophobicContact CZ-CB 3.74Å; F404-F419 AromaticContact CZ-CD1 3.82Å; F404-F419 HydrophobicContact CZ-CD1 3.82Å; F404-F419 HydrophobicContact CZ-CG 4.02Å; F404-F419 PolarHBondContact N-O 2.64Å; F404-F419 PolarHBondContact O-N 2.83Å; F404-I443 HydrophobicContact CE2-CG2 4.25Å; F404-I443 HydrophobicContact CZ-CG2 4.22Å
405	Q	96.1	Very high	91.2	Very high	8 Å²	8	51 Å²	51	4%	0.037	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	140.3	164.5	-72.8	172.2	-19.7	0	0	108.2	N376 K377 L390 N391 F392 V415 M417 Q418	N376-Q405 CarbonylContact C-O 3.6Å; N376-Q405 VanDerWaalsContact CA-O 3.22Å; N376-Q405 WeakPolarHBondContact CA-O 3.38Å; K377-Q405 HydrophobicContact CB-CB 4.17Å; K377-Q405 PolarHBondContact N-O 2.74Å; L390-Q405 HydrophobicContact CD1-CB 4.44Å; L390-Q405 HydrophobicContact CD1-CG 4.5Å; N391-Q405 PolarHBondContact O-NE2 2.74Å; F392-Q405 HydrophobicContact CD1-CG 4.46Å; F392-Q405 HydrophobicContact CE1-CG 4.06Å; Q405-V415 HydrophobicContact CB-CG1 4.05Å; Q405-V415 HydrophobicContact CG-CG1 3.98Å; Q405-M417 CarbonylContact C-O 3.56Å; Q405-M417 VanDerWaalsContact CA-O 3.31Å; Q405-M417 WeakPolarHBondContact CA-O 3.45Å; Q405-Q418 HydrophobicContact CG-CB 4.3Å; Q405-Q418 HydrophobicContact CG-CG 4.13Å
406	I	97	Very high	91.4	Very high	1 Å²	1	48.6 Å²	48.6	1%	0.005	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	134.5	175	-53.8	-59.9	0	0	0	108.9	M332 V334 L374 G375 N376 F404 I416 M417	M332-I406 HydrophobicContact CE-CD1 3.93Å; M332-I406 HydrophobicContact CG-CD1 4.43Å; M332-I406 HydrophobicContact SD-CD1 4.09Å; V334-I406 HydrophobicContact CG2-CD1 4.26Å; L374-I406 HydrophobicContact CB-CG2 3.55Å; L374-I406 HydrophobicContact CD1-CG2 3.9Å; L374-I406 HydrophobicContact CG-CG2 4.36Å; G375-I406 WeakPolarHBondContact O-CA 3.38Å; N376-I406 HydrophobicContact CB-CD1 4.38Å; F404-I406 HydrophobicContact CD2-CD1 3.6Å; F404-I406 HydrophobicContact CD2-CG1 3.76Å; F404-I406 HydrophobicContact CE2-CD1 3.89Å; F404-I406 HydrophobicContact CE2-CG1 3.78Å; I406-I416 PolarHBondContact O-N 2.93Å; I406-M417 HydrophobicContact CB-CB 3.97Å; I406-M417 HydrophobicContact CG1-CB 4.08Å; I406-M417 PolarHBondContact N-O 2.83Å; I406-M417 PolarHBondContact O-N 2.85Å
407	I	96.9	Very high	91.7	Very high	18 Å²	18	48.6 Å²	48.6	9%	0.092	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	161.7	-176.7	54.4	163.2	0	0	0	110.6	L374 G375 K377 P412 V415	L374-I407 WeakPolarHBondContact CA-O 3.43Å; G375-I407 PolarHBondContact N-O 3.4Å; G375-I407 WeakPolarHBondContact O-CG1 3.26Å; G375-I407 PolarHBondContact O-N 2.8Å; K377-I407 HydrophobicContact CB-CD1 3.89Å; K377-I407 HydrophobicContact CB-CG1 4.06Å; K377-I407 HydrophobicContact CB-CG2 4.09Å; K377-I407 HydrophobicContact CD-CG2 4.24Å; K377-I407 HydrophobicContact CG-CD1 3.99Å; I407-P412 HydrophobicContact CD1-CB 3.84Å; I407-P412 WeakPolarHBondContact CG2-O 3.31Å; I407-V415 HydrophobicContact CG2-CG2 4.42Å
408	H	95.6	Very high	92.1	Very high	30 Å²	30	46 Å²	46	14%	0.139	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	140.8	164.5	-175	-106	0	0	0	109.3	E373 L374 N410 N411 I416	E373-H408 PolarHBondContact O-CD2 2.99Å; L374-H408 HydrophobicContact CD2-CB 3.84Å; H408-N410 PolarHBondContact ND1-N 2.89Å; H408-N410 PolarHBondContact O-N 3.02Å; H408-N410 VanDerWaalsContact O-N 3.17Å; H408-N411 CarbonylContact O-C 3.5Å; H408-N411 VanDerWaalsContact O-C 3.23Å; H408-N411 PolarHBondContact O-N 3.39Å; H408-I416 HydrophobicContact CB-CD1 4.01Å
409	K	92.2	Very high	92.6	Very high	124 Å²	124	43 Å²	43	54%	0.539	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-40.6	-176.1	-65.1	174.4	-174.6	166.8	0	112.4	E373 N411	E373-K409 WeakPolarHBondContact OE1-CE 3.43Å; E373-K409 IonicContact OE1-NZ 2.62Å; E373-K409 PolarHBondContact OE1-NZ 3.38Å; E373-K409 IonicContact OE2-NZ 3.36Å; E373-K409 PolarHBondContact OE2-NZ 3.17Å; K409-N411 VanDerWaalsContact C-N 3.29Å; K409-N411 PolarHBondContact O-N 3.13Å
410	N	93.6	Very high	93.2	Very high	139 Å²	139	40.1 Å²	40.1	74%	0.743	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-2.7	-176.3	-50.9	5.5	0	0	0	113.3	H408	H408-N410 PolarHBondContact ND1-N 2.89Å; H408-N410 PolarHBondContact O-N 3.02Å; H408-N410 VanDerWaalsContact O-N 3.17Å
411	N	93.6	Very high	93.7	Very high	47 Å²	47	41.6 Å²	41.6	25%	0.251	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	79.8	175.5	-170.9	-18.1	0	0	0	110.2	H408 K409 E413 Y414	H408-N411 CarbonylContact O-C 3.5Å; H408-N411 VanDerWaalsContact O-C 3.23Å; H408-N411 PolarHBondContact O-N 3.39Å; K409-N411 VanDerWaalsContact C-N 3.29Å; K409-N411 PolarHBondContact O-N 3.13Å; N411-E413 VanDerWaalsContact C-N 3.27Å; N411-E413 PolarHBondContact O-N 3.23Å; N411-Y414 PolarHBondContact O-N 2.65Å; N411-Y414 WeakPolarHBondContact OD1-CB 3.12Å; N411-Y414 PolarHBondContact OD1-N 3.47Å; N411-Y414 VanDerWaalsContact OD1-N 3.12Å
412	P	92.5	Very high	94.5	Very high	60 Å²	60	38.3 Å²	38.3	39%	0.39	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	-14.4	-174.4	29.6	-36	0	0	0	114.3	K377 I407	K377-P412 WeakPolarHBondContact CE-O 3.42Å; K377-P412 PolarHBondContact NZ-O 2.66Å; I407-P412 HydrophobicContact CD1-CB 3.84Å; I407-P412 WeakPolarHBondContact CG2-O 3.31Å
413	E	92.3	Very high	94.9	Very high	138 Å²	138	38.9 Å²	38.9	65%	0.645	20%	0.195	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-88.2	-20.5	176.4	-61.3	-43.9	116.5	0	0	113	K377 N411 V415	K377-E413 IonicContact NZ-OE1 2.71Å; K377-E413 PolarHBondContact NZ-OE1 3.36Å; K377-E413 IonicContact NZ-OE2 3.34Å; K377-E413 PolarHBondContact NZ-OE2 3.17Å; N411-E413 VanDerWaalsContact C-N 3.27Å; N411-E413 PolarHBondContact O-N 3.23Å; E413-V415 PolarHBondContact O-N 2.95Å; E413-V415 VanDerWaalsContact O-N 3.12Å
414	Y	95	Very high	94.8	Very high	60 Å²	60	42.3 Å²	42.3	24%	0.235	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	93.7	172.6	-171.1	-118.3	0	0	0	111.9	N411 I416 S432 Y433	N411-Y414 PolarHBondContact O-N 2.65Å; N411-Y414 WeakPolarHBondContact OD1-CB 3.12Å; N411-Y414 PolarHBondContact OD1-N 3.47Å; N411-Y414 VanDerWaalsContact OD1-N 3.12Å; Y414-I416 HydrophobicContact CD1-CD1 4.32Å; Y414-I416 HydrophobicContact CD1-CG1 3.58Å; Y414-I416 HydrophobicContact CE1-CG1 3.66Å; Y414-I416 PolarHBondContact O-N 3.29Å; Y414-I416 VanDerWaalsContact O-N 3.1Å; Y414-S432 VanDerWaalsContact OH-CB 3.28Å; Y414-S432 WeakPolarHBondContact OH-CB 3.38Å; Y414-Y433 VanDerWaalsContact CE1-O 3.32Å; Y414-Y433 WeakPolarHBondContact CE1-O 3.17Å; Y414-Y433 PolarHBondContact OH-N 3.3Å; Y414-Y433 PolarHBondContact OH-O 3.44Å
415	V	96	Very high	94.8	Very high	36 Å²	36	44.1 Å²	44.1	22%	0.218	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	100.7	173.9	-179.3	0	0	0	0	110.1	Q405 I407 E413 M417 Q418 S432	Q405-V415 HydrophobicContact CB-CG1 4.05Å; Q405-V415 HydrophobicContact CG-CG1 3.98Å; I407-V415 HydrophobicContact CG2-CG2 4.42Å; E413-V415 PolarHBondContact O-N 2.95Å; E413-V415 VanDerWaalsContact O-N 3.12Å; V415-M417 VanDerWaalsContact CG1-O 3.31Å; V415-M417 WeakPolarHBondContact CG1-O 3.24Å; V415-Q418 HydrophobicContact CG1-CB 4.05Å; V415-S432 PolarHBondContact O-OG 3.24Å
416	I	97.8	Very high	94.8	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	-35.5	179.2	-68.3	165.5	0	0	0	111	L374 I406 H408 Y414 Y431 S432 L435	L374-I416 HydrophobicContact CD1-CD1 3.94Å; L374-I416 HydrophobicContact CD1-CG2 3.94Å; L374-I416 HydrophobicContact CD2-CD1 3.52Å; L374-I416 HydrophobicContact CG-CD1 4.37Å; I406-I416 PolarHBondContact O-N 2.93Å; H408-I416 HydrophobicContact CB-CD1 4.01Å; Y414-I416 HydrophobicContact CD1-CD1 4.32Å; Y414-I416 HydrophobicContact CD1-CG1 3.58Å; Y414-I416 HydrophobicContact CE1-CG1 3.66Å; Y414-I416 PolarHBondContact O-N 3.29Å; Y414-I416 VanDerWaalsContact O-N 3.1Å; I416-Y431 WeakPolarHBondContact O-CA 3.4Å; I416-S432 PolarHBondContact O-N 2.65Å; I416-L435 HydrophobicContact CG2-CD1 3.77Å; I416-L435 HydrophobicContact CG2-CG 3.94Å
417	M	97.9	Very high	94.8	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	143.3	175	-167.4	-175.6	166.2	0	0	110.7	F404 Q405 I406 V415 F419 M429 D430 L435 A440 I443 A444	F404-M417 HydrophobicContact CE2-CE 4.31Å; F404-M417 HydrophobicContact CE2-SD 4.33Å; F404-M417 HydrophobicContact CZ-CE 4.4Å; Q405-M417 CarbonylContact C-O 3.56Å; Q405-M417 VanDerWaalsContact CA-O 3.31Å; Q405-M417 WeakPolarHBondContact CA-O 3.45Å; I406-M417 HydrophobicContact CB-CB 3.97Å; I406-M417 HydrophobicContact CG1-CB 4.08Å; I406-M417 PolarHBondContact N-O 2.83Å; I406-M417 PolarHBondContact O-N 2.85Å; V415-M417 VanDerWaalsContact CG1-O 3.31Å; V415-M417 WeakPolarHBondContact CG1-O 3.24Å; M417-F419 HydrophobicContact CE-CB 4.26Å; M417-M429 HydrophobicContact CE-CG 3.69Å; M417-M429 HydrophobicContact CE-SD 4.05Å; M417-D430 CarbonylContact C-O 3.48Å; M417-D430 WeakPolarHBondContact CA-O 3.38Å; M417-D430 WeakPolarHBondContact CG-O 3.28Å; M417-L435 HydrophobicContact CB-CD1 3.71Å; M417-L435 HydrophobicContact CG-CD1 4.1Å; M417-L435 HydrophobicContact SD-CD1 4.13Å; M417-A440 HydrophobicContact CE-CB 4.27Å; M417-A440 WeakPolarHBondContact CE-O 3.37Å; M417-A440 HydrophobicContact SD-CB 4.29Å; M417-I443 HydrophobicContact CE-CB 4.12Å; M417-I443 HydrophobicContact CE-CG2 4.04Å; M417-I443 HydrophobicContact SD-CB 3.89Å; M417-I443 HydrophobicContact SD-CD1 4.08Å; M417-I443 HydrophobicContact SD-CG2 3.63Å; M417-A444 HydrophobicContact CE-CB 3.99Å
418	Q	96.8	Very high	94.9	Very high	15 Å²	15	45.5 Å²	45.5	7%	0.07	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	131.5	173.2	175.8	172.7	-99.3	0	0	109.5	F392 Q405 V415 M429 D430	F392-Q418 HydrophobicContact CD1-CG 3.67Å; F392-Q418 HydrophobicContact CE1-CG 4.13Å; Q405-Q418 HydrophobicContact CG-CB 4.3Å; Q405-Q418 HydrophobicContact CG-CG 4.13Å; V415-Q418 HydrophobicContact CG1-CB 4.05Å; Q418-M429 CarbonylContact O-C 3.59Å; Q418-M429 WeakPolarHBondContact O-CA 3.2Å; Q418-D430 HydrophobicContact CB-CB 4.23Å; Q418-D430 PolarHBondContact N-O 2.75Å; Q418-D430 PolarHBondContact NE2-OD2 3.47Å; Q418-D430 PolarHBondContact O-N 3.41Å
419	F	96.7	Very high	95	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	144.3	180	174.3	-96.6	0	0	0	111.9	I216 K402 N403 F404 M417 F427 S428 M429 A444 S447 F448	I216-F419 HydrophobicContact CD1-CD2 4.5Å; I216-F419 HydrophobicContact CD1-CE2 4.07Å; K402-F419 HydrophobicContact CB-CE1 4.44Å; K402-F419 WeakPolarHBondContact O-CD1 3.07Å; K402-F419 VanDerWaalsContact O-CE1 3.29Å; K402-F419 WeakPolarHBondContact O-CE1 3.45Å; N403-F419 WeakPolarHBondContact CA-O 3.41Å; F404-F419 AromaticContact CD1-CD1 3.97Å; F404-F419 HydrophobicContact CD1-CD1 3.97Å; F404-F419 HydrophobicContact CD2-CB 4.4Å; F404-F419 HydrophobicContact CE1-CB 4.06Å; F404-F419 AromaticContact CE1-CD1 3.37Å; F404-F419 HydrophobicContact CE1-CD1 3.37Å; F404-F419 HydrophobicContact CE1-CE1 4.19Å; F404-F419 HydrophobicContact CE1-CG 4.04Å; F404-F419 HydrophobicContact CE2-CB 3.93Å; F404-F419 HydrophobicContact CZ-CB 3.74Å; F404-F419 AromaticContact CZ-CD1 3.82Å; F404-F419 HydrophobicContact CZ-CD1 3.82Å; F404-F419 HydrophobicContact CZ-CG 4.02Å; F404-F419 PolarHBondContact N-O 2.64Å; F404-F419 PolarHBondContact O-N 2.83Å; M417-F419 HydrophobicContact CE-CB 4.26Å; F419-F427 HydrophobicContact CD2-CB 4.48Å; F419-F427 HydrophobicContact CE2-CB 3.57Å; F419-F427 HydrophobicContact CE2-CD1 4.41Å; F419-F427 HydrophobicContact CE2-CG 4.14Å; F419-F427 HydrophobicContact CZ-CB 3.89Å; F419-F427 AromaticContact CZ-CD1 3.83Å; F419-F427 HydrophobicContact CZ-CD1 3.83Å; F419-F427 AromaticContact CZ-CG 3.97Å; F419-F427 HydrophobicContact CZ-CG 3.97Å; F419-S428 WeakPolarHBondContact CA-O 3.27Å; F419-S428 WeakPolarHBondContact CD2-O 3.43Å; F419-M429 HydrophobicContact CD2-CB 4.11Å; F419-M429 HydrophobicContact CD2-CG 4.28Å; F419-A444 HydrophobicContact CD2-CB 3.85Å; F419-A444 HydrophobicContact CE2-CB 3.93Å; F419-A444 HydrophobicContact CG-CB 4.41Å; F419-S447 VanDerWaalsContact CE1-OG 3.24Å; F419-S447 WeakPolarHBondContact CE1-OG 3.21Å; F419-F448 HydrophobicContact CE2-CZ 4.02Å; F419-F448 AromaticContact CZ-CE1 3.7Å; F419-F448 HydrophobicContact CZ-CE1 3.7Å; F419-F448 HydrophobicContact CZ-CE2 4.44Å; F419-F448 AromaticContact CZ-CZ 3.58Å; F419-F448 HydrophobicContact CZ-CZ 3.58Å
420	G	94.5	Very high	95.2	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	176.6	171.4	172.2	0	0	0	0	0	115.8	N403 F427 S428	N403-G420 WeakPolarHBondContact OD1-CA 3.5Å; G420-F427 CarbonylContact O-C 3.49Å; G420-F427 WeakPolarHBondContact O-CA 3.3Å; G420-F427 WeakPolarHBondContact O-CB 3.5Å; G420-S428 PolarHBondContact N-O 3.12Å; G420-S428 VanDerWaalsContact N-O 3.16Å; G420-S428 PolarHBondContact O-N 2.99Å; G420-S428 PolarHBondContact O-OG 3.46Å
421	R	94.3	Very high	95.5	Very high	41 Å²	41	32 Å²	32	16%	0.155	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	129.1	-175.8	-167.6	-179.9	173.4	167.2	-3.7	112.6	E160 V396 T397 Q398 N403 S423 D424 F427	E160-R421 IonicContact OE2-NH1 2.78Å; E160-R421 PolarHBondContact OE2-NH1 2.84Å; V396-R421 WeakPolarHBondContact CG1-O 3.35Å; T397-R421 PolarHBondContact N-O 2.96Å; T397-R421 VanDerWaalsContact N-O 3.15Å; Q398-R421 HydrophobicContact CB-CB 4.14Å; Q398-R421 HydrophobicContact CB-CG 3.9Å; Q398-R421 PolarHBondContact N-O 3.02Å; N403-R421 PolarHBondContact OD1-N 3.01Å; R421-S423 WeakPolarHBondContact CG-O 3.19Å; R421-D424 IonicContact CZ-OD1 2.7Å; R421-D424 IonicContact NE-OD1 3.99Å; R421-D424 IonicContact NH2-OD1 2.91Å; R421-D424 PolarHBondContact NH2-OD1 3.16Å; R421-F427 HydrophobicContact CB-CD1 3.96Å; R421-F427 HydrophobicContact CB-CE1 3.92Å; R421-F427 HydrophobicContact CG-CD1 4.25Å; R421-F427 HydrophobicContact CG-CE1 3.82Å
422	I	94.8	Very high	95.6	Very high	30 Å²	30	29.8 Å²	29.8	15%	0.154	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	-44.6	170.5	-56.1	179.3	0	0	0	109.4	R395 T397 Q398 I426	R395-I422 WeakPolarHBondContact O-CD1 3.44Å; R395-I422 WeakPolarHBondContact O-CG1 3.46Å; T397-I422 WeakPolarHBondContact OG1-CA 3.28Å; T397-I422 WeakPolarHBondContact OG1-CG2 3.39Å; T397-I422 PolarHBondContact OG1-O 3.28Å; T397-I422 VanDerWaalsContact OG1-O 3.12Å; Q398-I422 WeakPolarHBondContact CG-O 3.46Å; I422-I426 WeakPolarHBondContact CA-O 3.09Å; I422-I426 HydrophobicContact CB-CG2 4.32Å; I422-I426 WeakPolarHBondContact CB-O 3.5Å; I422-I426 HydrophobicContact CD1-CG2 4.39Å; I422-I426 PolarHBondContact N-O 2.88Å
423	S	93.9	Very high	95.8	Very high	42 Å²	42	27.2 Å²	27.2	29%	0.294	14%	0.137	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	174.4	167.6	72.6	0	0	0	0	109.8	Q398 R421 N425 I426	Q398-S423 VanDerWaalsContact OE1-CA 3.23Å; R421-S423 WeakPolarHBondContact CG-O 3.19Å; S423-N425 PolarHBondContact O-N 2.62Å; S423-I426 PolarHBondContact N-O 3.49Å; S423-I426 PolarHBondContact O-N 3.15Å; S423-I426 WeakPolarHBondContact OG-CB 3.23Å; S423-I426 WeakPolarHBondContact OG-CG1 3.25Å
424	D	90.7	Very high	95.9	Very high	81 Å²	81	20.8 Å²	20.8	43%	0.433	11%	0.106	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.9	-26.2	-174.8	-50.5	-18.1	0	0	0	115.4	R218 R421	R218-D424 PolarHBondContact NE-O 3.38Å; R218-D424 PolarHBondContact NH2-O 2.84Å; R421-D424 IonicContact CZ-OD1 2.7Å; R421-D424 IonicContact NE-OD1 3.99Å; R421-D424 IonicContact NH2-OD1 2.91Å; R421-D424 PolarHBondContact NH2-OD1 3.16Å
425	N	93.4	Very high	96.1	Very high	56 Å²	56	17.9 Å²	17.9	30%	0.299	10%	0.095	S	C	.	.	T	Hydrogen-bonded Turn	trans	-130.6	14.9	-179	-68.2	-48.1	0	0	0	113.2	T217 R218 S423	T217-N425 CarbonylContact C-O 3.57Å; T217-N425 WeakPolarHBondContact CA-O 3.45Å; R218-N425 HydrophobicContact CB-CB 4.17Å; R218-N425 PolarHBondContact N-O 2.98Å; R218-N425 PolarHBondContact NE-OD1 2.92Å; R218-N425 WeakPolarHBondContact O-CB 3.46Å; R218-N425 PolarHBondContact O-OD1 2.93Å; S423-N425 PolarHBondContact O-N 2.62Å
426	I	96.1	Very high	96.1	Very high	52 Å²	52	16.2 Å²	16.2	27%	0.267	9%	0.085	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	126.3	179.8	-54.9	179.3	0	0	0	109.8	R215 I216 I422 S423	R215-I426 HydrophobicContact CG-CG2 3.78Å; I216-I426 WeakPolarHBondContact O-CA 3.4Å; I422-I426 WeakPolarHBondContact CA-O 3.09Å; I422-I426 HydrophobicContact CB-CG2 4.32Å; I422-I426 WeakPolarHBondContact CB-O 3.5Å; I422-I426 HydrophobicContact CD1-CG2 4.39Å; I422-I426 PolarHBondContact N-O 2.88Å; S423-I426 PolarHBondContact N-O 3.49Å; S423-I426 PolarHBondContact O-N 3.15Å; S423-I426 WeakPolarHBondContact OG-CB 3.23Å; S423-I426 WeakPolarHBondContact OG-CG1 3.25Å
427	F	97.1	Very high	96.1	Very high	4 Å²	4	16.2 Å²	16.2	2%	0.018	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	141.4	-177.1	-51.5	-95.1	0	0	0	109.8	R215 I216 R218 F419 G420 R421 F448	R215-F427 CarbonylContact C-O 3.52Å; R215-F427 WeakPolarHBondContact CA-O 3.21Å; I216-F427 HydrophobicContact CB-CB 4.38Å; I216-F427 PolarHBondContact N-O 3.17Å; I216-F427 PolarHBondContact O-N 2.83Å; R218-F427 HydrophobicContact CB-CE2 4.13Å; F419-F427 HydrophobicContact CD2-CB 4.48Å; F419-F427 HydrophobicContact CE2-CB 3.57Å; F419-F427 HydrophobicContact CE2-CD1 4.41Å; F419-F427 HydrophobicContact CE2-CG 4.14Å; F419-F427 HydrophobicContact CZ-CB 3.89Å; F419-F427 AromaticContact CZ-CD1 3.83Å; F419-F427 HydrophobicContact CZ-CD1 3.83Å; F419-F427 AromaticContact CZ-CG 3.97Å; F419-F427 HydrophobicContact CZ-CG 3.97Å; G420-F427 CarbonylContact O-C 3.49Å; G420-F427 WeakPolarHBondContact O-CA 3.3Å; G420-F427 WeakPolarHBondContact O-CB 3.5Å; R421-F427 HydrophobicContact CB-CD1 3.96Å; R421-F427 HydrophobicContact CB-CE1 3.92Å; R421-F427 HydrophobicContact CG-CD1 4.25Å; R421-F427 HydrophobicContact CG-CE1 3.82Å; F427-F448 AromaticContact CD1-CE1 3.9Å; F427-F448 HydrophobicContact CD1-CE1 3.9Å; F427-F448 HydrophobicContact CD1-CZ 4.4Å; F427-F448 AromaticContact CD2-CE1 3.78Å; F427-F448 HydrophobicContact CD2-CE1 3.78Å; F427-F448 AromaticContact CD2-CZ 3.77Å; F427-F448 HydrophobicContact CD2-CZ 3.77Å; F427-F448 AromaticContact CE1-CE1 3.76Å; F427-F448 HydrophobicContact CE1-CE1 3.76Å; F427-F448 AromaticContact CE2-CE1 3.63Å; F427-F448 HydrophobicContact CE2-CE1 3.63Å; F427-F448 HydrophobicContact CE2-CZ 4.02Å; F427-F448 AromaticContact CG-CE1 3.94Å; F427-F448 HydrophobicContact CG-CE1 3.94Å; F427-F448 HydrophobicContact CG-CZ 4.01Å; F427-F448 HydrophobicContact CZ-CD1 4.44Å; F427-F448 AromaticContact CZ-CE1 3.64Å; F427-F448 HydrophobicContact CZ-CE1 3.64Å; F427-F448 HydrophobicContact CZ-CZ 4.45Å
428	S	97.5	Very high	96.1	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	143.3	164.5	51.6	0	0	0	0	109.4	R395 V396 F419 G420	R395-S428 WeakPolarHBondContact O-CB 3.31Å; R395-S428 PolarHBondContact O-OG 2.86Å; V396-S428 VanDerWaalsContact CG2-OG 3.31Å; V396-S428 WeakPolarHBondContact CG2-OG 3.16Å; F419-S428 WeakPolarHBondContact CA-O 3.27Å; F419-S428 WeakPolarHBondContact CD2-O 3.43Å; G420-S428 PolarHBondContact N-O 3.12Å; G420-S428 VanDerWaalsContact N-O 3.16Å; G420-S428 PolarHBondContact O-N 2.99Å; G420-S428 PolarHBondContact O-OG 3.46Å
429	M	97.8	Very high	96.2	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	109.1	167.6	-170.8	-161.8	83.5	0	0	108	C214 I216 L233 M417 Q418 F419 Y431 A440 F441 A444	C214-M429 CarbonylContact C-O 3.51Å; C214-M429 VanDerWaalsContact CA-O 3.24Å; C214-M429 WeakPolarHBondContact CA-O 3.17Å; C214-M429 HydrophobicContact CB-CE 4.28Å; C214-M429 WeakPolarHBondContact CB-O 3.11Å; C214-M429 PolarHBondContact N-O 3.27Å; C214-M429 PolarHBondContact O-N 2.65Å; I216-M429 HydrophobicContact CD1-CB 3.94Å; I216-M429 HydrophobicContact CD1-CG 4.31Å; I216-M429 HydrophobicContact CD1-SD 3.85Å; I216-M429 HydrophobicContact CG1-CB 4.29Å; L233-M429 HydrophobicContact CD1-CE 3.63Å; L233-M429 HydrophobicContact CD1-SD 4.09Å; L233-M429 HydrophobicContact CD2-CE 4.12Å; M417-M429 HydrophobicContact CE-CG 3.69Å; M417-M429 HydrophobicContact CE-SD 4.05Å; Q418-M429 CarbonylContact O-C 3.59Å; Q418-M429 WeakPolarHBondContact O-CA 3.2Å; F419-M429 HydrophobicContact CD2-CB 4.11Å; F419-M429 HydrophobicContact CD2-CG 4.28Å; M429-Y431 HydrophobicContact CE-CD1 3.86Å; M429-Y431 HydrophobicContact CE-CE1 4.34Å; M429-A440 HydrophobicContact CE-CB 3.54Å; M429-A440 HydrophobicContact SD-CB 3.9Å; M429-F441 HydrophobicContact SD-CB 4.5Å; M429-A444 HydrophobicContact CG-CB 4.38Å; M429-A444 HydrophobicContact SD-CB 3.99Å
430	D	97.8	Very high	96.3	Very high	7 Å²	7	15.5 Å²	15.5	4%	0.037	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	139.9	176.7	-46.3	-47.3	0	0	0	108.7	T211 F212 K213 R395 M417 Q418	T211-D430 HydrophobicContact CG2-CB 3.99Å; F212-D430 VanDerWaalsContact O-CA 3.3Å; F212-D430 WeakPolarHBondContact O-CA 3.35Å; K213-D430 WeakPolarHBondContact CA-OD1 3.33Å; R395-D430 WeakPolarHBondContact CG-OD2 3.37Å; R395-D430 IonicContact CZ-OD1 3.24Å; R395-D430 IonicContact NE-OD1 3.67Å; R395-D430 PolarHBondContact NE-OD1 2.93Å; R395-D430 IonicContact NE-OD2 2.66Å; R395-D430 PolarHBondContact NE-OD2 2.77Å; R395-D430 VanDerWaalsContact NE-OD2 3.08Å; R395-D430 IonicContact NH2-OD1 3.46Å; R395-D430 PolarHBondContact NH2-OD1 3.43Å; M417-D430 CarbonylContact C-O 3.48Å; M417-D430 WeakPolarHBondContact CA-O 3.38Å; M417-D430 WeakPolarHBondContact CG-O 3.28Å; Q418-D430 HydrophobicContact CB-CB 4.23Å; Q418-D430 PolarHBondContact N-O 2.75Å; Q418-D430 PolarHBondContact NE2-OD2 3.47Å; Q418-D430 PolarHBondContact O-N 3.41Å
431	Y	98.1	Very high	96.5	Very high	3 Å²	3	15.5 Å²	15.5	1%	0.012	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	148.9	178.8	74	-82.9	0	0	0	113.1	A206 T211 F212 I416 M429 L435 A437 A440	A206-Y431 HydrophobicContact CB-CD2 4.05Å; A206-Y431 HydrophobicContact CB-CE2 3.88Å; T211-Y431 CarbonylContact C-O 3.59Å; T211-Y431 WeakPolarHBondContact CA-O 3.19Å; F212-Y431 HydrophobicContact CB-CD1 3.98Å; F212-Y431 HydrophobicContact CB-CE1 3.49Å; F212-Y431 VanDerWaalsContact CB-CE1 3.49Å; F212-Y431 HydrophobicContact CB-CE2 4.25Å; F212-Y431 HydrophobicContact CD2-CE2 4.04Å; F212-Y431 HydrophobicContact CG-CE1 4.28Å; F212-Y431 HydrophobicContact CG-CE2 4.37Å; F212-Y431 AromaticContact CG-CZ 3.9Å; F212-Y431 PolarHBondContact N-O 3.03Å; F212-Y431 PolarHBondContact O-N 3.14Å; I416-Y431 WeakPolarHBondContact O-CA 3.4Å; M429-Y431 HydrophobicContact CE-CD1 3.86Å; M429-Y431 HydrophobicContact CE-CE1 4.34Å; Y431-L435 HydrophobicContact CD2-CB 4.05Å; Y431-A437 HydrophobicContact CE1-CB 4.18Å; Y431-A440 HydrophobicContact CD1-CB 4.11Å; Y431-A440 HydrophobicContact CG-CB 3.89Å
432	S	97.2	Very high	96.6	Very high	1 Å²	1	13.6 Å²	13.6	1%	0.007	7%	0.074	C	C	.	.			trans	-128	177.1	-178.3	-44.4	0	0	0	0	109.8	T211 Y414 V415 I416 L435	T211-S432 PolarHBondContact OG1-OG 3.15Å; Y414-S432 VanDerWaalsContact OH-CB 3.28Å; Y414-S432 WeakPolarHBondContact OH-CB 3.38Å; V415-S432 PolarHBondContact O-OG 3.24Å; I416-S432 PolarHBondContact O-N 2.65Å; S432-L435 WeakPolarHBondContact O-CB 3.49Å; S432-L435 PolarHBondContact O-N 2.89Å
433	Y	95.6	Very high	96.8	Very high	6 Å²	6	12.2 Å²	12.2	2%	0.024	7%	0.067	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.9	141.4	170.6	-176.9	-93.4	0	0	0	110.5	Y49 P205 A206 K208 I339 D341 Y414	Y49-Y433 HydrophobicContact CD1-CE1 4.18Å; Y49-Y433 HydrophobicContact CD2-CD1 4.37Å; Y49-Y433 AromaticContact CD2-CE1 3.81Å; Y49-Y433 HydrophobicContact CD2-CE1 3.81Å; Y49-Y433 HydrophobicContact CE2-CD1 4.44Å; Y49-Y433 HydrophobicContact CE2-CE1 4.3Å; Y49-Y433 AromaticContact CG-CE1 3.74Å; Y49-Y433 HydrophobicContact CG-CE1 3.74Å; P205-Y433 HydrophobicContact CB-CD2 4.26Å; P205-Y433 HydrophobicContact CB-CE2 4.35Å; A206-Y433 WeakPolarHBondContact O-CB 3.36Å; A206-Y433 WeakPolarHBondContact O-CD2 3.01Å; K208-Y433 HydrophobicContact CG-CD1 4.07Å; K208-Y433 HydrophobicContact CG-CD2 3.91Å; K208-Y433 HydrophobicContact CG-CE1 4.45Å; K208-Y433 HydrophobicContact CG-CE2 4.31Å; K208-Y433 HydrophobicContact CG-CG 3.79Å; I339-Y433 WeakPolarHBondContact CB-OH 3.4Å; I339-Y433 HydrophobicContact CD1-CE2 3.79Å; I339-Y433 HydrophobicContact CG2-CE2 4.45Å; I339-Y433 WeakPolarHBondContact CG2-OH 3.47Å; D341-Y433 PolarHBondContact OD1-OH 2.65Å; D341-Y433 PolarHBondContact OD2-OH 3.26Å; D341-Y433 VanDerWaalsContact OD2-OH 3.13Å; Y414-Y433 VanDerWaalsContact CE1-O 3.32Å; Y414-Y433 WeakPolarHBondContact CE1-O 3.17Å; Y414-Y433 PolarHBondContact OH-N 3.3Å; Y414-Y433 PolarHBondContact OH-O 3.44Å
434	P	96	Very high	96.9	Very high	2 Å²	2	10.2 Å²	10.2	1%	0.013	5%	0.053	C	C	.	.	T	Hydrogen-bonded Turn	cis	-88	5.4	3.3	34.6	-37.2	0	0	0	115.9	Y49 L336 I339 R347 I372	Y49-P434 HydrophobicContact CE1-CG 4.35Å; L336-P434 HydrophobicContact CD1-CG 3.91Å; I339-P434 HydrophobicContact CD1-CB 3.49Å; I339-P434 VanDerWaalsContact CD1-CB 3.49Å; I339-P434 HydrophobicContact CG1-CB 4.33Å; R347-P434 PolarHBondContact NH2-O 3Å; I372-P434 HydrophobicContact CD1-CG 4.21Å
435	L	97.3	Very high	97.2	Very high	0 Å²	0	6.3 Å²	6.3	0%	0	3%	0.033	C	C	.	.			trans	-71.9	149.4	-173.6	-70.7	172.4	0	0	0	113.3	A206 L336 I416 M417 Y431 S432 Q439 A440 I443	A206-L435 PolarHBondContact N-O 3.17Å; L336-L435 HydrophobicContact CD1-CD2 3.63Å; L336-L435 HydrophobicContact CD1-CG 4.27Å; L336-L435 HydrophobicContact CD2-CD2 3.76Å; L336-L435 HydrophobicContact CG-CD2 4.36Å; I416-L435 HydrophobicContact CG2-CD1 3.77Å; I416-L435 HydrophobicContact CG2-CG 3.94Å; M417-L435 HydrophobicContact CB-CD1 3.71Å; M417-L435 HydrophobicContact CG-CD1 4.1Å; M417-L435 HydrophobicContact SD-CD1 4.13Å; Y431-L435 HydrophobicContact CD2-CB 4.05Å; S432-L435 WeakPolarHBondContact O-CB 3.49Å; S432-L435 PolarHBondContact O-N 2.89Å; L435-Q439 HydrophobicContact CD2-CB 3.67Å; L435-A440 HydrophobicContact CD1-CB 4.31Å; L435-I443 HydrophobicContact CD1-CD1 4.31Å; L435-I443 HydrophobicContact CD2-CD1 3.7Å
436	C	96.8	Very high	97.3	Very high	0 Å²	0	3.7 Å²	3.7	0%	0	2%	0.018	C	C	.	.			trans	-103.5	170.5	157.9	69.9	0	0	0	0	111.5	I202 M203 K204 R347 L438 Q439 A440	I202-C436 VanDerWaalsContact O-CB 3.27Å; I202-C436 WeakPolarHBondContact O-CB 3.28Å; I202-C436 PolarHBondContact O-SG 2.71Å; M203-C436 WeakPolarHBondContact O-CB 3.43Å; K204-C436 WeakPolarHBondContact O-CA 3.3Å; K204-C436 WeakPolarHBondContact O-CB 3.1Å; R347-C436 PolarHBondContact NH1-SG 2.95Å; R347-C436 VanDerWaalsContact NH1-SG 3.38Å; R347-C436 VanDerWaalsContact NH2-N 3.18Å; C436-L438 VanDerWaalsContact C-N 3.3Å; C436-L438 PolarHBondContact O-N 2.94Å; C436-Q439 PolarHBondContact O-N 3.44Å; C436-A440 PolarHBondContact O-N 3.01Å
437	A	97.9	Very high	97.1	Very high	0 Å²	0	1.7 Å²	1.7	0%	0	1%	0.009	C	C	.	.	H	α-helix	trans	-58.3	-39.8	179.8	0	0	0	0	0	112.8	I202 L233 L245 Y431 F441	I202-A437 HydrophobicContact CB-CB 4.43Å; I202-A437 HydrophobicContact CG2-CB 4.43Å; I202-A437 PolarHBondContact O-N 3.47Å; L233-A437 HydrophobicContact CD2-CB 4.31Å; L245-A437 HydrophobicContact CD1-CB 4.19Å; Y431-A437 HydrophobicContact CE1-CB 4.18Å; A437-F441 VanDerWaalsContact O-CB 3.23Å; A437-F441 WeakPolarHBondContact O-CB 3.43Å; A437-F441 PolarHBondContact O-N 3.12Å
438	L	98.2	Very high	96.8	Very high	0 Å²	0	2.6 Å²	2.6	0%	0	1%	0.013	C	C	.	.	H	α-helix	trans	-65.8	-40.9	179.3	-175.5	60.6	0	0	0	112.4	I202 M203 L246 I261 V276 L290 L311 C436 G442	I202-L438 WeakPolarHBondContact O-CB 3.46Å; I202-L438 PolarHBondContact O-N 3.14Å; M203-L438 HydrophobicContact SD-CB 4.46Å; M203-L438 HydrophobicContact SD-CD2 3.58Å; M203-L438 VanDerWaalsContact SD-CD2 3.58Å; L246-L438 HydrophobicContact CD1-CB 4.26Å; L246-L438 HydrophobicContact CD1-CD1 3.98Å; L246-L438 HydrophobicContact CD2-CD1 4.47Å; I261-L438 HydrophobicContact CB-CD1 4.11Å; I261-L438 HydrophobicContact CD1-CD1 3.79Å; I261-L438 HydrophobicContact CG2-CD1 3.66Å; V276-L438 HydrophobicContact CG2-CD1 4.38Å; L290-L438 HydrophobicContact CD2-CG 4.49Å; L290-L438 WeakPolarHBondContact CD2-O 3.37Å; L311-L438 HydrophobicContact CD1-CD2 3.7Å; L311-L438 HydrophobicContact CD1-CG 4.42Å; C436-L438 VanDerWaalsContact C-N 3.3Å; C436-L438 PolarHBondContact O-N 2.94Å; L438-G442 PolarHBondContact O-N 3.3Å
439	Q	98.3	Very high	96.1	Very high	1 Å²	1	3.3 Å²	3.3	1%	0.005	2%	0.017	C	C	.	.	H	α-helix	trans	-64.6	-52.4	174.9	-72.5	170.3	-39.8	0	0	111.2	L290 L311 L435 C436 F441 G442 I443	L290-Q439 HydrophobicContact CD2-CB 4.49Å; L290-Q439 HydrophobicContact CD2-CG 4.36Å; L311-Q439 HydrophobicContact CB-CG 4.36Å; L311-Q439 PolarHBondContact O-NE2 2.88Å; L435-Q439 HydrophobicContact CD2-CB 3.67Å; C436-Q439 PolarHBondContact O-N 3.44Å; Q439-F441 VanDerWaalsContact C-N 3.29Å; Q439-F441 PolarHBondContact O-N 2.86Å; Q439-G442 PolarHBondContact O-N 2.97Å; Q439-G442 VanDerWaalsContact O-N 3.15Å; Q439-I443 WeakPolarHBondContact O-CD1 3.39Å; Q439-I443 VanDerWaalsContact O-CG1 3.26Å; Q439-I443 WeakPolarHBondContact O-CG1 3.44Å; Q439-I443 PolarHBondContact O-N 3Å
440	A	98.5	Very high	94.8	Very high	0 Å²	0	5.8 Å²	5.8	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-58	-41.5	179.1	0	0	0	0	0	111.7	M417 M429 Y431 L435 C436 I443 A444	M417-A440 HydrophobicContact CE-CB 4.27Å; M417-A440 WeakPolarHBondContact CE-O 3.37Å; M417-A440 HydrophobicContact SD-CB 4.29Å; M429-A440 HydrophobicContact CE-CB 3.54Å; M429-A440 HydrophobicContact SD-CB 3.9Å; Y431-A440 HydrophobicContact CD1-CB 4.11Å; Y431-A440 HydrophobicContact CG-CB 3.89Å; L435-A440 HydrophobicContact CD1-CB 4.31Å; C436-A440 PolarHBondContact O-N 3.01Å; A440-I443 PolarHBondContact O-N 3.19Å; A440-A444 WeakPolarHBondContact O-CB 3.05Å; A440-A444 PolarHBondContact O-N 2.65Å
441	F	98.4	Very high	93.4	Very high	0 Å²	0	6.7 Å²	6.7	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-67.3	-41.2	176.6	-167.3	-145.2	0	0	0	112.4	I216 L233 L246 A248 I261 M429 A437 Q439 I443 A444 L445	I216-F441 HydrophobicContact CD1-CD2 3.72Å; I216-F441 HydrophobicContact CD1-CE2 3.88Å; I216-F441 HydrophobicContact CG1-CD2 4.16Å; I216-F441 HydrophobicContact CG1-CE2 4.01Å; I216-F441 HydrophobicContact CG2-CE2 4.26Å; L233-F441 HydrophobicContact CB-CD1 4.44Å; L233-F441 HydrophobicContact CB-CD2 4.14Å; L233-F441 HydrophobicContact CB-CE1 4.33Å; L233-F441 HydrophobicContact CB-CE2 4.05Å; L233-F441 HydrophobicContact CB-CG 4.35Å; L233-F441 HydrophobicContact CB-CZ 4.13Å; L233-F441 HydrophobicContact CD1-CD2 4.46Å; L233-F441 HydrophobicContact CD2-CB 4.12Å; L233-F441 HydrophobicContact CD2-CG 4.22Å; L246-F441 HydrophobicContact CB-CD1 3.6Å; L246-F441 HydrophobicContact CB-CE1 3.62Å; L246-F441 HydrophobicContact CD1-CB 4.06Å; L246-F441 HydrophobicContact CD1-CD1 3.7Å; L246-F441 HydrophobicContact CD1-CG 4.28Å; L246-F441 HydrophobicContact CG-CD1 4.29Å; A248-F441 HydrophobicContact CB-CD1 4.42Å; A248-F441 HydrophobicContact CB-CE1 3.49Å; A248-F441 VanDerWaalsContact CB-CE1 3.49Å; A248-F441 HydrophobicContact CB-CZ 3.72Å; I261-F441 HydrophobicContact CG2-CD1 3.92Å; I261-F441 HydrophobicContact CG2-CE1 4.06Å; M429-F441 HydrophobicContact SD-CB 4.5Å; A437-F441 VanDerWaalsContact O-CB 3.23Å; A437-F441 WeakPolarHBondContact O-CB 3.43Å; A437-F441 PolarHBondContact O-N 3.12Å; Q439-F441 VanDerWaalsContact C-N 3.29Å; Q439-F441 PolarHBondContact O-N 2.86Å; F441-I443 VanDerWaalsContact C-N 3.32Å; F441-I443 PolarHBondContact O-N 2.84Å; F441-A444 PolarHBondContact O-N 3.05Å; F441-L445 HydrophobicContact CD1-CD1 3.98Å; F441-L445 HydrophobicContact CD2-CD1 4.2Å; F441-L445 HydrophobicContact CD2-CG 4.11Å; F441-L445 HydrophobicContact CE1-CD1 4.03Å; F441-L445 HydrophobicContact CE2-CD1 4.22Å; F441-L445 HydrophobicContact CE2-CD2 4.15Å; F441-L445 HydrophobicContact CE2-CG 4.06Å; F441-L445 HydrophobicContact CG-CD1 4.08Å; F441-L445 HydrophobicContact CG-CG 4.46Å; F441-L445 HydrophobicContact CZ-CD1 4.15Å; F441-L445 HydrophobicContact CZ-CD2 4.31Å; F441-L445 HydrophobicContact CZ-CG 4.4Å; F441-L445 WeakPolarHBondContact O-CB 3.49Å; F441-L445 WeakPolarHBondContact O-CD1 3.22Å; F441-L445 WeakPolarHBondContact O-CG 3.48Å; F441-L445 PolarHBondContact O-N 2.78Å
442	G	98.2	Very high	91.4	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-60	-40.6	173.3	0	0	0	0	0	113	L279 L438 Q439 L445 S446	L279-G442 WeakPolarHBondContact CD2-O 3.43Å; L438-G442 PolarHBondContact O-N 3.3Å; Q439-G442 PolarHBondContact O-N 2.97Å; Q439-G442 VanDerWaalsContact O-N 3.15Å; G442-L445 PolarHBondContact O-N 2.66Å; G442-S446 PolarHBondContact O-N 3.03Å
443	I	97.8	Very high	89	Confident	1 Å²	1	15 Å²	15	1%	0.005	10%	0.097	C	C	.	.	H	α-helix	trans	-63.6	-50.3	174.7	-64.8	158.4	0	0	0	110.1	I314 M332 V334 F404 M417 L435 Q439 A440 F441 L445 S446	I314-I443 HydrophobicContact CD1-CG1 4.06Å; I314-I443 HydrophobicContact CG1-CB 4.4Å; I314-I443 HydrophobicContact CG1-CG1 3.92Å; I314-I443 HydrophobicContact CG1-CG2 4.47Å; M332-I443 HydrophobicContact CE-CG2 3.38Å; V334-I443 HydrophobicContact CG1-CD1 3.67Å; V334-I443 HydrophobicContact CG1-CG1 4.03Å; V334-I443 HydrophobicContact CG2-CG2 4.17Å; F404-I443 HydrophobicContact CE2-CG2 4.25Å; F404-I443 HydrophobicContact CZ-CG2 4.22Å; M417-I443 HydrophobicContact CE-CB 4.12Å; M417-I443 HydrophobicContact CE-CG2 4.04Å; M417-I443 HydrophobicContact SD-CB 3.89Å; M417-I443 HydrophobicContact SD-CD1 4.08Å; M417-I443 HydrophobicContact SD-CG2 3.63Å; L435-I443 HydrophobicContact CD1-CD1 4.31Å; L435-I443 HydrophobicContact CD2-CD1 3.7Å; Q439-I443 WeakPolarHBondContact O-CD1 3.39Å; Q439-I443 VanDerWaalsContact O-CG1 3.26Å; Q439-I443 WeakPolarHBondContact O-CG1 3.44Å; Q439-I443 PolarHBondContact O-N 3Å; A440-I443 PolarHBondContact O-N 3.19Å; F441-I443 VanDerWaalsContact C-N 3.32Å; F441-I443 PolarHBondContact O-N 2.84Å; I443-L445 VanDerWaalsContact C-N 3.34Å; I443-L445 PolarHBondContact O-N 3Å; I443-S446 PolarHBondContact O-N 2.87Å; I443-S446 PolarHBondContact O-OG 2.74Å
444	A	97.4	Very high	86.8	Confident	0 Å²	0	14.9 Å²	14.9	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-59.3	-42	177.2	0	0	0	0	0	112.5	I216 M417 F419 M429 A440 F441 S446 S447	I216-A444 HydrophobicContact CD1-CB 3.71Å; M417-A444 HydrophobicContact CE-CB 3.99Å; F419-A444 HydrophobicContact CD2-CB 3.85Å; F419-A444 HydrophobicContact CE2-CB 3.93Å; F419-A444 HydrophobicContact CG-CB 4.41Å; M429-A444 HydrophobicContact CG-CB 4.38Å; M429-A444 HydrophobicContact SD-CB 3.99Å; A440-A444 WeakPolarHBondContact O-CB 3.05Å; A440-A444 PolarHBondContact O-N 2.65Å; F441-A444 PolarHBondContact O-N 3.05Å; A444-S446 VanDerWaalsContact C-N 3.28Å; A444-S446 PolarHBondContact O-N 3.08Å; A444-S447 WeakPolarHBondContact O-CB 3.47Å; A444-S447 PolarHBondContact O-N 2.93Å; A444-S447 PolarHBondContact O-OG 3.37Å
445	L	96.5	Very high	84	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-60.9	-33.8	177.6	-74.2	165.9	0	0	0	112.9	Y231 A248 Y259 I261 L279 F441 G442 I443 S447 F448	Y231-L445 HydrophobicContact CD1-CD2 4.44Å; Y231-L445 HydrophobicContact CD2-CD2 3.81Å; Y231-L445 HydrophobicContact CE2-CD2 4.45Å; Y231-L445 HydrophobicContact CG-CD2 3.8Å; A248-L445 HydrophobicContact CB-CD1 3.52Å; A248-L445 HydrophobicContact CB-CD2 4.03Å; A248-L445 HydrophobicContact CB-CG 4.43Å; Y259-L445 HydrophobicContact CD1-CD2 4.02Å; Y259-L445 HydrophobicContact CE1-CD2 4.1Å; I261-L445 HydrophobicContact CD1-CD1 3.97Å; I261-L445 HydrophobicContact CG1-CD1 4.26Å; L279-L445 HydrophobicContact CD2-CB 3.78Å; F441-L445 HydrophobicContact CD1-CD1 3.98Å; F441-L445 HydrophobicContact CD2-CD1 4.2Å; F441-L445 HydrophobicContact CD2-CG 4.11Å; F441-L445 HydrophobicContact CE1-CD1 4.03Å; F441-L445 HydrophobicContact CE2-CD1 4.22Å; F441-L445 HydrophobicContact CE2-CD2 4.15Å; F441-L445 HydrophobicContact CE2-CG 4.06Å; F441-L445 HydrophobicContact CG-CD1 4.08Å; F441-L445 HydrophobicContact CG-CG 4.46Å; F441-L445 HydrophobicContact CZ-CD1 4.15Å; F441-L445 HydrophobicContact CZ-CD2 4.31Å; F441-L445 HydrophobicContact CZ-CG 4.4Å; F441-L445 WeakPolarHBondContact O-CB 3.49Å; F441-L445 WeakPolarHBondContact O-CD1 3.22Å; F441-L445 WeakPolarHBondContact O-CG 3.48Å; F441-L445 PolarHBondContact O-N 2.78Å; G442-L445 PolarHBondContact O-N 2.66Å; I443-L445 VanDerWaalsContact C-N 3.34Å; I443-L445 PolarHBondContact O-N 3Å; L445-S447 PolarHBondContact O-N 3.49Å; L445-F448 HydrophobicContact CD2-CD2 4.21Å; L445-F448 HydrophobicContact CD2-CE2 4.43Å; L445-F448 PolarHBondContact O-N 3.49Å
446	S	95.1	Very high	83.4	Confident	0 Å²	0	23.8 Å²	23.8	0%	0	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-12.1	175.2	76.5	0	0	0	0	114.4	Y316 G442 I443 A444 K451	Y316-S446 PolarHBondContact OH-OG 3.25Å; G442-S446 PolarHBondContact O-N 3.03Å; I443-S446 PolarHBondContact O-N 2.87Å; I443-S446 PolarHBondContact O-OG 2.74Å; A444-S446 VanDerWaalsContact C-N 3.28Å; A444-S446 PolarHBondContact O-N 3.08Å; S446-K451 WeakPolarHBondContact O-CE 3.31Å; S446-K451 PolarHBondContact O-NZ 2.61Å; S446-K451 VanDerWaalsContact O-NZ 3.09Å
447	S	92	Very high	82.6	Confident	11 Å²	11	25 Å²	25	8%	0.077	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-22.1	175.3	81.1	0	0	0	0	114.1	F419 A444 L445 D449	F419-S447 VanDerWaalsContact CE1-OG 3.24Å; F419-S447 WeakPolarHBondContact CE1-OG 3.21Å; A444-S447 WeakPolarHBondContact O-CB 3.47Å; A444-S447 PolarHBondContact O-N 2.93Å; A444-S447 PolarHBondContact O-OG 3.37Å; L445-S447 PolarHBondContact O-N 3.49Å; S447-D449 VanDerWaalsContact C-N 3.3Å
448	F	90	Very high	81.8	Confident	22 Å²	22	26.4 Å²	26.4	10%	0.096	16%	0.155	C	C	.	.	S	Bend	trans	-79.5	-11.4	177.7	-62.6	-54.2	0	0	0	113.8	I216 Y231 K402 F419 F427 L445	I216-F448 HydrophobicContact CG2-CE2 4.26Å; I216-F448 HydrophobicContact CG2-CZ 4.17Å; Y231-F448 AromaticContact CD1-CD2 3.73Å; Y231-F448 HydrophobicContact CD1-CD2 3.73Å; Y231-F448 AromaticContact CD1-CE2 3.44Å; Y231-F448 HydrophobicContact CD1-CE2 3.44Å; Y231-F448 VanDerWaalsContact CD1-CE2 3.44Å; Y231-F448 AromaticContact CD1-CZ 3.99Å; Y231-F448 HydrophobicContact CD1-CZ 3.99Å; Y231-F448 HydrophobicContact CE1-CB 4.36Å; Y231-F448 HydrophobicContact CE1-CD1 4.04Å; Y231-F448 AromaticContact CE1-CD2 3.26Å; Y231-F448 HydrophobicContact CE1-CD2 3.26Å; Y231-F448 HydrophobicContact CE1-CE1 4.1Å; Y231-F448 AromaticContact CE1-CE2 3.36Å; Y231-F448 HydrophobicContact CE1-CE2 3.36Å; Y231-F448 AromaticContact CE1-CG 3.65Å; Y231-F448 HydrophobicContact CE1-CG 3.65Å; Y231-F448 AromaticContact CE1-CZ 3.78Å; Y231-F448 HydrophobicContact CE1-CZ 3.78Å; Y231-F448 HydrophobicContact CE2-CD2 4.41Å; Y231-F448 HydrophobicContact CG-CD2 4.47Å; Y231-F448 HydrophobicContact CG-CE2 4.34Å; Y231-F448 AromaticContact CZ-CD2 3.67Å; Y231-F448 AromaticContact CZ-CG 3.86Å; K402-F448 HydrophobicContact CD-CD1 4.44Å; F419-F448 HydrophobicContact CE2-CZ 4.02Å; F419-F448 AromaticContact CZ-CE1 3.7Å; F419-F448 HydrophobicContact CZ-CE1 3.7Å; F419-F448 HydrophobicContact CZ-CE2 4.44Å; F419-F448 AromaticContact CZ-CZ 3.58Å; F419-F448 HydrophobicContact CZ-CZ 3.58Å; F427-F448 AromaticContact CD1-CE1 3.9Å; F427-F448 HydrophobicContact CD1-CE1 3.9Å; F427-F448 HydrophobicContact CD1-CZ 4.4Å; F427-F448 AromaticContact CD2-CE1 3.78Å; F427-F448 HydrophobicContact CD2-CE1 3.78Å; F427-F448 AromaticContact CD2-CZ 3.77Å; F427-F448 HydrophobicContact CD2-CZ 3.77Å; F427-F448 AromaticContact CE1-CE1 3.76Å; F427-F448 HydrophobicContact CE1-CE1 3.76Å; F427-F448 AromaticContact CE2-CE1 3.63Å; F427-F448 HydrophobicContact CE2-CE1 3.63Å; F427-F448 HydrophobicContact CE2-CZ 4.02Å; F427-F448 AromaticContact CG-CE1 3.94Å; F427-F448 HydrophobicContact CG-CE1 3.94Å; F427-F448 HydrophobicContact CG-CZ 4.01Å; F427-F448 HydrophobicContact CZ-CD1 4.44Å; F427-F448 AromaticContact CZ-CE1 3.64Å; F427-F448 HydrophobicContact CZ-CE1 3.64Å; F427-F448 HydrophobicContact CZ-CZ 4.45Å; L445-F448 HydrophobicContact CD2-CD2 4.21Å; L445-F448 HydrophobicContact CD2-CE2 4.43Å; L445-F448 PolarHBondContact O-N 3.49Å
449	D	83.2	Confident	80.8	Confident	15 Å²	15	27.9 Å²	27.9	8%	0.08	16%	0.164	C	C	.	.	S	Bend	trans	-91.2	138.7	-171	-145.6	5.4	0	0	0	112.3	K250 S257 F288 S447 K451	K250-D449 IonicContact NZ-OD1 3.66Å; K250-D449 PolarHBondContact NZ-OD1 3.28Å; S257-D449 WeakPolarHBondContact CB-OD2 3.43Å; S257-D449 PolarHBondContact OG-OD2 3.48Å; F288-D449 HydrophobicContact CE1-CB 4.18Å; F288-D449 WeakPolarHBondContact CE1-OD2 3.4Å; F288-D449 HydrophobicContact CZ-CB 3.96Å; S447-D449 VanDerWaalsContact C-N 3.3Å; D449-K451 WeakPolarHBondContact O-CG 3.22Å
450	G	70.4	Confident	79.7	Confident	53 Å²	53	29.6 Å²	29.6	55%	0.546	17%	0.174	S	C	.	.			trans	-67.9	138.9	175.3	0	0	0	0	0	111.8
451	K	68	Low	78.5	Confident	26 Å²	26	31.6 Å²	31.6	11%	0.113	19%	0.186	C	C	.	.			trans	-120.9	100.2	-170.7	-55.9	-176.1	179.9	159.6	0	109.2	G285 Y316 S446 D449 A453 C454	G285-K451 WeakPolarHBondContact O-CG 3.27Å; Y316-K451 HydrophobicContact CD2-CD 4.07Å; Y316-K451 VanDerWaalsContact CD2-NZ 3.25Å; Y316-K451 VanDerWaalsContact CE1-NZ 3.26Å; Y316-K451 HydrophobicContact CG-CD 4.08Å; S446-K451 WeakPolarHBondContact O-CE 3.31Å; S446-K451 PolarHBondContact O-NZ 2.61Å; S446-K451 VanDerWaalsContact O-NZ 3.09Å; D449-K451 WeakPolarHBondContact O-CG 3.22Å; K451-A453 PolarHBondContact O-N 2.8Å; K451-A453 VanDerWaalsContact O-N 3.09Å; K451-C454 HydrophobicContact CB-CB 3.88Å; K451-C454 PolarHBondContact O-N 3.22Å
452	L	55.9	Low	77.1	Confident	131 Å²	131	33.9 Å²	33.9	69%	0.686	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-20.7	-170.6	-63.1	174.3	0	0	0	113.6	L284	L284-L452 PolarHBondContact O-N 3.26Å; L284-L452 VanDerWaalsContact O-N 3.15Å
453	A	47.5	Very low	75.4	Confident	47 Å²	47	36.5 Å²	36.5	39%	0.388	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.4	21.4	178	0	0	0	0	0	113	L284 T286 K451	L284-A453 HydrophobicContact CB-CB 4.4Å; T286-A453 HydrophobicContact CG2-CB 3.96Å; K451-A453 PolarHBondContact O-N 2.8Å; K451-A453 VanDerWaalsContact O-N 3.09Å
454	C	49.1	Very low	73.6	Confident	3 Å²	3	39.4 Å²	39.4	2%	0.02	23%	0.232	C	C	.	.			trans	-142.4	28.3	-179.9	-47.2	0	0	0	0	114.3	R330 K451	R330-C454 PolarHBondContact NH2-O 3.34Å; K451-C454 HydrophobicContact CB-CB 3.88Å; K451-C454 PolarHBondContact O-N 3.22Å
455	E	37.9	Very low	71.4	Confident	165 Å²	165	43 Å²	43	77%	0.771	25%	0.253	S	S	*	.			trans	-65	0	161.7	-63.9	-175.2	-178.5	0	0	110.3	R154 K327	R154-E455 IonicContact CZ-OE1 3.95Å; R154-E455 IonicContact NH1-OE1 2.65Å; R154-E455 PolarHBondContact NH1-OE1 3.44Å; R154-E455 IonicContact NH1-OE2 2.65Å; R154-E455 IonicContact NH2-OE1 3.5Å; K327-E455 PolarHBondContact NZ-O 3.38Å

Retrieved 455 of 455 residues in 104.2 ms (Link to these results)

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