A0A087X8N9_POEFO Loading...

EGF like repeats and discoidin domains 3

AlphaFold DB , UniProt , Accession A0A087X8N9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 436 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	39.7	Very low	42.1	Very low	246 Å²	246	152.1 Å²	152.1	100%	1.212	86%	0.86	S	S	*	*				0	116.1	0	-76.1	165.1	127.5	0	0	107.5
2	G	44.1	Very low	41.8	Very low	72 Å²	72	152.6 Å²	152.6	74%	0.742	86%	0.858	S	S	*	*			trans	-70.1	-178.9	164	0	0	0	0	0	111.1
3	P	51.3	Low	41.6	Very low	124 Å²	124	150.2 Å²	150.2	81%	0.805	86%	0.857	S	S	*	*				-132.2	147.5	58	15.1	10.1	0	0	0	113.9
4	L	42.7	Very low	41.3	Very low	162 Å²	162	146.2 Å²	146.2	85%	0.848	85%	0.852	S	S	*	*				69.6	117.4	80.8	-79.2	170.2	0	0	0	117.4
5	L	37	Very low	41.2	Very low	163 Å²	163	143.1 Å²	143.1	85%	0.853	85%	0.85	S	S	*	*			trans	147.6	159	137.6	-80.7	159.8	0	0	0	111.5
6	P	46.2	Very low	41.2	Very low	112 Å²	112	142.4 Å²	142.4	73%	0.727	85%	0.847	S	S	*	*				-128	173.3	-58.2	31.9	-12.5	0	0	0	113.4
7	F	44.2	Very low	41.1	Very low	213 Å²	213	140.9 Å²	140.9	93%	0.934	84%	0.841	S	S	*	*			trans	-65	137.2	177	-85.8	-100.7	0	0	0	114.3
8	I	40.7	Very low	40.7	Very low	169 Å²	169	143.6 Å²	143.6	87%	0.867	84%	0.843	S	S	*	*			trans	-137.8	140.9	156.8	-63.9	-176.7	0	0	0	110.1
9	V	38.6	Very low	40.3	Very low	136 Å²	136	148.3 Å²	148.3	82%	0.824	85%	0.845	S	S	*	*			trans	-74.6	147.4	-165	169.9	0	0	0	0	114.2
10	L	42.5	Very low	40.3	Very low	141 Å²	141	147.6 Å²	147.6	74%	0.738	84%	0.843	S	S	*	*			trans	-64	140.8	170.7	-89.3	102.1	0	0	0	113.1	L12	L10-L12 HydrophobicContact CD2-CD1 3.89Å; L10-L12 HydrophobicContact CD2-CG 4.46Å
11	C	35.5	Very low	40.1	Very low	135 Å²	135	149.9 Å²	149.9	91%	0.912	84%	0.844	S	S	*	*			trans	-137.8	108.8	150.9	-112.4	0	0	0	0	109.4
12	L	39.1	Very low	40	Very low	158 Å²	158	143 Å²	143	83%	0.827	83%	0.826	S	S	*	*			trans	-80	119.8	171.2	-84.5	139.2	0	0	0	109	L10 A14	L10-L12 HydrophobicContact CD2-CD1 3.89Å; L10-L12 HydrophobicContact CD2-CG 4.46Å; L12-A14 PolarHBondContact O-N 2.97Å
13	S	38.5	Very low	39.9	Very low	121 Å²	121	143.8 Å²	143.8	85%	0.846	83%	0.826	S	S	*	*			trans	-79.8	109.2	171.4	41.3	0	0	0	0	110.3
14	A	38.2	Very low	39.4	Very low	95 Å²	95	145.6 Å²	145.6	79%	0.785	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-79.8	117.6	168.5	0	0	0	0	0	109.6	L12	L12-A14 PolarHBondContact O-N 2.97Å
15	A	40.3	Very low	39.9	Very low	100 Å²	100	142 Å²	142	83%	0.826	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-75.7	124.3	169.4	0	0	0	0	0	109.7
16	V	41.3	Very low	40	Very low	132 Å²	132	142.6 Å²	142.6	80%	0.8	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-79.9	127.5	177.8	178.2	0	0	0	0	109.3
17	P	38.8	Very low	40.2	Very low	116 Å²	116	145 Å²	145	75%	0.753	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-82.4	123.3	169.5	25.7	-18.7	0	0	0	110	R19	P17-R19 PolarHBondContact O-N 3.13Å; P17-R19 VanDerWaalsContact O-N 3.15Å
18	H	33.8	Very low	40.6	Very low	189 Å²	189	140.6 Å²	140.6	88%	0.875	82%	0.823	S	S	*	*			trans	-65.4	108.5	168.7	-110.3	-65.1	0	0	0	109.4	V20	H18-V20 PolarHBondContact O-N 3.32Å
19	R	33.7	Very low	41.3	Very low	234 Å²	234	138.1 Å²	138.1	88%	0.883	82%	0.816	S	S	*	*			trans	-89.6	97	175	-152	177.4	-170.1	-173.4	2.8	108.5	P17 K21	P17-R19 PolarHBondContact O-N 3.13Å; P17-R19 VanDerWaalsContact O-N 3.15Å; R19-K21 PolarHBondContact O-N 3.26Å
20	V	40	Very low	42.5	Very low	133 Å²	133	136.1 Å²	136.1	81%	0.806	81%	0.808	S	S	*	*			trans	-66.8	116	165.9	178	0	0	0	0	107	H18 A22	H18-V20 PolarHBondContact O-N 3.32Å; V20-A22 PolarHBondContact O-N 3.4Å
21	K	35.7	Very low	43.8	Very low	196 Å²	196	133.6 Å²	133.6	85%	0.852	80%	0.8	S	S	*	*			trans	-77.2	110.7	170.6	-79.9	-177.3	175.2	-179.4	0	107.9	R19	R19-K21 PolarHBondContact O-N 3.26Å
22	A	38	Very low	45.8	Very low	101 Å²	101	128.9 Å²	128.9	84%	0.835	77%	0.774	S	S	*	*			trans	-75.4	117.7	159.8	0	0	0	0	0	107.9	V20	V20-A22 PolarHBondContact O-N 3.4Å
23	A	42.1	Very low	47.9	Very low	90 Å²	90	124.1 Å²	124.1	74%	0.744	75%	0.753	S	S	*	*			trans	-93.1	105.7	164.8	0	0	0	0	0	106.7
24	D	41.3	Very low	50.1	Low	161 Å²	161	119.2 Å²	119.2	86%	0.861	72%	0.718	S	S	*	*	S	Bend	trans	170.4	133	134	-85.7	-24.9	0	0	0	107.2	E26	D24-E26 PolarHBondContact O-N 3.3Å; D24-E26 VanDerWaalsContact O-N 3.13Å
25	G	51.4	Low	52.4	Low	86 Å²	86	121.4 Å²	121.4	89%	0.887	71%	0.712	S	S	*	*			trans	-72.1	104.1	-174.3	0	0	0	0	0	111
26	E	41	Very low	54.6	Low	176 Å²	176	122.2 Å²	122.2	82%	0.822	71%	0.709	S	S	*	*			trans	-144.3	103.5	152.7	-126.9	166.6	-175.9	0	0	107.2	D24	D24-E26 PolarHBondContact O-N 3.3Å; D24-E26 VanDerWaalsContact O-N 3.13Å
27	E	50.4	Low	56.8	Low	163 Å²	163	119.9 Å²	119.9	76%	0.762	69%	0.692	S	S	*	*			trans	-53.6	126.6	162.8	-160.1	164.9	-146.8	0	0	106.3	T29	E27-T29 HydrophobicContact CB-CG2 4.41Å; E27-T29 PolarHBondContact O-N 3.04Å; E27-T29 PolarHBondContact O-OG1 3.43Å
28	P	51.8	Low	59.3	Low	121 Å²	121	115.9 Å²	115.9	79%	0.786	67%	0.666	S	S	*	*			trans	-68.8	86.7	-177.9	26.5	-30.6	0	0	0	108.2	S30	P28-S30 PolarHBondContact O-N 3.15Å
29	T	55.4	Low	62.1	Low	116 Å²	116	107.4 Å²	107.4	71%	0.712	63%	0.628	S	S	*	*			trans	-84.1	4.2	-179.7	40	0	0	0	0	111.6	E27	E27-T29 HydrophobicContact CB-CG2 4.41Å; E27-T29 PolarHBondContact O-N 3.04Å; E27-T29 PolarHBondContact O-OG1 3.43Å
30	S	63.2	Low	64.9	Low	94 Å²	94	101.4 Å²	101.4	66%	0.657	61%	0.609	S	S	*	*	S	Bend	trans	-93.3	117.9	168.9	-177.7	0	0	0	0	109.3	P28 G32	P28-S30 PolarHBondContact O-N 3.15Å; S30-G32 PolarHBondContact O-N 3.44Å
31	P	69.9	Low	67.3	Low	89 Å²	89	98.7 Å²	98.7	58%	0.578	59%	0.59	S	S	*	*	P	Polyproline II helix	trans	-53.4	132.6	163.6	24.2	-30.8	0	0	0	108	H35	P31-H35 HydrophobicContact CB-CB 3.88Å; P31-H35 WeakPolarHBondContact CB-O 3.49Å
32	G	77.1	Confident	69.9	Low	35 Å²	35	100.7 Å²	100.7	36%	0.361	59%	0.593	S	S	.	*	P	Polyproline II helix	trans	-58.2	167.5	-177.6	0	0	0	0	0	112	S30 C34 H35	S30-G32 PolarHBondContact O-N 3.44Å; G32-C34 PolarHBondContact O-N 3.3Å; G32-H35 PolarHBondContact O-N 2.91Å
33	P	82.9	Confident	72.4	Confident	59 Å²	59	96 Å²	96	38%	0.383	55%	0.554	S	S	.	*	T	Hydrogen-bonded Turn	trans	-59.2	-15.8	-170.8	21.1	-32.2	0	0	0	115.1	I47 G58 Y59	P33-I47 HydrophobicContact CG-CG1 4.48Å; P33-G58 WeakPolarHBondContact CG-O 2.96Å; P33-Y59 HydrophobicContact CB-CD1 3.77Å; P33-Y59 HydrophobicContact CB-CG 4.43Å
34	C	86.1	Confident	74.9	Confident	17 Å²	17	95.8 Å²	95.8	12%	0.115	54%	0.543	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	7.6	175.1	-68.2	0	0	0	0	114.9	G32 P36 N37 C45	G32-C34 PolarHBondContact O-N 3.3Å; C34-P36 CarbonylContact C-O 3.04Å; C34-P36 CarbonylContact O-C 3.56Å; C34-N37 VanDerWaalsContact O-CA 3.28Å; C34-N37 WeakPolarHBondContact O-CA 3.14Å; C34-N37 PolarHBondContact O-N 2.66Å; C34-C45 WeakPolarHBondContact CA-SG 3.36Å; C34-C45 HydrophobicContact CB-CB 3.63Å; C34-C45 WeakPolarHBondContact CB-SG 3.29Å; C34-C45 VanDerWaalsContact SG-C 3.59Å; C34-C45 WeakPolarHBondContact SG-CB 3.28Å; C34-C45 CovalentContact SG-SG 2.04Å; C34-C45 PolarHBondContact SG-SG 3.43Å
35	H	86.6	Confident	77.3	Confident	141 Å²	141	89.2 Å²	89.2	65%	0.653	51%	0.51	S	S	*	.	S	Bend	trans	-129.1	114.3	-179.5	-82.1	-77.1	0	0	0	112.2	P31 G32	P31-H35 HydrophobicContact CB-CB 3.88Å; P31-H35 WeakPolarHBondContact CB-O 3.49Å; G32-H35 PolarHBondContact O-N 2.91Å
36	P	86.1	Confident	79.2	Confident	117 Å²	117	88.8 Å²	88.8	76%	0.76	49%	0.485	S	S	*	.	S	Bend	cis	-65.4	156.3	-6.1	29.5	-34.7	0	0	0	112.1	C34 P38	C34-P36 CarbonylContact C-O 3.04Å; C34-P36 CarbonylContact O-C 3.56Å; P36-P38 WeakPolarHBondContact O-CD 3.21Å; P36-P38 VanDerWaalsContact O-N 3.09Å
37	N	88.1	Confident	81.4	Confident	84 Å²	84	86.8 Å²	86.8	45%	0.449	48%	0.478	S	S	.	.			trans	-58.6	114.5	-176.3	-177.8	-1	0	0	0	110.6	C34 C39 G43 C45	C34-N37 VanDerWaalsContact O-CA 3.28Å; C34-N37 WeakPolarHBondContact O-CA 3.14Å; C34-N37 PolarHBondContact O-N 2.66Å; N37-C39 VanDerWaalsContact C-N 3.25Å; N37-C39 PolarHBondContact O-N 3.46Å; N37-C39 VanDerWaalsContact OD1-CB 3.29Å; N37-C39 WeakPolarHBondContact OD1-CB 3.34Å; N37-C39 PolarHBondContact OD1-N 3.26Å; N37-C39 PolarHBondContact OD1-SG 3.2Å; N37-C39 VanDerWaalsContact OD1-SG 3.38Å; N37-G43 PolarHBondContact ND2-O 2.81Å; N37-C45 WeakPolarHBondContact OD1-CB 3.45Å
38	P	89.8	Confident	82.8	Confident	31 Å²	31	81 Å²	81	20%	0.201	46%	0.456	C	S	.	.			trans	-76.1	-11.6	-178.4	31.4	-35.8	0	0	0	113.2	P36 Y59	P36-P38 WeakPolarHBondContact O-CD 3.21Å; P36-P38 VanDerWaalsContact O-N 3.09Å; P38-Y59 HydrophobicContact CB-CE2 3.79Å; P38-Y59 HydrophobicContact CG-CD2 3.65Å; P38-Y59 HydrophobicContact CG-CE1 4.22Å; P38-Y59 HydrophobicContact CG-CE2 3.28Å; P38-Y59 HydrophobicContact CG-CG 4.26Å
39	C	92.9	Very high	84.2	Confident	11 Å²	11	83 Å²	83	7%	0.074	46%	0.455	C	S	.	.			trans	-82.5	126.2	-177.3	-47.5	0	0	0	0	111.5	N37 G43 C61	N37-C39 VanDerWaalsContact C-N 3.25Å; N37-C39 PolarHBondContact O-N 3.46Å; N37-C39 VanDerWaalsContact OD1-CB 3.29Å; N37-C39 WeakPolarHBondContact OD1-CB 3.34Å; N37-C39 PolarHBondContact OD1-N 3.26Å; N37-C39 PolarHBondContact OD1-SG 3.2Å; N37-C39 VanDerWaalsContact OD1-SG 3.38Å; C39-G43 WeakPolarHBondContact CB-O 3.3Å; C39-C61 WeakPolarHBondContact CA-SG 3.44Å; C39-C61 HydrophobicContact CB-CB 3.77Å; C39-C61 WeakPolarHBondContact CB-SG 3.29Å; C39-C61 WeakPolarHBondContact SG-CA 3.33Å; C39-C61 WeakPolarHBondContact SG-CB 3.44Å; C39-C61 CovalentContact SG-SG 2.03Å; C39-C61 PolarHBondContact SG-SG 2.04Å
40	H	93	Very high	84.8	Confident	108 Å²	108	80 Å²	80	50%	0.5	44%	0.437	S	S	.	.	S	Bend	trans	-77.2	171.5	174.8	-63.9	-78.3	0	0	0	112.2	R42 G43 H71	H40-R42 PolarHBondContact O-N 3.24Å; H40-R42 VanDerWaalsContact O-N 3.11Å; H40-G43 PolarHBondContact O-N 3.14Å; H40-H71 WeakPolarHBondContact CB-O 3.27Å; H40-H71 PolarHBondContact N-O 3.19Å
41	N	89.9	Confident	85.1	Confident	76 Å²	76	83.2 Å²	83.2	41%	0.406	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.3	35.3	171.8	-61.1	-46	0	0	0	115.2	G43 P64 F67 C72	N41-G43 VanDerWaalsContact C-N 3.28Å; N41-G43 PolarHBondContact O-N 3.49Å; N41-P64 VanDerWaalsContact O-CG 3.23Å; N41-P64 WeakPolarHBondContact O-CG 3.31Å; N41-F67 HydrophobicContact CB-CD1 3.72Å; N41-F67 HydrophobicContact CB-CD2 3.99Å; N41-F67 HydrophobicContact CB-CE1 3.63Å; N41-F67 HydrophobicContact CB-CE2 3.87Å; N41-F67 HydrophobicContact CB-CG 3.89Å; N41-F67 HydrophobicContact CB-CZ 3.69Å; N41-F67 WeakPolarHBondContact ND2-CD1 3.2Å; N41-F67 WeakPolarHBondContact ND2-CE1 3.34Å; N41-C72 PolarHBondContact ND2-O 2.77Å
42	R	90.9	Very high	84.8	Confident	239 Å²	239	87.2 Å²	87.2	90%	0.902	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.8	28	-175.8	-51.6	177.3	174.4	174.5	-1.9	113.8	H40	H40-R42 PolarHBondContact O-N 3.24Å; H40-R42 VanDerWaalsContact O-N 3.11Å
43	G	90.7	Very high	84.5	Confident	2 Å²	2	88.8 Å²	88.8	2%	0.021	46%	0.455	C	S	.	.	P	Polyproline II helix	trans	-62.5	144.8	170.3	0	0	0	0	0	112.6	N37 C39 H40 N41 K62	N37-G43 PolarHBondContact ND2-O 2.81Å; C39-G43 WeakPolarHBondContact CB-O 3.3Å; H40-G43 PolarHBondContact O-N 3.14Å; N41-G43 VanDerWaalsContact C-N 3.28Å; N41-G43 PolarHBondContact O-N 3.49Å; G43-K62 WeakPolarHBondContact CA-O 3.01Å
44	T	93.6	Very high	83.7	Confident	85 Å²	85	94.3 Å²	94.3	52%	0.521	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	122.5	178.9	-56.3	0	0	0	0	109.2	K62	T44-K62 PolarHBondContact N-O 2.81Å; T44-K62 PolarHBondContact O-N 3.38Å
45	C	92.1	Very high	82.6	Confident	24 Å²	24	98 Å²	98	16%	0.162	50%	0.503	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	128.5	176.2	-170.6	0	0	0	0	110.6	C34 N37	C34-C45 WeakPolarHBondContact CA-SG 3.36Å; C34-C45 HydrophobicContact CB-CB 3.63Å; C34-C45 WeakPolarHBondContact CB-SG 3.29Å; C34-C45 VanDerWaalsContact SG-C 3.59Å; C34-C45 WeakPolarHBondContact SG-CB 3.28Å; C34-C45 CovalentContact SG-SG 2.04Å; C34-C45 PolarHBondContact SG-SG 3.43Å; N37-C45 WeakPolarHBondContact OD1-CB 3.45Å
46	E	91.8	Very high	82	Confident	76 Å²	76	96.8 Å²	96.8	36%	0.355	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	133.1	172.8	-66.9	-175.3	174.5	0	0	109.6	S48 Y59 V60 K62	E46-S48 PolarHBondContact O-N 2.85Å; E46-Y59 CarbonylContact O-C 3.54Å; E46-Y59 VanDerWaalsContact O-CA 3.3Å; E46-Y59 WeakPolarHBondContact O-CA 3.44Å; E46-V60 HydrophobicContact CB-CG1 4.09Å; E46-V60 PolarHBondContact N-O 2.94Å; E46-V60 PolarHBondContact O-N 3.38Å; E46-K62 VanDerWaalsContact OE1-CD 3.3Å; E46-K62 WeakPolarHBondContact OE1-CD 3.42Å; E46-K62 VanDerWaalsContact OE1-CE 3.27Å; E46-K62 WeakPolarHBondContact OE1-CE 3.43Å; E46-K62 IonicContact OE1-NZ 2.7Å; E46-K62 PolarHBondContact OE1-NZ 2.04Å; E46-K62 WeakPolarHBondContact OE2-CE 3.07Å; E46-K62 IonicContact OE2-NZ 2.77Å; E46-K62 PolarHBondContact OE2-NZ 3.48Å
47	I	86.4	Confident	81.3	Confident	134 Å²	134	93.5 Å²	93.5	69%	0.687	47%	0.472	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.4	130	176	-57.5	174.1	0	0	0	107.9	P33	P33-I47 HydrophobicContact CG-CG1 4.48Å
48	S	81.4	Confident	81	Confident	41 Å²	41	89.7 Å²	89.7	29%	0.287	45%	0.453	S	S	.	.			trans	-148.4	147.7	-175	-169.2	0	0	0	0	110.7	E46 T50 G58 Y59	E46-S48 PolarHBondContact O-N 2.85Å; S48-T50 PolarHBondContact O-N 3.22Å; S48-G58 PolarHBondContact N-O 3.28Å; S48-G58 CarbonylContact O-C 3.56Å; S48-G58 WeakPolarHBondContact O-CA 3.47Å; S48-Y59 PolarHBondContact O-N 2.83Å
49	E	80.6	Confident	80.8	Confident	164 Å²	164	90.2 Å²	90.2	77%	0.766	45%	0.451	S	S	*	.			trans	-83.6	48.6	176	-62.6	-171.6	-177.3	0	0	111.8	Y51	E49-Y51 WeakPolarHBondContact O-CD2 3.38Å
50	T	67.5	Low	80.7	Confident	54 Å²	54	92.6 Å²	92.6	33%	0.331	47%	0.465	S	S	.	.			trans	-89.3	131.7	-177.9	36.9	0	0	0	0	112	S48 I57 Y59	S48-T50 PolarHBondContact O-N 3.22Å; T50-I57 PolarHBondContact O-N 2.99Å; T50-Y59 PolarHBondContact OG1-O 3.09Å; T50-Y59 VanDerWaalsContact OG1-O 3.14Å
51	Y	69.3	Low	80.7	Confident	160 Å²	160	88.1 Å²	88.1	63%	0.627	45%	0.445	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.5	144.3	175.3	-63	-96.1	0	0	0	110.2	E49 F56	E49-Y51 WeakPolarHBondContact O-CD2 3.38Å; Y51-F56 HydrophobicContact CD1-CB 4.24Å; Y51-F56 HydrophobicContact CD1-CD2 4.09Å; Y51-F56 HydrophobicContact CE1-CB 4.13Å; Y51-F56 AromaticContact CE1-CD2 3.67Å; Y51-F56 HydrophobicContact CE1-CD2 3.67Å; Y51-F56 HydrophobicContact CE1-CG 4.37Å; Y51-F56 HydrophobicContact CE2-CD2 4.26Å; Y51-F56 AromaticContact CZ-CD2 3.75Å
52	R	64.5	Low	80.8	Confident	174 Å²	174	89.8 Å²	89.8	66%	0.657	45%	0.449	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123	93.4	170.1	-170.6	-177.1	-171.7	-165.3	1.7	109.2	T55 I57	R52-T55 PolarHBondContact N-O 2.87Å; R52-I57 HydrophobicContact CB-CD1 3.44Å; R52-I57 VanDerWaalsContact CB-CD1 3.44Å; R52-I57 HydrophobicContact CB-CG1 4.26Å; R52-I57 HydrophobicContact CG-CD1 4.33Å
53	G	69.9	Low	81	Confident	67 Å²	67	80.5 Å²	80.5	69%	0.691	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.4	-131.8	-166.3	0	0	0	0	0	109.8	T55	G53-T55 VanDerWaalsContact C-N 3.32Å
54	D	67.4	Low	81	Confident	175 Å²	175	82.7 Å²	82.7	94%	0.936	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-0.5	-178.9	-56.3	-32.9	0	0	0	113.7
55	T	62.8	Low	80.9	Confident	95 Å²	95	86.6 Å²	86.6	58%	0.583	45%	0.447	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103	127.1	-176.6	-49.3	0	0	0	0	111.8	R52 G53	R52-T55 PolarHBondContact N-O 2.87Å; G53-T55 VanDerWaalsContact C-N 3.32Å
56	F	73.1	Confident	80.7	Confident	115 Å²	115	85.7 Å²	85.7	50%	0.504	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	124.3	172.2	-178.1	-103.3	0	0	0	110.9	Y51	Y51-F56 HydrophobicContact CD1-CB 4.24Å; Y51-F56 HydrophobicContact CD1-CD2 4.09Å; Y51-F56 HydrophobicContact CE1-CB 4.13Å; Y51-F56 AromaticContact CE1-CD2 3.67Å; Y51-F56 HydrophobicContact CE1-CD2 3.67Å; Y51-F56 HydrophobicContact CE1-CG 4.37Å; Y51-F56 HydrophobicContact CE2-CD2 4.26Å; Y51-F56 AromaticContact CZ-CD2 3.75Å
57	I	71.9	Confident	80.8	Confident	49 Å²	49	83.6 Å²	83.6	25%	0.251	43%	0.431	S	S	.	.			trans	-99.9	-33.3	-178.2	-60.3	-179.8	0	0	0	111.2	T50 R52 Y59	T50-I57 PolarHBondContact O-N 2.99Å; R52-I57 HydrophobicContact CB-CD1 3.44Å; R52-I57 VanDerWaalsContact CB-CD1 3.44Å; R52-I57 HydrophobicContact CB-CG1 4.26Å; R52-I57 HydrophobicContact CG-CD1 4.33Å; I57-Y59 VanDerWaalsContact C-N 3.29Å; I57-Y59 HydrophobicContact CG2-CD1 3.64Å; I57-Y59 HydrophobicContact CG2-CE1 3.37Å; I57-Y59 HydrophobicContact CG2-CE2 4.42Å; I57-Y59 HydrophobicContact CG2-CG 4.31Å; I57-Y59 WeakPolarHBondContact O-CD1 3.05Å; I57-Y59 PolarHBondContact O-N 3.16Å
58	G	82.5	Confident	81	Confident	4 Å²	4	79.5 Å²	79.5	4%	0.041	41%	0.414	C	S	.	.			trans	76.4	4	172.4	0	0	0	0	0	116.1	P33 S48	P33-G58 WeakPolarHBondContact CG-O 2.96Å; S48-G58 PolarHBondContact N-O 3.28Å; S48-G58 CarbonylContact O-C 3.56Å; S48-G58 WeakPolarHBondContact O-CA 3.47Å
59	Y	85.8	Confident	81.4	Confident	42 Å²	42	79.1 Å²	79.1	17%	0.165	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	162.1	176.6	67.9	-85.5	0	0	0	112.8	P33 P38 E46 S48 T50 I57 H71	P33-Y59 HydrophobicContact CB-CD1 3.77Å; P33-Y59 HydrophobicContact CB-CG 4.43Å; P38-Y59 HydrophobicContact CB-CE2 3.79Å; P38-Y59 HydrophobicContact CG-CD2 3.65Å; P38-Y59 HydrophobicContact CG-CE1 4.22Å; P38-Y59 HydrophobicContact CG-CE2 3.28Å; P38-Y59 HydrophobicContact CG-CG 4.26Å; E46-Y59 CarbonylContact O-C 3.54Å; E46-Y59 VanDerWaalsContact O-CA 3.3Å; E46-Y59 WeakPolarHBondContact O-CA 3.44Å; S48-Y59 PolarHBondContact O-N 2.83Å; T50-Y59 PolarHBondContact OG1-O 3.09Å; T50-Y59 VanDerWaalsContact OG1-O 3.14Å; I57-Y59 VanDerWaalsContact C-N 3.29Å; I57-Y59 HydrophobicContact CG2-CD1 3.64Å; I57-Y59 HydrophobicContact CG2-CE1 3.37Å; I57-Y59 HydrophobicContact CG2-CE2 4.42Å; I57-Y59 HydrophobicContact CG2-CG 4.31Å; I57-Y59 WeakPolarHBondContact O-CD1 3.05Å; I57-Y59 PolarHBondContact O-N 3.16Å; Y59-H71 AromaticContact CE2-CE1 3.75Å; Y59-H71 AromaticContact CE2-ND1 3.72Å; Y59-H71 AromaticContact CZ-CE1 3.68Å; Y59-H71 PolarHBondContact OH-CE1 2.03Å; Y59-H71 PolarHBondContact OH-ND1 2.78Å
60	V	89.9	Confident	81.8	Confident	60 Å²	60	74.5 Å²	74.5	36%	0.364	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	137.8	169.7	67.3	0	0	0	0	109.7	E46	E46-V60 HydrophobicContact CB-CG1 4.09Å; E46-V60 PolarHBondContact N-O 2.94Å; E46-V60 PolarHBondContact O-N 3.38Å
61	C	92	Very high	82.9	Confident	14 Å²	14	74.3 Å²	74.3	10%	0.095	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	122.5	173.4	-69.1	0	0	0	0	110.5	C39 C63 V70	C39-C61 WeakPolarHBondContact CA-SG 3.44Å; C39-C61 HydrophobicContact CB-CB 3.77Å; C39-C61 WeakPolarHBondContact CB-SG 3.29Å; C39-C61 WeakPolarHBondContact SG-CA 3.33Å; C39-C61 WeakPolarHBondContact SG-CB 3.44Å; C39-C61 CovalentContact SG-SG 2.03Å; C39-C61 PolarHBondContact SG-SG 2.04Å; C61-C63 PolarHBondContact O-N 3.5Å; C61-V70 WeakPolarHBondContact CB-O 2.91Å
62	K	93.7	Very high	84	Confident	111 Å²	111	66.7 Å²	66.7	48%	0.483	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	109.5	165.3	-74.6	-171.3	174.8	160.8	0	109.3	G43 T44 E46	G43-K62 WeakPolarHBondContact CA-O 3.01Å; T44-K62 PolarHBondContact N-O 2.81Å; T44-K62 PolarHBondContact O-N 3.38Å; E46-K62 VanDerWaalsContact OE1-CD 3.3Å; E46-K62 WeakPolarHBondContact OE1-CD 3.42Å; E46-K62 VanDerWaalsContact OE1-CE 3.27Å; E46-K62 WeakPolarHBondContact OE1-CE 3.43Å; E46-K62 IonicContact OE1-NZ 2.7Å; E46-K62 PolarHBondContact OE1-NZ 2.04Å; E46-K62 WeakPolarHBondContact OE2-CE 3.07Å; E46-K62 IonicContact OE2-NZ 2.77Å; E46-K62 PolarHBondContact OE2-NZ 3.48Å
63	C	93.8	Very high	85.3	Confident	45 Å²	45	62 Å²	62	30%	0.304	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-77.7	138.3	-178.4	-56.3	0	0	0	0	111.9	C61 F67 C72	C61-C63 PolarHBondContact O-N 3.5Å; C63-F67 HydrophobicContact CB-CB 4.25Å; C63-F67 WeakPolarHBondContact CB-O 3.01Å; C63-C72 WeakPolarHBondContact CA-SG 3.24Å; C63-C72 HydrophobicContact CB-CB 3.74Å; C63-C72 WeakPolarHBondContact CB-SG 3.33Å; C63-C72 PolarHBondContact N-SG 2.7Å; C63-C72 WeakPolarHBondContact SG-CA 3.3Å; C63-C72 WeakPolarHBondContact SG-CB 3.22Å; C63-C72 CovalentContact SG-SG 2.04Å; C63-C72 PolarHBondContact SG-SG 3.43Å
64	P	91.3	Very high	86.3	Confident	47 Å²	47	63.7 Å²	63.7	31%	0.305	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-65.8	160.7	168.5	20.3	-16.6	0	0	0	110	N41 G66 F67	N41-P64 VanDerWaalsContact O-CG 3.23Å; N41-P64 WeakPolarHBondContact O-CG 3.31Å; P64-G66 PolarHBondContact O-N 2.81Å; P64-F67 HydrophobicContact CG-CD2 3.84Å; P64-F67 PolarHBondContact O-N 2.91Å; P64-F67 VanDerWaalsContact O-N 3.12Å
65	Q	91	Very high	87.4	Confident	168 Å²	168	58.1 Å²	58.1	79%	0.785	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.7	137.9	177.1	-168.8	-179.5	-10	0	0	110.2	A95	Q65-A95 HydrophobicContact CB-CB 4.32Å; Q65-A95 HydrophobicContact CG-CB 4.06Å; Q65-A95 WeakPolarHBondContact O-CB 3Å
66	G	88.8	Confident	88.8	Confident	5 Å²	5	56.9 Å²	56.9	5%	0.052	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.7	-3.4	-177.1	0	0	0	0	0	115.2	P64 N75 I76	P64-G66 PolarHBondContact O-N 2.81Å; G66-N75 PolarHBondContact O-OD1 2.81Å; G66-I76 WeakPolarHBondContact O-CB 3.14Å; G66-I76 PolarHBondContact O-N 3.04Å
67	F	93.2	Very high	89.6	Confident	32 Å²	32	54.4 Å²	54.4	14%	0.14	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	148.8	177.4	-65.1	-80.9	0	0	0	113	N41 C63 P64 C72 H74 N75 V94	N41-F67 HydrophobicContact CB-CD1 3.72Å; N41-F67 HydrophobicContact CB-CD2 3.99Å; N41-F67 HydrophobicContact CB-CE1 3.63Å; N41-F67 HydrophobicContact CB-CE2 3.87Å; N41-F67 HydrophobicContact CB-CG 3.89Å; N41-F67 HydrophobicContact CB-CZ 3.69Å; N41-F67 WeakPolarHBondContact ND2-CD1 3.2Å; N41-F67 WeakPolarHBondContact ND2-CE1 3.34Å; C63-F67 HydrophobicContact CB-CB 4.25Å; C63-F67 WeakPolarHBondContact CB-O 3.01Å; P64-F67 HydrophobicContact CG-CD2 3.84Å; P64-F67 PolarHBondContact O-N 2.91Å; P64-F67 VanDerWaalsContact O-N 3.12Å; F67-C72 HydrophobicContact CB-CB 4.25Å; F67-H74 CarbonylContact C-O 3.52Å; F67-H74 VanDerWaalsContact CA-O 3.31Å; F67-H74 WeakPolarHBondContact CA-O 3.23Å; F67-N75 HydrophobicContact CE1-CB 4.36Å; F67-V94 HydrophobicContact CD2-CG1 4.42Å; F67-V94 HydrophobicContact CE2-CG1 3.4Å; F67-V94 HydrophobicContact CZ-CG1 3.51Å; F67-V94 HydrophobicContact CZ-CG2 4.21Å
68	S	91.8	Very high	90.6	Very high	47 Å²	47	53.9 Å²	53.9	33%	0.329	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	174.2	179.4	68.1	0	0	0	0	111.9	C72 Q73 H74	S68-C72 CarbonylContact O-C 3.56Å; S68-C72 VanDerWaalsContact O-C 3.31Å; S68-C72 VanDerWaalsContact O-CA 3.29Å; S68-C72 WeakPolarHBondContact O-CA 3.2Å; S68-Q73 PolarHBondContact O-N 3.4Å; S68-H74 PolarHBondContact N-O 2.89Å; S68-H74 WeakPolarHBondContact O-CB 3.44Å; S68-H74 PolarHBondContact O-N 3.11Å
69	G	89.3	Confident	91.2	Very high	34 Å²	34	54.5 Å²	54.5	35%	0.351	29%	0.292	S	S	.	.	S	Bend	trans	98.1	164.4	-175.8	0	0	0	0	0	113.2	H71 C72	G69-H71 PolarHBondContact O-N 3.08Å; G69-C72 PolarHBondContact O-N 3.16Å; G69-C72 VanDerWaalsContact O-N 3.09Å
70	V	88.3	Confident	91.5	Very high	67 Å²	67	59.7 Å²	59.7	41%	0.406	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-30.7	-175.3	-177.5	0	0	0	0	112.4	C61	C61-V70 WeakPolarHBondContact CB-O 2.91Å
71	H	90.9	Very high	91.5	Very high	49 Å²	49	65.8 Å²	65.8	23%	0.227	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.6	20.1	177.3	-53.6	-53.1	0	0	0	112.1	H40 Y59 G69 Q73	H40-H71 WeakPolarHBondContact CB-O 3.27Å; H40-H71 PolarHBondContact N-O 3.19Å; Y59-H71 AromaticContact CE2-CE1 3.75Å; Y59-H71 AromaticContact CE2-ND1 3.72Å; Y59-H71 AromaticContact CZ-CE1 3.68Å; Y59-H71 PolarHBondContact OH-CE1 2.03Å; Y59-H71 PolarHBondContact OH-ND1 2.78Å; G69-H71 PolarHBondContact O-N 3.08Å; H71-Q73 VanDerWaalsContact C-OE1 3.28Å; H71-Q73 VanDerWaalsContact CA-OE1 3.3Å; H71-Q73 PolarHBondContact O-N 2.95Å; H71-Q73 VanDerWaalsContact O-N 3.16Å
72	C	92.4	Very high	91.4	Very high	0 Å²	0	70.9 Å²	70.9	0%	0	37%	0.365	C	S	.	.	S	Bend	trans	56.9	28.6	-177	-46.1	0	0	0	0	113.8	N41 C63 F67 S68 G69 H74	N41-C72 PolarHBondContact ND2-O 2.77Å; C63-C72 WeakPolarHBondContact CA-SG 3.24Å; C63-C72 HydrophobicContact CB-CB 3.74Å; C63-C72 WeakPolarHBondContact CB-SG 3.33Å; C63-C72 PolarHBondContact N-SG 2.7Å; C63-C72 WeakPolarHBondContact SG-CA 3.3Å; C63-C72 WeakPolarHBondContact SG-CB 3.22Å; C63-C72 CovalentContact SG-SG 2.04Å; C63-C72 PolarHBondContact SG-SG 3.43Å; F67-C72 HydrophobicContact CB-CB 4.25Å; S68-C72 CarbonylContact O-C 3.56Å; S68-C72 VanDerWaalsContact O-C 3.31Å; S68-C72 VanDerWaalsContact O-CA 3.29Å; S68-C72 WeakPolarHBondContact O-CA 3.2Å; G69-C72 PolarHBondContact O-N 3.16Å; G69-C72 VanDerWaalsContact O-N 3.09Å; C72-H74 VanDerWaalsContact C-N 3.34Å
73	Q	91.5	Very high	91.4	Very high	76 Å²	76	66.3 Å²	66.3	36%	0.355	35%	0.347	S	S	.	.			trans	-80.3	-13.8	-174.2	72.1	-84.9	18.8	0	0	113.7	S68 H71	S68-Q73 PolarHBondContact O-N 3.4Å; H71-Q73 VanDerWaalsContact C-OE1 3.28Å; H71-Q73 VanDerWaalsContact CA-OE1 3.3Å; H71-Q73 PolarHBondContact O-N 2.95Å; H71-Q73 VanDerWaalsContact O-N 3.16Å
74	H	90.6	Very high	91.4	Very high	103 Å²	103	65 Å²	65	48%	0.477	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	123.7	-177.1	-57.4	-58.4	0	0	0	110.3	F67 S68 C72	F67-H74 CarbonylContact C-O 3.52Å; F67-H74 VanDerWaalsContact CA-O 3.31Å; F67-H74 WeakPolarHBondContact CA-O 3.23Å; S68-H74 PolarHBondContact N-O 2.89Å; S68-H74 WeakPolarHBondContact O-CB 3.44Å; S68-H74 PolarHBondContact O-N 3.11Å; C72-H74 VanDerWaalsContact C-N 3.34Å
75	N	90.6	Very high	91.4	Very high	57 Å²	57	67.4 Å²	67.4	31%	0.305	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	130.9	163	-164.1	40.1	0	0	0	107.8	G66 F67 N77 D92 Q93	G66-N75 PolarHBondContact O-OD1 2.81Å; F67-N75 HydrophobicContact CE1-CB 4.36Å; N75-N77 PolarHBondContact O-N 3.04Å; N75-D92 PolarHBondContact ND2-OD2 2.02Å; N75-Q93 PolarHBondContact ND2-O 3.02Å
76	I	92.3	Very high	91.4	Very high	70 Å²	70	63 Å²	63	36%	0.359	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-70.4	122.8	171.9	-65	175.2	0	0	0	106.3	G66 E78	G66-I76 WeakPolarHBondContact O-CB 3.14Å; G66-I76 PolarHBondContact O-N 3.04Å; I76-E78 PolarHBondContact O-N 3.15Å; I76-E78 VanDerWaalsContact O-N 3.15Å
77	N	90.7	Very high	91.4	Very high	62 Å²	62	66 Å²	66	33%	0.332	36%	0.356	S	S	.	.			trans	-79.9	98.2	176.6	-178.7	-1.3	0	0	0	109.4	N75 C79 E80 D92	N75-N77 PolarHBondContact O-N 3.04Å; N77-C79 PolarHBondContact O-N 2.79Å; N77-C79 VanDerWaalsContact O-N 3.16Å; N77-C79 VanDerWaalsContact OD1-CB 3.24Å; N77-C79 WeakPolarHBondContact OD1-CB 3.47Å; N77-C79 PolarHBondContact OD1-N 3.03Å; N77-E80 HydrophobicContact CB-CG 3.89Å; N77-E80 PolarHBondContact O-N 3.02Å; N77-D92 WeakPolarHBondContact CA-OD1 3.39Å
78	E	92.6	Very high	91.3	Very high	38 Å²	38	65.1 Å²	65.1	18%	0.178	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-65.9	-16.5	-179.4	-80.1	89.5	-158.3	0	0	112.9	I76 D92 Q93 A95 N96 Y97	I76-E78 PolarHBondContact O-N 3.15Å; I76-E78 VanDerWaalsContact O-N 3.15Å; E78-D92 PolarHBondContact N-OD1 2.87Å; E78-Q93 VanDerWaalsContact OE2-O 3.12Å; E78-A95 WeakPolarHBondContact OE1-CA 3.38Å; E78-N96 PolarHBondContact OE2-N 3.12Å; E78-Y97 HydrophobicContact CB-CD1 3.94Å; E78-Y97 HydrophobicContact CB-CG 4.43Å
79	C	94.1	Very high	91.4	Very high	17 Å²	17	68 Å²	68	12%	0.115	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	-77.4	-15	176.5	-64.4	0	0	0	0	114.3	N77 K81 D82 C90 D92	N77-C79 PolarHBondContact O-N 2.79Å; N77-C79 VanDerWaalsContact O-N 3.16Å; N77-C79 VanDerWaalsContact OD1-CB 3.24Å; N77-C79 WeakPolarHBondContact OD1-CB 3.47Å; N77-C79 PolarHBondContact OD1-N 3.03Å; C79-K81 PolarHBondContact O-N 3Å; C79-K81 VanDerWaalsContact O-N 3.08Å; C79-D82 PolarHBondContact O-N 3.46Å; C79-C90 WeakPolarHBondContact CA-SG 3.44Å; C79-C90 HydrophobicContact CB-CB 3.65Å; C79-C90 WeakPolarHBondContact CB-SG 3Å; C79-C90 VanDerWaalsContact SG-C 3.52Å; C79-C90 WeakPolarHBondContact SG-CB 3.39Å; C79-C90 CovalentContact SG-SG 2.03Å; C79-C90 PolarHBondContact SG-SG 2.95Å; C79-D92 PolarHBondContact SG-N 3.04Å; C79-D92 VanDerWaalsContact SG-N 3.4Å
80	E	92.4	Very high	91.7	Very high	152 Å²	152	68.1 Å²	68.1	71%	0.71	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	-60.8	-21.2	179.4	-75.3	-179.2	-178.7	0	0	113.5	N77 D82	N77-E80 HydrophobicContact CB-CG 3.89Å; N77-E80 PolarHBondContact O-N 3.02Å; E80-D82 VanDerWaalsContact C-N 3.31Å
81	K	90.5	Very high	92.1	Very high	188 Å²	188	68.4 Å²	68.4	82%	0.817	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	-88.6	5.9	178.2	-64.5	-176.7	-179.7	176.5	0	113.7	C79	C79-K81 PolarHBondContact O-N 3Å; C79-K81 VanDerWaalsContact O-N 3.08Å
82	D	90.4	Very high	92.1	Very high	120 Å²	120	68.9 Å²	68.9	64%	0.642	37%	0.368	S	S	*	.			trans	45.8	59.4	-174.2	-64.8	-45	0	0	0	113	C79 E80 C84 K85	C79-D82 PolarHBondContact O-N 3.46Å; E80-D82 VanDerWaalsContact C-N 3.31Å; D82-C84 VanDerWaalsContact C-N 3.32Å; D82-C84 PolarHBondContact O-N 3.41Å; D82-K85 PolarHBondContact O-NZ 2.03Å
83	P	92.6	Very high	92	Very high	16 Å²	16	72.7 Å²	72.7	10%	0.104	39%	0.386	C	S	.	.			trans	-67.7	-33.6	-177.6	27.9	-34.3	0	0	0	112.1	K85 Y97 N109	P83-K85 PolarHBondContact O-N 2.94Å; P83-Y97 HydrophobicContact CB-CD2 4.05Å; P83-Y97 HydrophobicContact CB-CE1 4.03Å; P83-Y97 HydrophobicContact CB-CE2 3.52Å; P83-Y97 VanDerWaalsContact CB-CZ 3.49Å; P83-Y97 HydrophobicContact CG-CD1 4.22Å; P83-Y97 HydrophobicContact CG-CD2 3.64Å; P83-Y97 HydrophobicContact CG-CE1 4.23Å; P83-Y97 HydrophobicContact CG-CE2 3.67Å; P83-Y97 HydrophobicContact CG-CG 3.92Å; P83-N109 WeakPolarHBondContact O-CB 3.03Å
84	C	93.9	Very high	92	Very high	16 Å²	16	73.3 Å²	73.3	11%	0.108	40%	0.395	C	S	.	.			trans	-72.5	120.2	179.8	-51.8	0	0	0	0	111.5	D82 G88 C90 C99	D82-C84 VanDerWaalsContact C-N 3.32Å; D82-C84 PolarHBondContact O-N 3.41Å; C84-G88 WeakPolarHBondContact CB-O 3.2Å; C84-C90 HydrophobicContact CB-CB 4.41Å; C84-C90 WeakPolarHBondContact SG-CA 3.47Å; C84-C90 WeakPolarHBondContact SG-CB 3.47Å; C84-C99 WeakPolarHBondContact CA-SG 3.3Å; C84-C99 HydrophobicContact CB-CB 3.81Å; C84-C99 WeakPolarHBondContact CB-SG 3.43Å; C84-C99 VanDerWaalsContact SG-CA 3.5Å; C84-C99 WeakPolarHBondContact SG-CB 2.99Å; C84-C99 CovalentContact SG-SG 2.02Å; C84-C99 PolarHBondContact SG-SG 3.46Å
85	K	91.3	Very high	91.8	Very high	98 Å²	98	70 Å²	70	43%	0.426	39%	0.385	S	S	.	.			trans	-91.9	170.7	179.1	-54.4	-52.3	178.8	-161	0	111.4	D82 P83 G87 G88 N109 C110	D82-K85 PolarHBondContact O-NZ 2.03Å; P83-K85 PolarHBondContact O-N 2.94Å; K85-G87 VanDerWaalsContact C-N 3.25Å; K85-G87 PolarHBondContact O-N 3.4Å; K85-G87 VanDerWaalsContact O-N 3.14Å; K85-G88 PolarHBondContact O-N 3.04Å; K85-N109 WeakPolarHBondContact CB-O 3.33Å; K85-N109 PolarHBondContact N-O 2.84Å; K85-C110 WeakPolarHBondContact O-CB 3.46Å
86	N	90.5	Very high	91.7	Very high	77 Å²	77	69.7 Å²	69.7	41%	0.412	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.2	35.9	171	-57.5	-52.2	0	0	0	114.8	G88 P102 Y105 C110	N86-G88 VanDerWaalsContact C-N 3.35Å; N86-P102 WeakPolarHBondContact O-CG 3.4Å; N86-Y105 HydrophobicContact CB-CD1 3.62Å; N86-Y105 HydrophobicContact CB-CD2 3.89Å; N86-Y105 HydrophobicContact CB-CE1 3.56Å; N86-Y105 HydrophobicContact CB-CE2 3.85Å; N86-Y105 HydrophobicContact CB-CG 3.77Å; N86-Y105 WeakPolarHBondContact ND2-CD1 3.39Å; N86-Y105 WeakPolarHBondContact ND2-CE1 3.45Å; N86-C110 PolarHBondContact ND2-O 2.73Å
87	G	88.6	Confident	91.7	Very high	66 Å²	66	68.3 Å²	68.3	68%	0.68	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	76	19.1	179.9	0	0	0	0	0	114.5	K85	K85-G87 VanDerWaalsContact C-N 3.25Å; K85-G87 PolarHBondContact O-N 3.4Å; K85-G87 VanDerWaalsContact O-N 3.14Å
88	G	92.4	Very high	91.8	Very high	15 Å²	15	67.4 Å²	67.4	16%	0.155	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-62.1	139.9	170.4	0	0	0	0	0	112.5	C84 K85 N86 E100	C84-G88 WeakPolarHBondContact CB-O 3.2Å; K85-G88 PolarHBondContact O-N 3.04Å; N86-G88 VanDerWaalsContact C-N 3.35Å; G88-E100 WeakPolarHBondContact CA-O 3.45Å
89	I	94.1	Very high	91.8	Very high	108 Å²	108	66.8 Å²	66.8	55%	0.554	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89	119	176.4	-58.8	174.4	0	0	0	108.2	C99 E100	I89-C99 WeakPolarHBondContact O-CA 3.23Å; I89-E100 HydrophobicContact CB-CB 4.39Å; I89-E100 PolarHBondContact N-O 2.82Å; I89-E100 PolarHBondContact O-N 3.4Å
90	C	95.6	Very high	91.7	Very high	35 Å²	35	71.3 Å²	71.3	24%	0.236	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	132.5	178.6	-165	0	0	0	0	111.1	C79 C84	C79-C90 WeakPolarHBondContact CA-SG 3.44Å; C79-C90 HydrophobicContact CB-CB 3.65Å; C79-C90 WeakPolarHBondContact CB-SG 3Å; C79-C90 VanDerWaalsContact SG-C 3.52Å; C79-C90 WeakPolarHBondContact SG-CB 3.39Å; C79-C90 CovalentContact SG-SG 2.03Å; C79-C90 PolarHBondContact SG-SG 2.95Å; C84-C90 HydrophobicContact CB-CB 4.41Å; C84-C90 WeakPolarHBondContact SG-CA 3.47Å; C84-C90 WeakPolarHBondContact SG-CB 3.47Å
91	T	95.2	Very high	91.6	Very high	74 Å²	74	65.5 Å²	65.5	45%	0.454	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	121.9	169.2	-53.2	0	0	0	0	108.8	Y97 S98	T91-Y97 WeakPolarHBondContact O-CA 3.35Å; T91-S98 PolarHBondContact N-O 3.47Å; T91-S98 PolarHBondContact O-N 2.88Å
92	D	92.1	Very high	91.4	Very high	58 Å²	58	59.2 Å²	59.2	31%	0.31	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	139.7	176.2	-173.5	51.7	0	0	0	110.7	N75 N77 E78 C79	N75-D92 PolarHBondContact ND2-OD2 2.02Å; N77-D92 WeakPolarHBondContact CA-OD1 3.39Å; E78-D92 PolarHBondContact N-OD1 2.87Å; C79-D92 PolarHBondContact SG-N 3.04Å; C79-D92 VanDerWaalsContact SG-N 3.4Å
93	Q	90.5	Very high	91	Very high	80 Å²	80	54.8 Å²	54.8	37%	0.374	33%	0.329	S	S	.	.			trans	-131.8	-176.8	172.9	-52.4	-173.6	-23.7	0	0	108.6	N75 E78 A95 N96 S98	N75-Q93 PolarHBondContact ND2-O 3.02Å; E78-Q93 VanDerWaalsContact OE2-O 3.12Å; Q93-A95 PolarHBondContact O-N 3.16Å; Q93-N96 CarbonylContact C-O 3.5Å; Q93-N96 VanDerWaalsContact C-O 3.29Å; Q93-N96 VanDerWaalsContact CA-O 3.23Å; Q93-N96 WeakPolarHBondContact CA-O 3.39Å; Q93-N96 HydrophobicContact CB-CB 4.3Å; Q93-N96 WeakPolarHBondContact CB-O 3.05Å; Q93-N96 PolarHBondContact N-O 2.73Å; Q93-N96 PolarHBondContact OE1-ND2 2.78Å; Q93-S98 PolarHBondContact NE2-OG 3Å
94	V	90.5	Very high	90.6	Very high	89 Å²	89	56.8 Å²	56.8	54%	0.539	34%	0.337	S	S	.	.	S	Bend	trans	-83.5	118.3	176	177.1	0	0	0	0	108.7	F67 N96	F67-V94 HydrophobicContact CD2-CG1 4.42Å; F67-V94 HydrophobicContact CE2-CG1 3.4Å; F67-V94 HydrophobicContact CZ-CG1 3.51Å; F67-V94 HydrophobicContact CZ-CG2 4.21Å; V94-N96 PolarHBondContact O-N 3.14Å; V94-N96 VanDerWaalsContact O-N 3.16Å
95	A	86.3	Confident	90.3	Very high	34 Å²	34	58.5 Å²	58.5	28%	0.281	34%	0.341	S	S	.	.	S	Bend	trans	59.6	19.2	-179.3	0	0	0	0	0	114.1	Q65 E78 Q93	Q65-A95 HydrophobicContact CB-CB 4.32Å; Q65-A95 HydrophobicContact CG-CB 4.06Å; Q65-A95 WeakPolarHBondContact O-CB 3Å; E78-A95 WeakPolarHBondContact OE1-CA 3.38Å; Q93-A95 PolarHBondContact O-N 3.16Å
96	N	89.5	Confident	90.1	Very high	51 Å²	51	54.5 Å²	54.5	27%	0.273	32%	0.324	S	S	.	.			trans	-163.5	167.9	-171.9	-167.6	25	0	0	0	110.2	E78 Q93 V94 R108	E78-N96 PolarHBondContact OE2-N 3.12Å; Q93-N96 CarbonylContact C-O 3.5Å; Q93-N96 VanDerWaalsContact C-O 3.29Å; Q93-N96 VanDerWaalsContact CA-O 3.23Å; Q93-N96 WeakPolarHBondContact CA-O 3.39Å; Q93-N96 HydrophobicContact CB-CB 4.3Å; Q93-N96 WeakPolarHBondContact CB-O 3.05Å; Q93-N96 PolarHBondContact N-O 2.73Å; Q93-N96 PolarHBondContact OE1-ND2 2.78Å; V94-N96 PolarHBondContact O-N 3.14Å; V94-N96 VanDerWaalsContact O-N 3.16Å; N96-R108 PolarHBondContact OD1-NH2 3.17Å
97	Y	92.6	Very high	89.9	Confident	40 Å²	40	52.2 Å²	52.2	16%	0.157	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	161.7	171.5	61.1	-83.7	0	0	0	109.8	E78 P83 T91 N109	E78-Y97 HydrophobicContact CB-CD1 3.94Å; E78-Y97 HydrophobicContact CB-CG 4.43Å; P83-Y97 HydrophobicContact CB-CD2 4.05Å; P83-Y97 HydrophobicContact CB-CE1 4.03Å; P83-Y97 HydrophobicContact CB-CE2 3.52Å; P83-Y97 VanDerWaalsContact CB-CZ 3.49Å; P83-Y97 HydrophobicContact CG-CD1 4.22Å; P83-Y97 HydrophobicContact CG-CD2 3.64Å; P83-Y97 HydrophobicContact CG-CE1 4.23Å; P83-Y97 HydrophobicContact CG-CE2 3.67Å; P83-Y97 HydrophobicContact CG-CG 3.92Å; T91-Y97 WeakPolarHBondContact O-CA 3.35Å; Y97-N109 WeakPolarHBondContact CE2-OD1 3.35Å; Y97-N109 PolarHBondContact OH-ND2 3.2Å; Y97-N109 PolarHBondContact OH-OD1 2.79Å
98	S	92.7	Very high	89.8	Confident	44 Å²	44	56.5 Å²	56.5	31%	0.308	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	142.3	166.6	63.1	0	0	0	0	111.1	T91 Q93	T91-S98 PolarHBondContact N-O 3.47Å; T91-S98 PolarHBondContact O-N 2.88Å; Q93-S98 PolarHBondContact NE2-OG 3Å
99	C	92.9	Very high	89.7	Confident	24 Å²	24	57.6 Å²	57.6	16%	0.162	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	124.1	174.9	-61.4	0	0	0	0	110.3	C84 I89 C101 R108 C110	C84-C99 WeakPolarHBondContact CA-SG 3.3Å; C84-C99 HydrophobicContact CB-CB 3.81Å; C84-C99 WeakPolarHBondContact CB-SG 3.43Å; C84-C99 VanDerWaalsContact SG-CA 3.5Å; C84-C99 WeakPolarHBondContact SG-CB 2.99Å; C84-C99 CovalentContact SG-SG 2.02Å; C84-C99 PolarHBondContact SG-SG 3.46Å; I89-C99 WeakPolarHBondContact O-CA 3.23Å; C99-C101 PolarHBondContact O-N 3.33Å; C99-R108 VanDerWaalsContact CB-O 3.3Å; C99-R108 WeakPolarHBondContact CB-O 3.41Å; C99-R108 PolarHBondContact SG-O 2.78Å; C99-C110 VanDerWaalsContact CB-SG 3.58Å
100	E	91.4	Very high	89.5	Confident	112 Å²	112	52.4 Å²	52.4	52%	0.523	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	106.8	164.6	-171.6	174.5	-174.3	0	0	108.7	G88 I89 K219	G88-E100 WeakPolarHBondContact CA-O 3.45Å; I89-E100 HydrophobicContact CB-CB 4.39Å; I89-E100 PolarHBondContact N-O 2.82Å; I89-E100 PolarHBondContact O-N 3.4Å; E100-K219 IonicContact OE1-NZ 3.35Å
101	C	89.8	Confident	89	Confident	30 Å²	30	53.4 Å²	53.4	20%	0.203	29%	0.291	C	S	.	.			trans	-83	129	-175.7	-56.7	0	0	0	0	112.4	C99 Y105 C110	C99-C101 PolarHBondContact O-N 3.33Å; C101-Y105 VanDerWaalsContact CB-O 3.22Å; C101-Y105 WeakPolarHBondContact CB-O 3.38Å; C101-C110 WeakPolarHBondContact CA-SG 3.3Å; C101-C110 HydrophobicContact CB-CB 3.73Å; C101-C110 WeakPolarHBondContact CB-SG 3.34Å; C101-C110 WeakPolarHBondContact SG-CA 2.99Å; C101-C110 WeakPolarHBondContact SG-CB 3.02Å; C101-C110 CovalentContact SG-SG 2.03Å; C101-C110 PolarHBondContact SG-SG 3.13Å
102	P	86.1	Confident	88.5	Confident	56 Å²	56	51.8 Å²	51.8	36%	0.364	28%	0.277	S	S	.	.			trans	-72	138.3	177.7	28.7	-34.9	0	0	0	111.5	N86 E104 Y105	N86-P102 WeakPolarHBondContact O-CG 3.4Å; P102-E104 PolarHBondContact O-N 2.81Å; P102-Y105 HydrophobicContact CG-CD2 4.38Å; P102-Y105 PolarHBondContact O-N 3.33Å
103	G	82.2	Confident	88.2	Confident	27 Å²	27	53.1 Å²	53.1	28%	0.278	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	45.8	-103.4	164.2	0	0	0	0	0	115.4	R181	G103-R181 PolarHBondContact O-NH2 3.18Å
104	E	84.1	Confident	88.1	Confident	59 Å²	59	49.3 Å²	49.3	28%	0.276	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	3.3	-173	63.1	178.1	-160	0	0	114.9	P102 K113 C114 S115	P102-E104 PolarHBondContact O-N 2.81Å; E104-K113 WeakPolarHBondContact OE1-CE 3.41Å; E104-K113 IonicContact OE1-NZ 2.69Å; E104-K113 PolarHBondContact OE1-NZ 3.41Å; E104-K113 IonicContact OE2-NZ 3.45Å; E104-C114 WeakPolarHBondContact O-CA 3.36Å; E104-C114 WeakPolarHBondContact O-CB 3.37Å; E104-C114 PolarHBondContact O-N 2.83Å; E104-S115 VanDerWaalsContact OE2-CB 3.32Å; E104-S115 WeakPolarHBondContact OE2-CB 3.45Å
105	Y	88.6	Confident	87.9	Confident	52 Å²	52	46.4 Å²	46.4	20%	0.204	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	152.2	-179.9	-66.2	-82.4	0	0	0	113.4	N86 C101 P102 Y112 K113 R181	N86-Y105 HydrophobicContact CB-CD1 3.62Å; N86-Y105 HydrophobicContact CB-CD2 3.89Å; N86-Y105 HydrophobicContact CB-CE1 3.56Å; N86-Y105 HydrophobicContact CB-CE2 3.85Å; N86-Y105 HydrophobicContact CB-CG 3.77Å; N86-Y105 WeakPolarHBondContact ND2-CD1 3.39Å; N86-Y105 WeakPolarHBondContact ND2-CE1 3.45Å; C101-Y105 VanDerWaalsContact CB-O 3.22Å; C101-Y105 WeakPolarHBondContact CB-O 3.38Å; P102-Y105 HydrophobicContact CG-CD2 4.38Å; P102-Y105 PolarHBondContact O-N 3.33Å; Y105-Y112 CarbonylContact C-O 3.52Å; Y105-Y112 WeakPolarHBondContact CA-O 3.32Å; Y105-K113 HydrophobicContact CD1-CB 4.42Å; Y105-K113 HydrophobicContact CE1-CB 4.21Å; Y105-K113 HydrophobicContact CE1-CG 4.46Å; Y105-R181 PolarHBondContact O-NH2 2.85Å
106	M	87.4	Confident	88	Confident	14 Å²	14	45.5 Å²	45.5	7%	0.069	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	178.3	178.7	75.2	178	-70.7	0	0	113.5	C110 Q111 Y112 C114 C270 L272 G274	M106-C110 CarbonylContact O-C 3.56Å; M106-C110 VanDerWaalsContact O-C 3.29Å; M106-C110 VanDerWaalsContact O-CA 3.3Å; M106-C110 WeakPolarHBondContact O-CA 3.23Å; M106-Q111 PolarHBondContact O-N 3.35Å; M106-Y112 PolarHBondContact N-O 2.79Å; M106-Y112 PolarHBondContact O-N 3.08Å; M106-C114 HydrophobicContact CG-CB 4.21Å; M106-C114 HydrophobicContact SD-CB 3.95Å; M106-C270 PolarHBondContact SD-SG 2.86Å; M106-L272 WeakPolarHBondContact CE-O 3.29Å; M106-G274 VanDerWaalsContact CE-N 3.28Å; M106-G274 WeakPolarHBondContact SD-CA 3.44Å
107	G	85.7	Confident	88.1	Confident	28 Å²	28	47.4 Å²	47.4	29%	0.289	26%	0.255	S	S	.	.	S	Bend	trans	98.2	169.5	-171.3	0	0	0	0	0	111.2	N109 C110	G107-N109 PolarHBondContact O-N 3.08Å; G107-C110 PolarHBondContact O-N 2.75Å
108	R	86.1	Confident	88.1	Confident	156 Å²	156	46.3 Å²	46.3	59%	0.589	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-34.9	-179.5	-171.6	-179.8	-174.9	167.7	-0.4	112.1	N96 C99	N96-R108 PolarHBondContact OD1-NH2 3.17Å; C99-R108 VanDerWaalsContact CB-O 3.3Å; C99-R108 WeakPolarHBondContact CB-O 3.41Å; C99-R108 PolarHBondContact SG-O 2.78Å
109	N	89.5	Confident	88.1	Confident	38 Å²	38	44.4 Å²	44.4	20%	0.203	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116	16.1	-173.9	-59.2	3.2	0	0	0	111.2	P83 K85 Y97 G107 Q111	P83-N109 WeakPolarHBondContact O-CB 3.03Å; K85-N109 WeakPolarHBondContact CB-O 3.33Å; K85-N109 PolarHBondContact N-O 2.84Å; Y97-N109 WeakPolarHBondContact CE2-OD1 3.35Å; Y97-N109 PolarHBondContact OH-ND2 3.2Å; Y97-N109 PolarHBondContact OH-OD1 2.79Å; G107-N109 PolarHBondContact O-N 3.08Å; N109-Q111 PolarHBondContact O-N 3.09Å; N109-Q111 VanDerWaalsContact O-N 3.17Å
110	C	90.3	Very high	88.2	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.232	C	C	.	.	S	Bend	trans	56.2	29.5	-175.9	-47.1	0	0	0	0	114	K85 N86 C99 C101 M106 G107	K85-C110 WeakPolarHBondContact O-CB 3.46Å; N86-C110 PolarHBondContact ND2-O 2.73Å; C99-C110 VanDerWaalsContact CB-SG 3.58Å; C101-C110 WeakPolarHBondContact CA-SG 3.3Å; C101-C110 HydrophobicContact CB-CB 3.73Å; C101-C110 WeakPolarHBondContact CB-SG 3.34Å; C101-C110 WeakPolarHBondContact SG-CA 2.99Å; C101-C110 WeakPolarHBondContact SG-CB 3.02Å; C101-C110 CovalentContact SG-SG 2.03Å; C101-C110 PolarHBondContact SG-SG 3.13Å; M106-C110 CarbonylContact O-C 3.56Å; M106-C110 VanDerWaalsContact O-C 3.29Å; M106-C110 VanDerWaalsContact O-CA 3.3Å; M106-C110 WeakPolarHBondContact O-CA 3.23Å; G107-C110 PolarHBondContact O-N 2.75Å
111	Q	85.7	Confident	88.3	Confident	55 Å²	55	42.5 Å²	42.5	26%	0.257	23%	0.228	S	C	.	.			trans	-80.9	-24.9	-174.4	69.9	-88.2	40.6	0	0	113.5	M106 N109	M106-Q111 PolarHBondContact O-N 3.35Å; N109-Q111 PolarHBondContact O-N 3.09Å; N109-Q111 VanDerWaalsContact O-N 3.17Å
112	Y	84.3	Confident	88.1	Confident	41 Å²	41	41.7 Å²	41.7	16%	0.161	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	123.8	-177	-54	-50.9	0	0	0	109.9	Y105 M106 G274 C432	Y105-Y112 CarbonylContact C-O 3.52Å; Y105-Y112 WeakPolarHBondContact CA-O 3.32Å; M106-Y112 PolarHBondContact N-O 2.79Å; M106-Y112 PolarHBondContact O-N 3.08Å; Y112-G274 WeakPolarHBondContact CB-O 3.22Å; Y112-C432 HydrophobicContact CD1-CB 4.18Å; Y112-C432 HydrophobicContact CE1-CB 3.53Å
113	K	85.3	Confident	88.3	Confident	85 Å²	85	39.7 Å²	39.7	37%	0.37	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	136.4	168.6	-173.5	165.7	174	128.3	0	108.3	E104 Y105 S115 E277	E104-K113 WeakPolarHBondContact OE1-CE 3.41Å; E104-K113 IonicContact OE1-NZ 2.69Å; E104-K113 PolarHBondContact OE1-NZ 3.41Å; E104-K113 IonicContact OE2-NZ 3.45Å; Y105-K113 HydrophobicContact CD1-CB 4.42Å; Y105-K113 HydrophobicContact CE1-CB 4.21Å; Y105-K113 HydrophobicContact CE1-CG 4.46Å; K113-S115 WeakPolarHBondContact CE-OG 3.39Å; K113-E277 WeakPolarHBondContact O-CG 3.15Å
114	C	88.5	Confident	88.7	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.212	C	C	.	.			trans	-127.4	55.9	-176.1	-177	0	0	0	0	109	E104 M106 T183 C270	E104-C114 WeakPolarHBondContact O-CA 3.36Å; E104-C114 WeakPolarHBondContact O-CB 3.37Å; E104-C114 PolarHBondContact O-N 2.83Å; M106-C114 HydrophobicContact CG-CB 4.21Å; M106-C114 HydrophobicContact SD-CB 3.95Å; C114-T183 HydrophobicContact CB-CG2 4.27Å; C114-T183 VanDerWaalsContact O-CB 3.32Å; C114-T183 WeakPolarHBondContact O-CB 3.42Å; C114-T183 WeakPolarHBondContact O-CG2 3.2Å; C114-T183 PolarHBondContact O-OG1 2.63Å; C114-C270 HydrophobicContact CB-CB 3.94Å; C114-C270 WeakPolarHBondContact CB-SG 3.38Å; C114-C270 WeakPolarHBondContact SG-CB 2.92Å; C114-C270 PolarHBondContact SG-N 2.84Å; C114-C270 CovalentContact SG-SG 2.02Å; C114-C270 PolarHBondContact SG-SG 2.9Å
115	S	87.9	Confident	89.2	Confident	28 Å²	28	38 Å²	38	20%	0.196	20%	0.2	C	C	.	.			trans	-128.2	16.8	-179.5	77.3	0	0	0	0	112	E104 K113	E104-S115 VanDerWaalsContact OE2-CB 3.32Å; E104-S115 WeakPolarHBondContact OE2-CB 3.45Å; K113-S115 WeakPolarHBondContact CE-OG 3.39Å
116	G	88.1	Confident	89.4	Confident	16 Å²	16	37 Å²	37	17%	0.165	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	155.8	-179.3	0	0	0	0	0	112.2	L118 L268 G269	G116-L118 PolarHBondContact O-N 2.69Å; G116-L268 CarbonylContact O-C 3.55Å; G116-L268 VanDerWaalsContact O-CA 3.31Å; G116-L268 WeakPolarHBondContact O-CA 3.42Å; G116-G269 PolarHBondContact N-O 3.42Å; G116-G269 PolarHBondContact O-N 3.07Å; G116-G269 VanDerWaalsContact O-O 3.05Å
117	P	91.8	Very high	89.7	Confident	90 Å²	90	40.1 Å²	40.1	58%	0.584	22%	0.218	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-66.8	132.6	173.9	28.7	-33.7	0	0	0	110.5	G119 E266	P117-G119 PolarHBondContact O-N 2.84Å; P117-E266 HydrophobicContact CB-CG 3.87Å
118	L	92.5	Very high	90.1	Very high	18 Å²	18	46.2 Å²	46.2	9%	0.094	24%	0.239	C	C	.	.			trans	-78.4	-10.6	175.7	-64.4	-172.8	0	0	0	112.7	G116 I125 L176 M180 V182 L267 G269	G116-L118 PolarHBondContact O-N 2.69Å; L118-I125 HydrophobicContact CB-CD1 4.22Å; L118-L176 HydrophobicContact CD1-CD1 4.1Å; L118-L176 HydrophobicContact CD1-CD2 4.01Å; L118-M180 HydrophobicContact CD2-CE 3.83Å; L118-V182 HydrophobicContact CD1-CG2 4.12Å; L118-L267 HydrophobicContact CB-CB 4.2Å; L118-L267 HydrophobicContact CD1-CB 3.92Å; L118-L267 HydrophobicContact CG-CB 4.28Å; L118-L267 PolarHBondContact N-O 3.36Å; L118-G269 VanDerWaalsContact CD2-C 3.48Å
119	G	92.3	Very high	90.6	Very high	4 Å²	4	39.5 Å²	39.5	4%	0.041	22%	0.215	C	C	.	.	S	Bend	trans	104	36.6	162.9	0	0	0	0	0	114.1	P117 G123 I124 I125 E266	P117-G119 PolarHBondContact O-N 2.84Å; G119-G123 PolarHBondContact O-N 3.39Å; G119-G123 VanDerWaalsContact O-N 3.15Å; G119-I124 PolarHBondContact O-N 3.03Å; G119-I124 VanDerWaalsContact O-N 3.09Å; G119-I125 PolarHBondContact O-N 3.26Å; G119-E266 PolarHBondContact N-OE1 2.78Å; G119-E266 VanDerWaalsContact N-OE1 3.08Å
120	M	94.4	Very high	91	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-47.9	165.4	-63.5	-71.9	-77.9	0	0	110.8	I125 I130 R151 I174 M265 E266	M120-I125 HydrophobicContact CG-CD1 3.8Å; M120-I125 HydrophobicContact SD-CB 3.99Å; M120-I125 HydrophobicContact SD-CD1 3.54Å; M120-I125 VanDerWaalsContact SD-CD1 3.54Å; M120-I125 HydrophobicContact SD-CG1 4.36Å; M120-I125 HydrophobicContact SD-CG2 3.76Å; M120-I130 HydrophobicContact CE-CD1 3.67Å; M120-I130 HydrophobicContact CE-CG1 4.1Å; M120-I130 HydrophobicContact CE-CG2 4.39Å; M120-I130 HydrophobicContact SD-CD1 3.97Å; M120-I130 HydrophobicContact SD-CG1 4.27Å; M120-R151 WeakPolarHBondContact O-CB 3.41Å; M120-R151 WeakPolarHBondContact O-CD 3.37Å; M120-R151 WeakPolarHBondContact O-CG 3.26Å; M120-R151 PolarHBondContact O-NH1 3.26Å; M120-I174 HydrophobicContact CE-CD1 4.38Å; M120-I174 HydrophobicContact CE-CG1 3.75Å; M120-I174 HydrophobicContact SD-CG1 3.94Å; M120-I174 HydrophobicContact SD-CG2 4.15Å; M120-M265 WeakPolarHBondContact CB-O 3.11Å; M120-M265 HydrophobicContact CE-CG 3.99Å; M120-M265 HydrophobicContact CE-SD 4.26Å; M120-E266 WeakPolarHBondContact CB-OE1 3.41Å; M120-E266 WeakPolarHBondContact CG-OE1 3.43Å; M120-E266 PolarHBondContact N-OE1 3.44Å; M120-E266 PolarHBondContact N-OE2 2.82Å; M120-E266 VanDerWaalsContact N-OE2 3.08Å
121	E	93.1	Very high	91.3	Very high	95 Å²	95	40.7 Å²	40.7	44%	0.444	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-47.8	177.7	-179.1	171.3	-161.1	0	0	111.3	G123 L152 N153 E266	E121-G123 VanDerWaalsContact C-N 3.31Å; E121-G123 PolarHBondContact O-N 2.87Å; E121-L152 HydrophobicContact CB-CB 4.25Å; E121-N153 WeakPolarHBondContact OE1-CB 3.38Å; E121-N153 PolarHBondContact OE1-ND2 2.98Å; E121-E266 WeakPolarHBondContact CB-OE2 3.08Å; E121-E266 PolarHBondContact N-OE2 2.8Å
122	G	86.3	Confident	91.9	Very high	14 Å²	14	39.2 Å²	39.2	14%	0.144	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-14.1	-175.6	0	0	0	0	0	115.7	H398	G122-H398 VanDerWaalsContact CA-CE1 3.5Å; G122-H398 WeakPolarHBondContact CA-CE1 3.3Å; G122-H398 WeakPolarHBondContact CA-ND1 3.33Å; G122-H398 VanDerWaalsContact O-CB 3.27Å; G122-H398 WeakPolarHBondContact O-CB 3.34Å; G122-H398 VanDerWaalsContact O-CG 3.23Å; G122-H398 PolarHBondContact O-N 3.42Å; G122-H398 PolarHBondContact O-ND1 2.67Å
123	G	90.2	Very high	92.5	Very high	14 Å²	14	39.2 Å²	39.2	14%	0.144	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	84	6.6	178.8	0	0	0	0	0	115.4	G119 E121 I125	G119-G123 PolarHBondContact O-N 3.39Å; G119-G123 VanDerWaalsContact O-N 3.15Å; E121-G123 VanDerWaalsContact C-N 3.31Å; E121-G123 PolarHBondContact O-N 2.87Å; G123-I125 PolarHBondContact O-N 3.26Å
124	I	91.4	Very high	92.9	Very high	44 Å²	44	36.2 Å²	36.2	23%	0.226	22%	0.216	C	C	.	.			trans	-57.3	-43.2	169.9	-59.4	175.5	0	0	0	109.8	G119 S126 I348 H398 K400	G119-I124 PolarHBondContact O-N 3.03Å; G119-I124 VanDerWaalsContact O-N 3.09Å; I124-S126 PolarHBondContact O-N 3.29Å; I124-I348 HydrophobicContact CD1-CD1 4Å; I124-H398 HydrophobicContact CD1-CB 4.29Å; I124-H398 HydrophobicContact CG1-CB 3.56Å; I124-K400 HydrophobicContact CD1-CB 4.17Å; I124-K400 HydrophobicContact CG1-CB 4.29Å; I124-K400 HydrophobicContact CG2-CB 3.7Å; I124-K400 HydrophobicContact CG2-CD 4.31Å
125	I	94.1	Very high	93.2	Very high	5 Å²	5	38 Å²	38	3%	0.026	23%	0.227	C	C	.	.	S	Bend	trans	-77.8	114.4	169.4	-63.9	171.6	0	0	0	107.7	L118 G119 M120 G123 Q129 I130 R151 I174 L176	L118-I125 HydrophobicContact CB-CD1 4.22Å; G119-I125 PolarHBondContact O-N 3.26Å; M120-I125 HydrophobicContact CG-CD1 3.8Å; M120-I125 HydrophobicContact SD-CB 3.99Å; M120-I125 HydrophobicContact SD-CD1 3.54Å; M120-I125 VanDerWaalsContact SD-CD1 3.54Å; M120-I125 HydrophobicContact SD-CG1 4.36Å; M120-I125 HydrophobicContact SD-CG2 3.76Å; G123-I125 PolarHBondContact O-N 3.26Å; I125-Q129 HydrophobicContact CG2-CB 3.7Å; I125-I130 HydrophobicContact CG2-CD1 4.25Å; I125-I130 HydrophobicContact CG2-CG1 3.91Å; I125-R151 VanDerWaalsContact O-CZ 3.28Å; I125-R151 PolarHBondContact O-NH1 3.11Å; I125-R151 PolarHBondContact O-NH2 2.82Å; I125-I174 HydrophobicContact CD1-CG2 4.07Å; I125-I174 HydrophobicContact CG2-CG2 4.17Å; I125-L176 HydrophobicContact CD1-CD2 3.95Å
126	S	92.4	Very high	93.3	Very high	33 Å²	33	37.4 Å²	37.4	23%	0.231	22%	0.221	C	C	.	.			trans	-71.7	164	-176.3	88.5	0	0	0	0	112.5	I124 Q128 Q129	I124-S126 PolarHBondContact O-N 3.29Å; S126-Q128 PolarHBondContact O-N 2.98Å; S126-Q128 PolarHBondContact OG-N 2.03Å; S126-Q128 PolarHBondContact OG-OE1 3.32Å; S126-Q129 WeakPolarHBondContact O-CB 3.09Å; S126-Q129 PolarHBondContact O-N 3.46Å; S126-Q129 VanDerWaalsContact O-N 3.13Å; S126-Q129 PolarHBondContact OG-OE1 2.81Å
127	N	93.8	Very high	93.2	Very high	79 Å²	79	44 Å²	44	42%	0.422	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-61.2	-31.3	177.3	-66.3	-14	0	0	0	112.5	Q129 I130 Y148 R151	N127-Q129 VanDerWaalsContact C-N 3.27Å; N127-Q129 PolarHBondContact O-N 3Å; N127-I130 PolarHBondContact O-N 3.24Å; N127-Y148 HydrophobicContact CB-CG 4.25Å; N127-R151 PolarHBondContact OD1-NH2 2.83Å
128	Q	94.1	Very high	92.5	Very high	156 Å²	156	40.4 Å²	40.4	73%	0.729	22%	0.219	S	C	*	.	G	3₁₀ helix	trans	-72.6	-20.7	179.3	-59.1	82.5	10.3	0	0	112.8	S126 I130	S126-Q128 PolarHBondContact O-N 2.98Å; S126-Q128 PolarHBondContact OG-N 2.03Å; S126-Q128 PolarHBondContact OG-OE1 3.32Å; Q128-I130 VanDerWaalsContact C-N 3.29Å
129	Q	96.6	Very high	91.9	Very high	15 Å²	15	43.9 Å²	43.9	7%	0.07	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-80	-11.1	178.5	-70.7	172.9	-99.9	0	0	113.1	I125 S126 N127 N175 Q177	I125-Q129 HydrophobicContact CG2-CB 3.7Å; S126-Q129 WeakPolarHBondContact O-CB 3.09Å; S126-Q129 PolarHBondContact O-N 3.46Å; S126-Q129 VanDerWaalsContact O-N 3.13Å; S126-Q129 PolarHBondContact OG-OE1 2.81Å; N127-Q129 VanDerWaalsContact C-N 3.27Å; N127-Q129 PolarHBondContact O-N 3Å; Q129-N175 WeakPolarHBondContact CB-O 3.32Å; Q129-N175 WeakPolarHBondContact CG-O 3.19Å; Q129-N175 PolarHBondContact NE2-O 2.75Å; Q129-N175 PolarHBondContact O-N 3.2Å; Q129-Q177 HydrophobicContact CG-CG 4.26Å
130	I	97.6	Very high	91.1	Very high	6 Å²	6	54.1 Å²	54.1	3%	0.031	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	114.3	-175.8	-46	170	0	0	0	109.1	M120 I125 N127 Q128 P147 I172 Q173	M120-I130 HydrophobicContact CE-CD1 3.67Å; M120-I130 HydrophobicContact CE-CG1 4.1Å; M120-I130 HydrophobicContact CE-CG2 4.39Å; M120-I130 HydrophobicContact SD-CD1 3.97Å; M120-I130 HydrophobicContact SD-CG1 4.27Å; I125-I130 HydrophobicContact CG2-CD1 4.25Å; I125-I130 HydrophobicContact CG2-CG1 3.91Å; N127-I130 PolarHBondContact O-N 3.24Å; Q128-I130 VanDerWaalsContact C-N 3.29Å; I130-P147 HydrophobicContact CG2-CB 3.95Å; I130-I172 HydrophobicContact CG2-CD1 3.91Å; I130-I172 HydrophobicContact CG2-CG1 4.06Å; I130-Q173 WeakPolarHBondContact CA-O 3.11Å
131	T	97.3	Very high	90.2	Very high	56 Å²	56	55.2 Å²	55.2	34%	0.344	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	161.1	179.3	59.9	0	0	0	0	110.6	I172 Q173	T131-I172 CarbonylContact O-C 3.52Å; T131-I172 WeakPolarHBondContact O-CA 3.31Å; T131-I172 WeakPolarHBondContact O-CG1 3.42Å; T131-Q173 PolarHBondContact N-O 2.94Å; T131-Q173 PolarHBondContact O-N 2.77Å
132	A	97.5	Very high	89.4	Confident	24 Å²	24	57.9 Å²	57.9	20%	0.198	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	162.5	177.6	0	0	0	0	0	110.9	S134 P147 W161 W171 I172	A132-S134 VanDerWaalsContact C-N 3.32Å; A132-P147 HydrophobicContact CB-CB 3.87Å; A132-P147 HydrophobicContact CB-CG 4.16Å; A132-W161 HydrophobicContact CB-CZ2 3.81Å; A132-W171 CarbonylContact C-O 3.55Å; A132-W171 WeakPolarHBondContact CA-O 3.3Å; A132-W171 VanDerWaalsContact CB-O 3.32Å; A132-W171 WeakPolarHBondContact CB-O 3.22Å; A132-I172 HydrophobicContact CB-CB 4.45Å; A132-I172 HydrophobicContact CB-CG1 4.43Å
133	S	96.7	Very high	89.3	Confident	42 Å²	42	58.7 Å²	58.7	29%	0.294	31%	0.309	S	S	.	.	S	Bend	trans	-60.8	-41.7	173.7	57	0	0	0	0	112.4	D167 P170 W171	S133-D167 VanDerWaalsContact CB-OD2 3.31Å; S133-D167 WeakPolarHBondContact CB-OD2 3.03Å; S133-D167 PolarHBondContact OG-OD2 2.85Å; S133-P170 WeakPolarHBondContact OG-CA 3.03Å; S133-W171 PolarHBondContact N-O 3.26Å; S133-W171 PolarHBondContact OG-N 3Å; S133-W171 PolarHBondContact OG-O 3.19Å
134	S	95.5	Very high	89.3	Confident	22 Å²	22	61.9 Å²	61.9	15%	0.154	32%	0.319	C	S	.	.			trans	-154.3	171	-173.6	68.2	0	0	0	0	111.3	A132 W161 A164 D167	A132-S134 VanDerWaalsContact C-N 3.32Å; S134-W161 PolarHBondContact O-NE1 2.7Å; S134-A164 PolarHBondContact OG-N 2.87Å; S134-D167 VanDerWaalsContact CB-OD2 3.25Å; S134-D167 WeakPolarHBondContact CB-OD2 3.31Å; S134-D167 WeakPolarHBondContact OG-CB 3.19Å; S134-D167 PolarHBondContact OG-OD2 2.82Å
135	T	93.3	Very high	89.4	Confident	36 Å²	36	59.8 Å²	59.8	22%	0.221	31%	0.308	C	S	.	.			trans	-145.2	132	179.9	-68	0	0	0	0	109.9	Y146	T135-Y146 HydrophobicContact CG2-CD1 3.84Å; T135-Y146 HydrophobicContact CG2-CE1 4.31Å; T135-Y146 HydrophobicContact CG2-CG 4.28Å
136	H	89.9	Confident	89.4	Confident	17 Å²	17	62.7 Å²	62.7	8%	0.079	32%	0.319	C	S	.	.			trans	-74.8	140.1	174.1	-166.4	-82.2	0	0	0	112.1	W145 T162 E165 R192	H136-W145 HydrophobicContact CB-CB 4.4Å; H136-W145 PolarHBondContact O-N 2.93Å; H136-W145 VanDerWaalsContact O-N 3.1Å; H136-T162 HydrophobicContact CB-CG2 3.84Å; H136-T162 WeakPolarHBondContact CB-O 3.39Å; H136-T162 PolarHBondContact N-O 2.81Å; H136-E165 IonicContact CD2-OE1 3.62Å; H136-E165 IonicContact CE1-OE1 3.83Å; H136-E165 IonicContact NE2-OE1 2.77Å; H136-E165 PolarHBondContact NE2-OE1 2.97Å; H136-R192 PolarHBondContact CE1-NH1 2.96Å; H136-R192 PolarHBondContact ND1-NH1 3.37Å
137	R	86.3	Confident	89.6	Confident	153 Å²	153	61.8 Å²	61.8	58%	0.577	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.2	121.5	172.1	-61.3	-176.1	-176.5	-150	3.5	108.6	Q143	R137-Q143 CarbonylContact C-O 3.58Å; R137-Q143 WeakPolarHBondContact CA-O 3.19Å
138	A	78.1	Confident	89.6	Confident	16 Å²	16	61.6 Å²	61.6	13%	0.132	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	166.3	177.1	0	0	0	0	0	111.5	G141 L142 Q143	A138-G141 PolarHBondContact O-N 2.95Å; A138-G141 VanDerWaalsContact O-N 3.1Å; A138-L142 PolarHBondContact O-N 3.38Å; A138-Q143 HydrophobicContact CB-CB 3.99Å; A138-Q143 PolarHBondContact N-O 2.64Å; A138-Q143 PolarHBondContact O-N 3.2Å; A138-Q143 VanDerWaalsContact O-N 3.09Å
139	L	78.3	Confident	89.7	Confident	91 Å²	91	56.3 Å²	56.3	48%	0.476	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	48.3	63.6	178.2	-69	172.6	0	0	0	112.9	G141 L142 Q143	L139-G141 PolarHBondContact O-N 3.01Å; L139-L142 HydrophobicContact CB-CB 4.4Å; L139-L142 VanDerWaalsContact O-CB 3.31Å; L139-L142 WeakPolarHBondContact O-CB 3.15Å; L139-L142 WeakPolarHBondContact O-CG 3.45Å; L139-L142 PolarHBondContact O-N 2.03Å; L139-Q143 HydrophobicContact CD1-CG 4.1Å
140	F	76.5	Confident	89.7	Confident	219 Å²	219	55.6 Å²	55.6	96%	0.961	28%	0.278	S	S	*	.	G	3₁₀ helix	trans	54.3	26	-179.4	-52.9	-76.3	0	0	0	114.4
141	G	75.3	Confident	89.7	Confident	23 Å²	23	56.2 Å²	56.2	24%	0.237	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	90.1	4.3	179.2	0	0	0	0	0	115.3	A138 L139 K144	A138-G141 PolarHBondContact O-N 2.95Å; A138-G141 VanDerWaalsContact O-N 3.1Å; L139-G141 PolarHBondContact O-N 3.01Å; G141-K144 VanDerWaalsContact O-CE 3.22Å; G141-K144 WeakPolarHBondContact O-CE 3.28Å; G141-K144 WeakPolarHBondContact O-CG 3.21Å
142	L	76.8	Confident	89.6	Confident	151 Å²	151	54.1 Å²	54.1	79%	0.791	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-30.9	175.9	-64	172.7	0	0	0	112.4	A138 L139	A138-L142 PolarHBondContact O-N 3.38Å; L139-L142 HydrophobicContact CB-CB 4.4Å; L139-L142 VanDerWaalsContact O-CB 3.31Å; L139-L142 WeakPolarHBondContact O-CB 3.15Å; L139-L142 WeakPolarHBondContact O-CG 3.45Å; L139-L142 PolarHBondContact O-N 2.03Å
143	Q	83.9	Confident	89.5	Confident	30 Å²	30	56.3 Å²	56.3	14%	0.14	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	112.8	175.2	-73.2	-177.3	-5.2	0	0	110.5	R137 A138 L139 V158	R137-Q143 CarbonylContact C-O 3.58Å; R137-Q143 WeakPolarHBondContact CA-O 3.19Å; A138-Q143 HydrophobicContact CB-CB 3.99Å; A138-Q143 PolarHBondContact N-O 2.64Å; A138-Q143 PolarHBondContact O-N 3.2Å; A138-Q143 VanDerWaalsContact O-N 3.09Å; L139-Q143 HydrophobicContact CD1-CG 4.1Å; Q143-V158 HydrophobicContact CB-CG2 3.98Å; Q143-V158 HydrophobicContact CG-CG2 3.91Å
144	K	90.3	Very high	89.3	Confident	82 Å²	82	58.7 Å²	58.7	36%	0.357	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	109.1	-177.7	-57.4	-179.7	-176.4	173.4	0	110.8	G141 Y146 F149 V158	G141-K144 VanDerWaalsContact O-CE 3.22Å; G141-K144 WeakPolarHBondContact O-CE 3.28Å; G141-K144 WeakPolarHBondContact O-CG 3.21Å; K144-Y146 VanDerWaalsContact C-N 3.26Å; K144-Y146 HydrophobicContact CB-CD2 3.62Å; K144-Y146 HydrophobicContact CB-CE2 3.38Å; K144-Y146 HydrophobicContact CD-CE2 3.47Å; K144-Y146 VanDerWaalsContact CD-CE2 3.47Å; K144-Y146 WeakPolarHBondContact CD-OH 3.38Å; K144-Y146 HydrophobicContact CG-CE2 4.05Å; K144-Y146 PolarHBondContact O-N 3.19Å; K144-F149 WeakPolarHBondContact O-CE2 3.49Å; K144-V158 WeakPolarHBondContact O-CG1 3.38Å
145	W	93	Very high	89.1	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	31%	0.31	C	S	.	.			trans	-88.1	57.4	-174.3	-66.4	78.6	0	0	0	111.9	H136 V158 A160 W161 T162 A190 R192 T262	H136-W145 HydrophobicContact CB-CB 4.4Å; H136-W145 PolarHBondContact O-N 2.93Å; H136-W145 VanDerWaalsContact O-N 3.1Å; W145-V158 HydrophobicContact CD2-CG1 3.94Å; W145-V158 HydrophobicContact CE3-CG1 4.23Å; W145-V158 HydrophobicContact CG-CG1 4.16Å; W145-V158 HydrophobicContact CZ2-CG2 4.5Å; W145-A160 HydrophobicContact CE3-CB 3.99Å; W145-A160 VanDerWaalsContact CE3-O 3.24Å; W145-A160 HydrophobicContact CZ3-CB 3.82Å; W145-W161 WeakPolarHBondContact O-CA 3.36Å; W145-W161 VanDerWaalsContact O-CD1 3.31Å; W145-T162 PolarHBondContact O-N 2.98Å; W145-A190 HydrophobicContact CZ3-CB 4.1Å; W145-R192 HydrophobicContact CZ2-CB 4.39Å; W145-R192 HydrophobicContact CZ2-CG 4.13Å; W145-T262 HydrophobicContact CE3-CG2 4.38Å; W145-T262 HydrophobicContact CZ3-CG2 4.23Å
146	Y	95.1	Very high	88.9	Confident	65 Å²	65	67.3 Å²	67.3	26%	0.255	33%	0.327	S	S	.	.			trans	-62.9	154.8	-174.6	-74.7	-67.7	0	0	0	114.2	T135 K144 Y148 F149	T135-Y146 HydrophobicContact CG2-CD1 3.84Å; T135-Y146 HydrophobicContact CG2-CE1 4.31Å; T135-Y146 HydrophobicContact CG2-CG 4.28Å; K144-Y146 VanDerWaalsContact C-N 3.26Å; K144-Y146 HydrophobicContact CB-CD2 3.62Å; K144-Y146 HydrophobicContact CB-CE2 3.38Å; K144-Y146 HydrophobicContact CD-CE2 3.47Å; K144-Y146 VanDerWaalsContact CD-CE2 3.47Å; K144-Y146 WeakPolarHBondContact CD-OH 3.38Å; K144-Y146 HydrophobicContact CG-CE2 4.05Å; K144-Y146 PolarHBondContact O-N 3.19Å; Y146-Y148 VanDerWaalsContact C-N 3.25Å; Y146-Y148 HydrophobicContact CD1-CE1 4.32Å; Y146-Y148 AromaticContact CD2-CE1 3.61Å; Y146-Y148 HydrophobicContact CD2-CE1 3.61Å; Y146-Y148 AromaticContact CD2-CZ 3.7Å; Y146-Y148 WeakPolarHBondContact CD2-OH 3.35Å; Y146-Y148 HydrophobicContact CG-CD1 4.24Å; Y146-Y148 AromaticContact CG-CE1 3.47Å; Y146-Y148 HydrophobicContact CG-CE1 3.47Å; Y146-Y148 VanDerWaalsContact CG-CE1 3.47Å; Y146-Y148 AromaticContact CG-CZ 3.97Å; Y146-Y148 PolarHBondContact O-N 2.85Å; Y146-F149 HydrophobicContact CD2-CE2 4.47Å; Y146-F149 WeakPolarHBondContact O-CB 3.48Å; Y146-F149 PolarHBondContact O-N 3.08Å
147	P	96.4	Very high	88.8	Confident	15 Å²	15	73.9 Å²	73.9	10%	0.097	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-54.2	-36.7	179.9	17.4	-31	0	0	0	114.1	I130 A132 F149 A150 I172	I130-P147 HydrophobicContact CG2-CB 3.95Å; A132-P147 HydrophobicContact CB-CB 3.87Å; A132-P147 HydrophobicContact CB-CG 4.16Å; P147-F149 PolarHBondContact O-N 3.35Å; P147-F149 VanDerWaalsContact O-N 3.07Å; P147-A150 WeakPolarHBondContact O-CB 3.09Å; P147-A150 PolarHBondContact O-N 2.96Å; P147-I172 HydrophobicContact CB-CD1 4.26Å; P147-I172 HydrophobicContact CB-CG1 4.47Å
148	Y	94.1	Very high	89	Confident	75 Å²	75	67.9 Å²	67.9	29%	0.294	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-67.1	-10.8	-178.3	63.8	-102.9	0	0	0	114.4	N127 Y146 A150 R151	N127-Y148 HydrophobicContact CB-CG 4.25Å; Y146-Y148 VanDerWaalsContact C-N 3.25Å; Y146-Y148 HydrophobicContact CD1-CE1 4.32Å; Y146-Y148 AromaticContact CD2-CE1 3.61Å; Y146-Y148 HydrophobicContact CD2-CE1 3.61Å; Y146-Y148 AromaticContact CD2-CZ 3.7Å; Y146-Y148 WeakPolarHBondContact CD2-OH 3.35Å; Y146-Y148 HydrophobicContact CG-CD1 4.24Å; Y146-Y148 AromaticContact CG-CE1 3.47Å; Y146-Y148 HydrophobicContact CG-CE1 3.47Å; Y146-Y148 VanDerWaalsContact CG-CE1 3.47Å; Y146-Y148 AromaticContact CG-CZ 3.97Å; Y146-Y148 PolarHBondContact O-N 2.85Å; Y148-A150 VanDerWaalsContact C-N 3.35Å; Y148-R151 PolarHBondContact O-NE 2.73Å; Y148-R151 VanDerWaalsContact O-NE 3.08Å
149	F	95.4	Very high	89.8	Confident	44 Å²	44	68 Å²	68	19%	0.193	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-84.5	-5.9	170.6	-69.4	-64.3	0	0	0	113.4	K144 Y146 P147 R151 V158 N159 A160	K144-F149 WeakPolarHBondContact O-CE2 3.49Å; Y146-F149 HydrophobicContact CD2-CE2 4.47Å; Y146-F149 WeakPolarHBondContact O-CB 3.48Å; Y146-F149 PolarHBondContact O-N 3.08Å; P147-F149 PolarHBondContact O-N 3.35Å; P147-F149 VanDerWaalsContact O-N 3.07Å; F149-R151 PolarHBondContact O-N 3.38Å; F149-V158 HydrophobicContact CD2-CG1 4.08Å; F149-V158 HydrophobicContact CE2-CG1 4.09Å; F149-N159 CarbonylContact O-C 3.56Å; F149-A160 WeakPolarHBondContact CB-O 3.39Å; F149-A160 WeakPolarHBondContact O-CA 3.32Å
150	A	97.1	Very high	90.6	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	32%	0.318	C	S	.	.			trans	-71.6	42.2	179.2	0	0	0	0	0	113.6	P147 Y148 W161 I172 L263 M265	P147-A150 WeakPolarHBondContact O-CB 3.09Å; P147-A150 PolarHBondContact O-N 2.96Å; Y148-A150 VanDerWaalsContact C-N 3.35Å; A150-W161 HydrophobicContact CB-CB 3.72Å; A150-I172 HydrophobicContact CB-CD1 3.38Å; A150-L263 WeakPolarHBondContact CA-O 3.22Å; A150-M265 HydrophobicContact CB-CG 4.46Å; A150-M265 VanDerWaalsContact O-CG 3.28Å; A150-M265 WeakPolarHBondContact O-CG 3.17Å; A150-M265 PolarHBondContact O-N 3.46Å
151	R	97	Very high	91.6	Very high	20 Å²	20	53.2 Å²	53.2	8%	0.075	27%	0.272	C	S	.	.	B	Isolated β-bridge	trans	-102.5	134.2	-177.6	-58.6	179.4	-178.9	-89	4	108.9	M120 I125 N127 Y148 F149 K154 R264	M120-R151 WeakPolarHBondContact O-CB 3.41Å; M120-R151 WeakPolarHBondContact O-CD 3.37Å; M120-R151 WeakPolarHBondContact O-CG 3.26Å; M120-R151 PolarHBondContact O-NH1 3.26Å; I125-R151 VanDerWaalsContact O-CZ 3.28Å; I125-R151 PolarHBondContact O-NH1 3.11Å; I125-R151 PolarHBondContact O-NH2 2.82Å; N127-R151 PolarHBondContact OD1-NH2 2.83Å; Y148-R151 PolarHBondContact O-NE 2.73Å; Y148-R151 VanDerWaalsContact O-NE 3.08Å; F149-R151 PolarHBondContact O-N 3.38Å; R151-K154 HydrophobicContact CB-CB 4.38Å; R151-K154 VanDerWaalsContact O-CB 3.27Å; R151-K154 WeakPolarHBondContact O-CB 3.34Å; R151-K154 PolarHBondContact O-N 3.18Å; R151-R264 WeakPolarHBondContact O-CB 3.36Å; R151-R264 WeakPolarHBondContact O-CG 3.4Å
152	L	95.9	Very high	92.6	Very high	12 Å²	12	52.1 Å²	52.1	6%	0.063	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	143.8	178.4	-166.8	68.7	0	0	0	111	E121 K154 I186 Q188 P236 M265 E266	E121-L152 HydrophobicContact CB-CB 4.25Å; L152-K154 PolarHBondContact O-N 3.01Å; L152-I186 HydrophobicContact CD1-CG2 3.76Å; L152-I186 HydrophobicContact CD2-CB 4.42Å; L152-I186 HydrophobicContact CD2-CD1 4.4Å; L152-I186 HydrophobicContact CD2-CG2 3.99Å; L152-Q188 HydrophobicContact CD1-CB 3.82Å; L152-P236 HydrophobicContact CD1-CB 4.35Å; L152-M265 PolarHBondContact N-O 2.87Å; L152-E266 HydrophobicContact CB-CB 3.94Å; L152-E266 HydrophobicContact CD2-CB 3.92Å; L152-E266 HydrophobicContact CG-CB 4.49Å
153	N	94.6	Very high	93.5	Very high	69 Å²	69	45.2 Å²	45.2	37%	0.369	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	56	10	178.1	-58.4	-41.7	0	0	0	116.6	E121 K155 Q188	E121-N153 WeakPolarHBondContact OE1-CB 3.38Å; E121-N153 PolarHBondContact OE1-ND2 2.98Å; N153-K155 PolarHBondContact O-N 2.85Å; N153-Q188 PolarHBondContact OD1-NE2 3.44Å
154	K	93.3	Very high	94	Very high	92 Å²	92	44.6 Å²	44.6	40%	0.4	23%	0.226	S	C	.	.			trans	-56.9	133.3	176.4	-171.1	67.3	177	167	0	109.9	R151 L152 N159 R264	R151-K154 HydrophobicContact CB-CB 4.38Å; R151-K154 VanDerWaalsContact O-CB 3.27Å; R151-K154 WeakPolarHBondContact O-CB 3.34Å; R151-K154 PolarHBondContact O-N 3.18Å; L152-K154 PolarHBondContact O-N 3.01Å; K154-N159 HydrophobicContact CB-CB 4.41Å; K154-N159 WeakPolarHBondContact CB-O 3.05Å; K154-N159 HydrophobicContact CG-CB 4.2Å; K154-N159 WeakPolarHBondContact O-CB 3.41Å; K154-N159 PolarHBondContact O-ND2 3.15Å; K154-R264 PolarHBondContact O-NH1 2.79Å
155	K	91.3	Very high	94	Very high	184 Å²	184	47.3 Å²	47.3	80%	0.8	24%	0.24	S	C	*	.			trans	-109	158.8	179.6	-60	-176.9	-178.5	177	0	110.6	N153	N153-K155 PolarHBondContact O-N 2.85Å
156	G	89.3	Confident	93.9	Very high	56 Å²	56	54 Å²	54	58%	0.577	28%	0.275	S	S	*	.	S	Bend	trans	130.2	174.2	179.4	0	0	0	0	0	112.1	V158	G156-V158 VanDerWaalsContact C-N 3.29Å
157	L	87	Confident	93.8	Very high	154 Å²	154	52.9 Å²	52.9	81%	0.806	27%	0.274	S	S	*	.	S	Bend	trans	-65.8	-33.5	175.2	-68.5	172.5	0	0	0	112.3
158	V	90.9	Very high	93.5	Very high	28 Å²	28	62.6 Å²	62.6	17%	0.17	31%	0.309	C	S	.	.	S	Bend	trans	-122.7	115.8	170.7	-179.9	0	0	0	0	107	Q143 K144 W145 F149 G156	Q143-V158 HydrophobicContact CB-CG2 3.98Å; Q143-V158 HydrophobicContact CG-CG2 3.91Å; K144-V158 WeakPolarHBondContact O-CG1 3.38Å; W145-V158 HydrophobicContact CD2-CG1 3.94Å; W145-V158 HydrophobicContact CE3-CG1 4.23Å; W145-V158 HydrophobicContact CG-CG1 4.16Å; W145-V158 HydrophobicContact CZ2-CG2 4.5Å; F149-V158 HydrophobicContact CD2-CG1 4.08Å; F149-V158 HydrophobicContact CE2-CG1 4.09Å; G156-V158 VanDerWaalsContact C-N 3.29Å
159	N	93.9	Very high	93.5	Very high	17 Å²	17	68.1 Å²	68.1	9%	0.091	33%	0.329	C	S	.	.			trans	-145.2	12.1	-166.6	72.2	-34.3	0	0	0	114	F149 K154 R264	F149-N159 CarbonylContact O-C 3.56Å; K154-N159 HydrophobicContact CB-CB 4.41Å; K154-N159 WeakPolarHBondContact CB-O 3.05Å; K154-N159 HydrophobicContact CG-CB 4.2Å; K154-N159 WeakPolarHBondContact O-CB 3.41Å; K154-N159 PolarHBondContact O-ND2 3.15Å; N159-R264 VanDerWaalsContact O-CD 3.24Å; N159-R264 WeakPolarHBondContact O-CD 3.25Å; N159-R264 VanDerWaalsContact O-CG 3.28Å; N159-R264 WeakPolarHBondContact O-CG 3.43Å
160	A	96.4	Very high	93.6	Very high	0 Å²	0	66.4 Å²	66.4	0%	0	32%	0.322	C	S	.	.	S	Bend	trans	-145.2	171.4	177	0	0	0	0	0	110.1	W145 F149 A190 T262 R264	W145-A160 HydrophobicContact CE3-CB 3.99Å; W145-A160 VanDerWaalsContact CE3-O 3.24Å; W145-A160 HydrophobicContact CZ3-CB 3.82Å; F149-A160 WeakPolarHBondContact CB-O 3.39Å; F149-A160 WeakPolarHBondContact O-CA 3.32Å; A160-A190 HydrophobicContact CB-CB 3.72Å; A160-T262 HydrophobicContact CB-CG2 3.63Å; A160-R264 HydrophobicContact CB-CG 3.69Å
161	W	97.1	Very high	93.6	Very high	0 Å²	0	69.3 Å²	69.3	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	141.8	161.7	167.7	64.5	0	0	0	109.8	A132 S134 W145 A150 A163 P170 W171 I172 P254 T262 L263	A132-W161 HydrophobicContact CB-CZ2 3.81Å; S134-W161 PolarHBondContact O-NE1 2.7Å; W145-W161 WeakPolarHBondContact O-CA 3.36Å; W145-W161 VanDerWaalsContact O-CD1 3.31Å; A150-W161 HydrophobicContact CB-CB 3.72Å; W161-A163 HydrophobicContact CH2-CB 4.37Å; W161-A163 HydrophobicContact CZ2-CB 3.97Å; W161-P170 HydrophobicContact CH2-CB 4.31Å; W161-W171 WeakPolarHBondContact CZ2-O 3Å; W161-I172 HydrophobicContact CB-CD1 4.22Å; W161-I172 HydrophobicContact CD2-CB 4.22Å; W161-I172 HydrophobicContact CD2-CD1 3.93Å; W161-I172 HydrophobicContact CD2-CG1 4.48Å; W161-I172 HydrophobicContact CE3-CB 3.79Å; W161-I172 HydrophobicContact CE3-CD1 3.81Å; W161-I172 HydrophobicContact CE3-CG1 4.34Å; W161-I172 HydrophobicContact CE3-CG2 3.97Å; W161-I172 HydrophobicContact CG-CD1 4.12Å; W161-I172 HydrophobicContact CH2-CB 3.83Å; W161-I172 HydrophobicContact CH2-CG2 4.22Å; W161-I172 HydrophobicContact CZ2-CB 4.24Å; W161-I172 HydrophobicContact CZ3-CB 3.6Å; W161-I172 HydrophobicContact CZ3-CD1 4.49Å; W161-I172 HydrophobicContact CZ3-CG2 3.62Å; W161-P254 HydrophobicContact CH2-CG 4.32Å; W161-P254 HydrophobicContact CZ3-CG 4.16Å; W161-T262 CarbonylContact O-C 3.59Å; W161-T262 VanDerWaalsContact O-CA 3.25Å; W161-T262 WeakPolarHBondContact O-CA 3.5Å; W161-L263 HydrophobicContact CE3-CB 4.09Å; W161-L263 HydrophobicContact CZ3-CB 4.49Å; W161-L263 HydrophobicContact CZ3-CD2 4.4Å; W161-L263 PolarHBondContact N-O 2.98Å; W161-L263 VanDerWaalsContact N-O 3.08Å; W161-L263 PolarHBondContact O-N 3.21Å
162	T	95.9	Very high	93.6	Very high	0 Å²	0	68.3 Å²	68.3	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	131.8	169.3	-54.9	0	0	0	0	109.1	H136 W145 R192 H260 C261 T262	H136-T162 HydrophobicContact CB-CG2 3.84Å; H136-T162 WeakPolarHBondContact CB-O 3.39Å; H136-T162 PolarHBondContact N-O 2.81Å; W145-T162 PolarHBondContact O-N 2.98Å; T162-R192 PolarHBondContact OG1-NH2 2.58Å; T162-R192 VanDerWaalsContact OG1-NH2 3.14Å; T162-H260 HydrophobicContact CG2-CB 3.66Å; T162-C261 WeakPolarHBondContact CA-O 3.46Å; T162-T262 VanDerWaalsContact CG2-OG1 3.26Å; T162-T262 WeakPolarHBondContact CG2-OG1 3.08Å; T162-T262 WeakPolarHBondContact OG1-CG2 3.38Å; T162-T262 PolarHBondContact OG1-OG1 2.95Å
163	A	96.1	Very high	93.7	Very high	6 Å²	6	68.9 Å²	68.9	5%	0.05	33%	0.332	C	S	.	.			trans	-67.6	153.7	174.1	0	0	0	0	0	112.6	W161 P170 C261	W161-A163 HydrophobicContact CH2-CB 4.37Å; W161-A163 HydrophobicContact CZ2-CB 3.97Å; A163-P170 HydrophobicContact CB-CB 3.4Å; A163-P170 VanDerWaalsContact CB-CB 3.4Å; A163-P170 HydrophobicContact CB-CG 4.17Å; A163-C261 HydrophobicContact CB-CB 4.22Å; A163-C261 PolarHBondContact N-O 2.84Å; A163-C261 VanDerWaalsContact N-O 3.14Å
164	A	94	Very high	93.8	Very high	18 Å²	18	65.6 Å²	65.6	15%	0.149	31%	0.314	C	S	.	.			trans	-65.6	148.8	173.7	0	0	0	0	0	111.2	S134 N166 D167	S134-A164 PolarHBondContact OG-N 2.87Å; A164-N166 VanDerWaalsContact C-N 3.26Å; A164-N166 WeakPolarHBondContact CB-OD1 3.26Å; A164-N166 PolarHBondContact O-N 2.72Å; A164-D167 HydrophobicContact CB-CB 4.46Å; A164-D167 WeakPolarHBondContact O-CB 3.41Å; A164-D167 PolarHBondContact O-N 2.91Å
165	E	89.1	Confident	94	Very high	138 Å²	138	63.2 Å²	63.2	65%	0.645	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-27.2	-175	-71.4	171.6	-158	0	0	113.8	H136 H260	H136-E165 IonicContact CD2-OE1 3.62Å; H136-E165 IonicContact CE1-OE1 3.83Å; H136-E165 IonicContact NE2-OE1 2.77Å; H136-E165 PolarHBondContact NE2-OE1 2.97Å; E165-H260 IonicContact OE1-CE1 3.48Å; E165-H260 PolarHBondContact OE1-CE1 3.42Å; E165-H260 VanDerWaalsContact OE1-CE1 3.3Å
166	N	90.9	Very high	94.2	Very high	140 Å²	140	55.1 Å²	55.1	75%	0.749	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-3.6	178.8	63	-21.2	0	0	0	113.6	A164 R168	A164-N166 VanDerWaalsContact C-N 3.26Å; A164-N166 WeakPolarHBondContact CB-OD1 3.26Å; A164-N166 PolarHBondContact O-N 2.72Å; N166-R168 PolarHBondContact O-N 2.93Å
167	D	93.6	Very high	94.3	Very high	43 Å²	43	58.5 Å²	58.5	23%	0.23	27%	0.272	C	S	.	.			trans	-83	108	179.1	-170.9	-6	0	0	0	110.3	S133 S134 A164 W169 P170	S133-D167 VanDerWaalsContact CB-OD2 3.31Å; S133-D167 WeakPolarHBondContact CB-OD2 3.03Å; S133-D167 PolarHBondContact OG-OD2 2.85Å; S134-D167 VanDerWaalsContact CB-OD2 3.25Å; S134-D167 WeakPolarHBondContact CB-OD2 3.31Å; S134-D167 WeakPolarHBondContact OG-CB 3.19Å; S134-D167 PolarHBondContact OG-OD2 2.82Å; A164-D167 HydrophobicContact CB-CB 4.46Å; A164-D167 WeakPolarHBondContact O-CB 3.41Å; A164-D167 PolarHBondContact O-N 2.91Å; D167-W169 VanDerWaalsContact C-N 3.31Å; D167-W169 VanDerWaalsContact OD1-C 3.31Å; D167-W169 PolarHBondContact OD1-N 3.05Å; D167-P170 WeakPolarHBondContact OD2-CA 3.12Å
168	R	91	Very high	94.5	Very high	219 Å²	219	56.2 Å²	56.2	83%	0.826	25%	0.253	S	S	*	.	S	Bend	trans	-74.7	-22	-179.9	-64.2	-174.5	-176.7	-177.1	1.1	113.1	N166	N166-R168 PolarHBondContact O-N 2.93Å
169	W	93.3	Very high	94.6	Very high	190 Å²	190	60.7 Å²	60.7	72%	0.72	27%	0.267	S	S	*	.	S	Bend	trans	-136	61.9	-172.5	-57.8	108.5	0	0	0	110.6	D167	D167-W169 VanDerWaalsContact C-N 3.31Å; D167-W169 VanDerWaalsContact OD1-C 3.31Å; D167-W169 PolarHBondContact OD1-N 3.05Å
170	P	97.1	Very high	94.5	Very high	8 Å²	8	60.6 Å²	60.6	5%	0.052	27%	0.266	C	S	.	.			trans	-66.4	144.2	-174.1	29.7	-35.9	0	0	0	111	S133 W161 A163 D167 P254 C261	S133-P170 WeakPolarHBondContact OG-CA 3.03Å; W161-P170 HydrophobicContact CH2-CB 4.31Å; A163-P170 HydrophobicContact CB-CB 3.4Å; A163-P170 VanDerWaalsContact CB-CB 3.4Å; A163-P170 HydrophobicContact CB-CG 4.17Å; D167-P170 WeakPolarHBondContact OD2-CA 3.12Å; P170-P254 HydrophobicContact CG-CB 4.36Å; P170-P254 VanDerWaalsContact O-CD 3.31Å; P170-P254 WeakPolarHBondContact O-CD 3.15Å; P170-C261 HydrophobicContact CG-CB 4.47Å
171	W	97.3	Very high	94.4	Very high	61 Å²	61	62 Å²	62	23%	0.231	27%	0.271	C	S	.	.			trans	-142.5	150.9	171.6	59.8	-101.4	0	0	0	111.5	A132 S133 W161 Q173 R251 V252 Y253	A132-W171 CarbonylContact C-O 3.55Å; A132-W171 WeakPolarHBondContact CA-O 3.3Å; A132-W171 VanDerWaalsContact CB-O 3.32Å; A132-W171 WeakPolarHBondContact CB-O 3.22Å; S133-W171 PolarHBondContact N-O 3.26Å; S133-W171 PolarHBondContact OG-N 3Å; S133-W171 PolarHBondContact OG-O 3.19Å; W161-W171 WeakPolarHBondContact CZ2-O 3Å; W171-Q173 HydrophobicContact CE3-CB 3.76Å; W171-Q173 HydrophobicContact CZ3-CB 3.52Å; W171-R251 HydrophobicContact CB-CG 3.78Å; W171-R251 HydrophobicContact CD2-CG 4.27Å; W171-R251 HydrophobicContact CE3-CG 4.07Å; W171-R251 HydrophobicContact CG-CG 4.18Å; W171-V252 VanDerWaalsContact CA-O 3.3Å; W171-V252 WeakPolarHBondContact CA-O 3.39Å; W171-Y253 HydrophobicContact CB-CD1 3.69Å; W171-Y253 HydrophobicContact CB-CE1 3.67Å; W171-Y253 HydrophobicContact CB-CG 4.29Å; W171-Y253 HydrophobicContact CG-CE1 4.09Å
172	I	98	Very high	94.3	Very high	0 Å²	0	62 Å²	62	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	136.5	167.5	-172.1	170.7	0	0	0	108.7	I130 T131 A132 P147 A150 W161 R251 V252 L263 M265	I130-I172 HydrophobicContact CG2-CD1 3.91Å; I130-I172 HydrophobicContact CG2-CG1 4.06Å; T131-I172 CarbonylContact O-C 3.52Å; T131-I172 WeakPolarHBondContact O-CA 3.31Å; T131-I172 WeakPolarHBondContact O-CG1 3.42Å; A132-I172 HydrophobicContact CB-CB 4.45Å; A132-I172 HydrophobicContact CB-CG1 4.43Å; P147-I172 HydrophobicContact CB-CD1 4.26Å; P147-I172 HydrophobicContact CB-CG1 4.47Å; A150-I172 HydrophobicContact CB-CD1 3.38Å; W161-I172 HydrophobicContact CB-CD1 4.22Å; W161-I172 HydrophobicContact CD2-CB 4.22Å; W161-I172 HydrophobicContact CD2-CD1 3.93Å; W161-I172 HydrophobicContact CD2-CG1 4.48Å; W161-I172 HydrophobicContact CE3-CB 3.79Å; W161-I172 HydrophobicContact CE3-CD1 3.81Å; W161-I172 HydrophobicContact CE3-CG1 4.34Å; W161-I172 HydrophobicContact CE3-CG2 3.97Å; W161-I172 HydrophobicContact CG-CD1 4.12Å; W161-I172 HydrophobicContact CH2-CB 3.83Å; W161-I172 HydrophobicContact CH2-CG2 4.22Å; W161-I172 HydrophobicContact CZ2-CB 4.24Å; W161-I172 HydrophobicContact CZ3-CB 3.6Å; W161-I172 HydrophobicContact CZ3-CD1 4.49Å; W161-I172 HydrophobicContact CZ3-CG2 3.62Å; I172-R251 CarbonylContact O-C 3.6Å; I172-R251 VanDerWaalsContact O-CA 3.27Å; I172-R251 WeakPolarHBondContact O-CA 3.3Å; I172-R251 WeakPolarHBondContact O-CG 3.28Å; I172-V252 HydrophobicContact CG2-CB 3.93Å; I172-V252 PolarHBondContact N-O 2.84Å; I172-V252 PolarHBondContact O-N 2.71Å; I172-L263 HydrophobicContact CG2-CD2 4.35Å; I172-M265 HydrophobicContact CG2-CE 3.65Å; I172-M265 HydrophobicContact CG2-SD 4.48Å
173	Q	97.1	Very high	94.3	Very high	23 Å²	23	62.2 Å²	62.2	11%	0.107	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	139.3	-173.7	175.9	-178.8	-54.4	0	0	110.3	I130 T131 W171 W213 V250 R251	I130-Q173 WeakPolarHBondContact CA-O 3.11Å; T131-Q173 PolarHBondContact N-O 2.94Å; T131-Q173 PolarHBondContact O-N 2.77Å; W171-Q173 HydrophobicContact CE3-CB 3.76Å; W171-Q173 HydrophobicContact CZ3-CB 3.52Å; Q173-W213 HydrophobicContact CG-CH2 4.03Å; Q173-V250 CarbonylContact C-O 3.2Å; Q173-V250 WeakPolarHBondContact CA-O 3.32Å; Q173-R251 HydrophobicContact CB-CB 4.46Å; Q173-R251 HydrophobicContact CB-CG 4.28Å
174	I	98.1	Very high	94.2	Very high	0 Å²	0	62 Å²	62	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	124.5	176.1	-60.9	78.2	0	0	0	107.8	M120 I125 L176 F249 V250 M265 L267	M120-I174 HydrophobicContact CE-CD1 4.38Å; M120-I174 HydrophobicContact CE-CG1 3.75Å; M120-I174 HydrophobicContact SD-CG1 3.94Å; M120-I174 HydrophobicContact SD-CG2 4.15Å; I125-I174 HydrophobicContact CD1-CG2 4.07Å; I125-I174 HydrophobicContact CG2-CG2 4.17Å; I174-L176 HydrophobicContact CG2-CD2 3.83Å; I174-L176 HydrophobicContact CG2-CG 4.45Å; I174-F249 WeakPolarHBondContact O-CA 3.5Å; I174-V250 PolarHBondContact N-O 2.7Å; I174-V250 PolarHBondContact O-N 2.9Å; I174-M265 HydrophobicContact CD1-SD 3.77Å; I174-L267 HydrophobicContact CB-CD1 3.89Å; I174-L267 HydrophobicContact CD1-CD1 4.42Å; I174-L267 HydrophobicContact CG1-CD1 4.01Å; I174-L267 HydrophobicContact CG2-CD1 3.83Å
175	N	97.2	Very high	94.4	Very high	42 Å²	42	61.1 Å²	61.1	23%	0.225	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	109.9	170.4	178.8	5.8	0	0	0	109.6	Q129 Q177 Q248 F249	Q129-N175 WeakPolarHBondContact CB-O 3.32Å; Q129-N175 WeakPolarHBondContact CG-O 3.19Å; Q129-N175 PolarHBondContact NE2-O 2.75Å; Q129-N175 PolarHBondContact O-N 3.2Å; N175-Q177 PolarHBondContact O-N 2.7Å; N175-Q177 WeakPolarHBondContact OD1-CA 3.29Å; N175-Q177 PolarHBondContact OD1-N 3.17Å; N175-Q248 PolarHBondContact OD1-NE2 2.99Å; N175-F249 HydrophobicContact CB-CD1 3.81Å; N175-F249 HydrophobicContact CB-CE1 3.62Å; N175-F249 WeakPolarHBondContact OD1-CE1 3.37Å
176	L	94.8	Very high	94.8	Very high	14 Å²	14	56 Å²	56	7%	0.073	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	0.3	179.8	-58	173.2	0	0	0	113.2	L118 I125 I174 R178 M180 V182 Q248 V250 L267	L118-L176 HydrophobicContact CD1-CD1 4.1Å; L118-L176 HydrophobicContact CD1-CD2 4.01Å; I125-L176 HydrophobicContact CD1-CD2 3.95Å; I174-L176 HydrophobicContact CG2-CD2 3.83Å; I174-L176 HydrophobicContact CG2-CG 4.45Å; L176-R178 WeakPolarHBondContact O-CG 3.36Å; L176-R178 PolarHBondContact O-N 2.92Å; L176-M180 HydrophobicContact CB-CG 3.85Å; L176-M180 HydrophobicContact CD1-CB 3.74Å; L176-M180 HydrophobicContact CD1-CG 3.88Å; L176-M180 HydrophobicContact CG-CG 4.42Å; L176-V182 HydrophobicContact CD1-CG2 3.78Å; L176-Q248 VanDerWaalsContact CB-O 3.27Å; L176-Q248 WeakPolarHBondContact CB-O 3.48Å; L176-Q248 WeakPolarHBondContact CG-O 3.23Å; L176-Q248 PolarHBondContact N-O 2.92Å; L176-V250 HydrophobicContact CD1-CG2 4.39Å; L176-L267 HydrophobicContact CD2-CD1 4.17Å
177	Q	92.1	Very high	95.2	Very high	127 Å²	127	49.3 Å²	49.3	59%	0.593	21%	0.205	S	C	*	.	E	Extended strand (participates in β ladder)	trans	62.7	-17.9	-178.3	-64.7	175.2	-24.1	0	0	116.1	Q129 N175	Q129-Q177 HydrophobicContact CG-CG 4.26Å; N175-Q177 PolarHBondContact O-N 2.7Å; N175-Q177 WeakPolarHBondContact OD1-CA 3.29Å; N175-Q177 PolarHBondContact OD1-N 3.17Å
178	R	90.5	Very high	95.3	Very high	106 Å²	106	47.7 Å²	47.7	40%	0.4	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	160.2	177.8	45.5	172.1	62.4	-165.7	-4.6	108.9	L176 M180 Q248 E271	L176-R178 WeakPolarHBondContact O-CG 3.36Å; L176-R178 PolarHBondContact O-N 2.92Å; R178-M180 HydrophobicContact CG-CG 4.24Å; R178-M180 HydrophobicContact CG-SD 3.76Å; R178-M180 WeakPolarHBondContact O-CG 3.32Å; R178-M180 PolarHBondContact O-N 3.08Å; R178-Q248 WeakPolarHBondContact O-CA 3.37Å; R178-E271 IonicContact NH1-OE1 2.77Å; R178-E271 IonicContact NH1-OE2 3.31Å; R178-E271 PolarHBondContact NH1-OE2 2.95Å
179	R	93.1	Very high	95.6	Very high	123 Å²	123	37.2 Å²	37.2	46%	0.464	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	119.6	175.8	-161.1	175.1	176	-138.7	-17.2	109.1	D208 E246 L272	R179-D208 IonicContact NE-OD1 2.7Å; R179-E246 IonicContact CZ-OE2 3.36Å; R179-E246 IonicContact NH2-OE2 3.61Å; R179-E246 PolarHBondContact NH2-OE2 3.32Å; R179-E246 VanDerWaalsContact NH2-OE2 3.13Å; R179-L272 HydrophobicContact CB-CD1 3.99Å; R179-L272 HydrophobicContact CG-CD1 3.94Å
180	M	92.6	Very high	95.6	Very high	14 Å²	14	28.2 Å²	28.2	7%	0.069	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	157.6	-175.7	-60.8	-67.7	-75.8	0	0	109.9	L118 L176 R178 E246 A247 E271	L118-M180 HydrophobicContact CD2-CE 3.83Å; L176-M180 HydrophobicContact CB-CG 3.85Å; L176-M180 HydrophobicContact CD1-CB 3.74Å; L176-M180 HydrophobicContact CD1-CG 3.88Å; L176-M180 HydrophobicContact CG-CG 4.42Å; R178-M180 HydrophobicContact CG-CG 4.24Å; R178-M180 HydrophobicContact CG-SD 3.76Å; R178-M180 WeakPolarHBondContact O-CG 3.32Å; R178-M180 PolarHBondContact O-N 3.08Å; M180-E246 WeakPolarHBondContact O-CA 3.43Å; M180-A247 PolarHBondContact N-O 2.86Å; M180-A247 PolarHBondContact O-N 2.86Å; M180-A247 VanDerWaalsContact O-N 3.1Å; M180-E271 HydrophobicContact CE-CB 4.49Å; M180-E271 HydrophobicContact CE-CG 3.65Å; M180-E271 HydrophobicContact SD-CB 4.49Å; M180-E271 HydrophobicContact SD-CG 3.83Å
181	R	93.9	Very high	95.4	Very high	29 Å²	29	33.3 Å²	33.3	11%	0.109	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	111.7	168.6	-177.3	171.3	170.2	171.2	-9.3	108.9	G103 Y105 T183 P244 I245 G269 C270 L272	G103-R181 PolarHBondContact O-NH2 3.18Å; Y105-R181 PolarHBondContact O-NH2 2.85Å; R181-T183 HydrophobicContact CG-CG2 4.19Å; R181-P244 HydrophobicContact CG-CB 4.14Å; R181-I245 CarbonylContact C-O 3.55Å; R181-I245 WeakPolarHBondContact CA-O 3.25Å; R181-G269 CarbonylContact O-C 3.52Å; R181-G269 WeakPolarHBondContact O-CA 3.24Å; R181-C270 PolarHBondContact N-O 2.86Å; R181-C270 PolarHBondContact O-N 3.17Å; R181-L272 HydrophobicContact CB-CD2 4.11Å
182	V	95.3	Very high	94.8	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	117.6	179.7	-172.8	0	0	0	0	108.7	L118 L176 F241 I245 V250 L267 L268	L118-V182 HydrophobicContact CD1-CG2 4.12Å; L176-V182 HydrophobicContact CD1-CG2 3.78Å; V182-F241 HydrophobicContact CG1-CD2 4.12Å; V182-F241 HydrophobicContact CG1-CE2 3.86Å; V182-I245 HydrophobicContact CB-CB 4.27Å; V182-I245 PolarHBondContact N-O 2.93Å; V182-I245 PolarHBondContact O-N 2.87Å; V182-V250 HydrophobicContact CG2-CG2 3.99Å; V182-L267 HydrophobicContact CG1-CD2 4.02Å; V182-L268 CarbonylContact C-O 3.29Å; V182-L268 WeakPolarHBondContact CA-O 3.48Å; V182-L268 WeakPolarHBondContact CG1-O 3.38Å
183	T	94.8	Very high	94.1	Very high	6 Å²	6	38.1 Å²	38.1	4%	0.037	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	-11.6	-172.7	54.9	0	0	0	0	112.9	C114 R181 S240 F241 P244 L268	C114-T183 HydrophobicContact CB-CG2 4.27Å; C114-T183 VanDerWaalsContact O-CB 3.32Å; C114-T183 WeakPolarHBondContact O-CB 3.42Å; C114-T183 WeakPolarHBondContact O-CG2 3.2Å; C114-T183 PolarHBondContact O-OG1 2.63Å; R181-T183 HydrophobicContact CG-CG2 4.19Å; T183-S240 CarbonylContact O-C 3.05Å; T183-S240 WeakPolarHBondContact O-CA 3.48Å; T183-F241 PolarHBondContact O-N 2.81Å; T183-P244 HydrophobicContact CG2-CB 4.09Å; T183-L268 PolarHBondContact N-O 2.8Å; T183-L268 PolarHBondContact OG1-O 3.44Å
184	G	95.4	Very high	93.4	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-174	178.3	175.6	0	0	0	0	0	114.5	N239 L268	G184-N239 CarbonylContact C-O 3.31Å; G184-N239 WeakPolarHBondContact CA-O 3.24Å; G184-L268 PolarHBondContact N-O 2.7Å; G184-L268 PolarHBondContact O-N 2.75Å
185	L	97.3	Very high	93	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	127.9	177.4	177	71.3	0	0	0	109.3	T187 Y202 N239 F241 V252 M265 L267	L185-T187 HydrophobicContact CD2-CG2 3.78Å; L185-T187 HydrophobicContact CG-CG2 3.87Å; L185-Y202 HydrophobicContact CD2-CD2 4.3Å; L185-Y202 HydrophobicContact CD2-CE2 3.56Å; L185-N239 PolarHBondContact N-O 2.61Å; L185-N239 PolarHBondContact O-N 3.13Å; L185-F241 HydrophobicContact CB-CE2 4.42Å; L185-F241 HydrophobicContact CB-CZ 3.77Å; L185-V252 HydrophobicContact CD2-CG1 4.23Å; L185-V252 HydrophobicContact CD2-CG2 3.73Å; L185-M265 HydrophobicContact CD1-CB 3.95Å; L185-M265 HydrophobicContact CD1-CE 4.3Å; L185-M265 HydrophobicContact CD1-CG 4.48Å; L185-M265 HydrophobicContact CD1-SD 3.96Å; L185-L267 HydrophobicContact CD1-CD2 3.66Å; L185-L267 HydrophobicContact CD1-CG 4.26Å
186	I	97.8	Very high	92.8	Very high	31 Å²	31	40.2 Å²	40.2	16%	0.159	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	133.4	167.6	-53.7	-179.7	0	0	0	108.1	L152 P236 S237 A238 M265 E266 L268	L152-I186 HydrophobicContact CD1-CG2 3.76Å; L152-I186 HydrophobicContact CD2-CB 4.42Å; L152-I186 HydrophobicContact CD2-CD1 4.4Å; L152-I186 HydrophobicContact CD2-CG2 3.99Å; I186-P236 HydrophobicContact CG2-CB 3.66Å; I186-S237 CarbonylContact C-O 3.53Å; I186-S237 WeakPolarHBondContact CA-O 3.49Å; I186-A238 HydrophobicContact CG1-CB 4.06Å; I186-M265 CarbonylContact O-C 3.54Å; I186-M265 WeakPolarHBondContact O-CA 3.26Å; I186-M265 VanDerWaalsContact O-CB 3.25Å; I186-M265 WeakPolarHBondContact O-CB 3.2Å; I186-E266 HydrophobicContact CB-CB 4.39Å; I186-E266 PolarHBondContact N-O 2.02Å; I186-E266 PolarHBondContact O-N 3.19Å; I186-L268 HydrophobicContact CD1-CD1 4.02Å; I186-L268 HydrophobicContact CD1-CD2 3.97Å; I186-L268 HydrophobicContact CD1-CG 4.28Å; I186-L268 HydrophobicContact CG1-CD1 3.87Å; I186-L268 HydrophobicContact CG1-CD2 4.32Å; I186-L268 HydrophobicContact CG1-CG 4.12Å
187	T	97.9	Very high	92.9	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	147	179.6	56.4	0	0	0	0	110.6	L185 Y202 N230 P236 S237 L263 R264	L185-T187 HydrophobicContact CD2-CG2 3.78Å; L185-T187 HydrophobicContact CG-CG2 3.87Å; T187-Y202 HydrophobicContact CG2-CD1 4.48Å; T187-Y202 HydrophobicContact CG2-CE1 3.77Å; T187-N230 PolarHBondContact O-ND2 2.86Å; T187-N230 PolarHBondContact OG1-OD1 3.05Å; T187-P236 CarbonylContact O-C 3.58Å; T187-P236 WeakPolarHBondContact O-CA 3.4Å; T187-S237 PolarHBondContact N-O 2.77Å; T187-S237 PolarHBondContact O-N 2.95Å; T187-S237 PolarHBondContact OG1-O 2.87Å; T187-L263 HydrophobicContact CG2-CD1 3.82Å; T187-R264 CarbonylContact C-O 3.58Å; T187-R264 WeakPolarHBondContact CA-O 3.45Å
188	Q	97.3	Very high	93.1	Very high	8 Å²	8	34.2 Å²	34.2	4%	0.037	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	142.3	178	-170.4	-171.6	32.6	0	0	108.7	L152 N153 N230 N234 R264	L152-Q188 HydrophobicContact CD1-CB 3.82Å; N153-Q188 PolarHBondContact OD1-NE2 3.44Å; Q188-N230 WeakPolarHBondContact CA-ND2 3.19Å; Q188-N230 PolarHBondContact N-OD1 3.2Å; Q188-N234 WeakPolarHBondContact CG-O 3.47Å; Q188-N234 PolarHBondContact NE2-O 2.89Å; Q188-R264 HydrophobicContact CB-CB 4.06Å; Q188-R264 PolarHBondContact N-O 3.34Å; Q188-R264 PolarHBondContact O-N 3.3Å
189	G	95.8	Very high	93.4	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.151	C	C	.	.			trans	-79.2	-163.4	177.4	0	0	0	0	0	113.8	E197 N233 R264	G189-E197 CarbonylContact C-O 3.51Å; G189-E197 WeakPolarHBondContact CA-O 3.46Å; G189-N233 CarbonylContact C-O 3.56Å; G189-R264 PolarHBondContact O-NE 3.44Å; G189-R264 PolarHBondContact O-NH2 3.16Å
190	A	94.9	Very high	93.6	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	179	165.7	0	0	0	0	0	111.4	W145 A160 E197 N233 T262	W145-A190 HydrophobicContact CZ3-CB 4.1Å; A160-A190 HydrophobicContact CB-CB 3.72Å; A190-E197 PolarHBondContact N-O 2.87Å; A190-E197 PolarHBondContact O-N 3.48Å; A190-N233 PolarHBondContact N-O 2.79Å; A190-N233 WeakPolarHBondContact O-CB 3.25Å; A190-T262 HydrophobicContact CB-CG2 3.64Å
191	K	91.1	Very high	93.8	Very high	116 Å²	116	28.4 Å²	28.4	50%	0.504	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	128.9	-179	-172.8	-180	-178.7	-178.9	0	109.3	G194 S195	K191-G194 WeakPolarHBondContact CE-O 3.49Å; K191-S195 CarbonylContact C-O 3.39Å; K191-S195 VanDerWaalsContact CA-O 3.31Å; K191-S195 WeakPolarHBondContact CA-O 3.15Å; K191-S195 WeakPolarHBondContact CG-O 3.31Å
192	R	85.8	Confident	94	Very high	24 Å²	24	27 Å²	27	9%	0.091	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	119.7	175.7	-167.6	-172.3	-43.4	-131.7	-12.5	108.8	H136 W145 T162 G194 S195 E197	H136-R192 PolarHBondContact CE1-NH1 2.96Å; H136-R192 PolarHBondContact ND1-NH1 3.37Å; W145-R192 HydrophobicContact CZ2-CB 4.39Å; W145-R192 HydrophobicContact CZ2-CG 4.13Å; T162-R192 PolarHBondContact OG1-NH2 2.58Å; T162-R192 VanDerWaalsContact OG1-NH2 3.14Å; R192-G194 PolarHBondContact O-N 2.88Å; R192-S195 PolarHBondContact N-O 2.79Å; R192-S195 WeakPolarHBondContact O-CB 3.4Å; R192-S195 PolarHBondContact O-N 3.36Å; R192-E197 WeakPolarHBondContact CB-OE1 3.3Å; R192-E197 IonicContact CZ-OE1 3.64Å; R192-E197 IonicContact CZ-OE2 2.78Å; R192-E197 IonicContact NE-OE1 3.3Å; R192-E197 PolarHBondContact NE-OE1 2.83Å; R192-E197 IonicContact NE-OE2 3.54Å; R192-E197 PolarHBondContact NE-OE2 2.95Å; R192-E197 IonicContact NH2-OE1 2.79Å; R192-E197 IonicContact NH2-OE2 3.26Å; R192-E197 PolarHBondContact NH2-OE2 3.32Å
193	I	82.9	Confident	94.1	Very high	137 Å²	137	29.2 Å²	29.2	70%	0.703	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	42.7	63.4	177	-50	173.3	0	0	0	111.5	S195	I193-S195 PolarHBondContact O-N 2.71Å; I193-S195 VanDerWaalsContact O-N 3.1Å
194	G	82.2	Confident	94.2	Very high	53 Å²	53	28.9 Å²	28.9	55%	0.546	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.9	-15.7	178	0	0	0	0	0	115.4	K191 R192	K191-G194 WeakPolarHBondContact CE-O 3.49Å; R192-G194 PolarHBondContact O-N 2.88Å
195	S	90.2	Very high	94.3	Very high	28 Å²	28	29 Å²	29	20%	0.196	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	129.6	-168.4	-63.2	0	0	0	0	114.2	K191 R192 I193 R259	K191-S195 CarbonylContact C-O 3.39Å; K191-S195 VanDerWaalsContact CA-O 3.31Å; K191-S195 WeakPolarHBondContact CA-O 3.15Å; K191-S195 WeakPolarHBondContact CG-O 3.31Å; R192-S195 PolarHBondContact N-O 2.79Å; R192-S195 WeakPolarHBondContact O-CB 3.4Å; R192-S195 PolarHBondContact O-N 3.36Å; I193-S195 PolarHBondContact O-N 2.71Å; I193-S195 VanDerWaalsContact O-N 3.1Å; S195-R259 PolarHBondContact OG-NH1 3.27Å
196	P	94.1	Very high	94.3	Very high	29 Å²	29	31.8 Å²	31.8	19%	0.188	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	136.7	179.2	31.3	-34.6	0	0	0	112.1	Y198 N233	P196-Y198 HydrophobicContact CB-CD1 4.45Å; P196-Y198 HydrophobicContact CB-CE1 4.31Å; P196-N233 HydrophobicContact CB-CB 3.77Å
197	E	95	Very high	94.3	Very high	6 Å²	6	30.5 Å²	30.5	3%	0.028	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	132.1	176.6	-62.7	172.9	-177.1	0	0	109.2	G189 A190 R192 R259 H260 T262	G189-E197 CarbonylContact C-O 3.51Å; G189-E197 WeakPolarHBondContact CA-O 3.46Å; A190-E197 PolarHBondContact N-O 2.87Å; A190-E197 PolarHBondContact O-N 3.48Å; R192-E197 WeakPolarHBondContact CB-OE1 3.3Å; R192-E197 IonicContact CZ-OE1 3.64Å; R192-E197 IonicContact CZ-OE2 2.78Å; R192-E197 IonicContact NE-OE1 3.3Å; R192-E197 PolarHBondContact NE-OE1 2.83Å; R192-E197 IonicContact NE-OE2 3.54Å; R192-E197 PolarHBondContact NE-OE2 2.95Å; R192-E197 IonicContact NH2-OE1 2.79Å; R192-E197 IonicContact NH2-OE2 3.26Å; R192-E197 PolarHBondContact NH2-OE2 3.32Å; E197-R259 HydrophobicContact CG-CB 4.22Å; E197-H260 IonicContact OE1-CD2 2.7Å; E197-H260 PolarHBondContact OE1-CD2 3.41Å; E197-T262 HydrophobicContact CB-CG2 4.36Å; E197-T262 PolarHBondContact OE2-OG1 2.77Å
198	Y	96.4	Very high	94.3	Very high	9 Å²	9	34.4 Å²	34.4	4%	0.035	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166	160.2	-178	53.3	-93.2	0	0	0	112.6	P196 K200 N230 V231 D232 C257 R258 T262	P196-Y198 HydrophobicContact CB-CD1 4.45Å; P196-Y198 HydrophobicContact CB-CE1 4.31Å; Y198-K200 HydrophobicContact CD2-CG 4.09Å; Y198-K200 HydrophobicContact CE2-CG 3.79Å; Y198-N230 HydrophobicContact CD2-CB 3.98Å; Y198-N230 VanDerWaalsContact CD2-O 3.25Å; Y198-N230 WeakPolarHBondContact CD2-O 3.49Å; Y198-N230 WeakPolarHBondContact CE2-O 3.5Å; Y198-N230 HydrophobicContact CG-CB 4.25Å; Y198-V231 PolarHBondContact OH-O 2.75Å; Y198-D232 VanDerWaalsContact CD1-C 3.46Å; Y198-D232 WeakPolarHBondContact CD1-O 3.42Å; Y198-C257 WeakPolarHBondContact O-CA 3.42Å; Y198-R258 HydrophobicContact CD1-CB 4.25Å; Y198-R258 HydrophobicContact CD2-CB 4.21Å; Y198-R258 HydrophobicContact CE1-CB 4.06Å; Y198-R258 HydrophobicContact CE1-CG 4.22Å; Y198-R258 HydrophobicContact CE2-CB 4.01Å; Y198-R258 HydrophobicContact CG-CB 4.33Å; Y198-R258 PolarHBondContact O-N 3.35Å; Y198-R258 WeakPolarHBondContact OH-CD 3.47Å; Y198-R258 PolarHBondContact OH-NH1 2.7Å; Y198-T262 WeakPolarHBondContact CA-O 3.48Å
199	V	97.6	Very high	94.2	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	124	173.7	-179.3	0	0	0	0	109.5	S201 Y202 G229 N230 P254 C261 L263	V199-S201 WeakPolarHBondContact CG1-O 3.19Å; V199-Y202 HydrophobicContact CG1-CD1 4.33Å; V199-G229 CarbonylContact O-C 3.56Å; V199-G229 WeakPolarHBondContact O-CA 3.3Å; V199-N230 PolarHBondContact O-N 3.41Å; V199-P254 HydrophobicContact CG1-CB 3.89Å; V199-P254 HydrophobicContact CG2-CB 3.94Å; V199-P254 HydrophobicContact CG2-CG 4.06Å; V199-C261 HydrophobicContact CG2-CB 4.47Å; V199-L263 HydrophobicContact CG2-CB 4.27Å; V199-L263 HydrophobicContact CG2-CD1 4.39Å
200	K	96.8	Very high	94	Very high	102 Å²	102	38.6 Å²	38.6	44%	0.443	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	-28.8	178	-68.5	-173.7	177.4	-175.9	0	113.4	Y198 G229 V256	Y198-K200 HydrophobicContact CD2-CG 4.09Å; Y198-K200 HydrophobicContact CE2-CG 3.79Å; K200-G229 WeakPolarHBondContact O-CA 3.27Å; K200-G229 PolarHBondContact O-N 2.98Å; K200-V256 WeakPolarHBondContact CA-O 3.49Å; K200-V256 HydrophobicContact CB-CB 4.28Å; K200-V256 HydrophobicContact CB-CG1 4.18Å; K200-V256 WeakPolarHBondContact CB-O 3.36Å; K200-V256 HydrophobicContact CD-CG1 4.17Å; K200-V256 PolarHBondContact N-O 2.99Å
201	S	97.2	Very high	94	Very high	19 Å²	19	47.1 Å²	47.1	13%	0.133	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	152.5	173.8	62.4	0	0	0	0	111.1	V199 F227 Q255 V256	V199-S201 WeakPolarHBondContact CG1-O 3.19Å; S201-F227 WeakPolarHBondContact CA-O 3.36Å; S201-F227 VanDerWaalsContact CB-O 3.3Å; S201-F227 WeakPolarHBondContact CB-O 3.39Å; S201-Q255 PolarHBondContact O-N 3.37Å; S201-V256 PolarHBondContact N-O 3.3Å; S201-V256 PolarHBondContact O-N 2.74Å; S201-V256 WeakPolarHBondContact OG-CB 3.49Å; S201-V256 WeakPolarHBondContact OG-CG2 3.13Å; S201-V256 PolarHBondContact OG-N 3.04Å
202	Y	97.7	Very high	94.2	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	157.3	-177.8	60.2	-91.1	0	0	0	111.8	L185 T187 V199 V204 F227 N239 V252 Y253	L185-Y202 HydrophobicContact CD2-CD2 4.3Å; L185-Y202 HydrophobicContact CD2-CE2 3.56Å; T187-Y202 HydrophobicContact CG2-CD1 4.48Å; T187-Y202 HydrophobicContact CG2-CE1 3.77Å; V199-Y202 HydrophobicContact CG1-CD1 4.33Å; Y202-V204 HydrophobicContact CD2-CG2 3.8Å; Y202-V204 HydrophobicContact CE2-CG2 3.7Å; Y202-F227 HydrophobicContact CD1-CB 4.29Å; Y202-F227 HydrophobicContact CD2-CB 3.91Å; Y202-F227 HydrophobicContact CD2-CD2 4.1Å; Y202-F227 HydrophobicContact CD2-CG 4.34Å; Y202-F227 HydrophobicContact CE1-CB 3.9Å; Y202-F227 HydrophobicContact CE2-CB 3.47Å; Y202-F227 VanDerWaalsContact CE2-CB 3.47Å; Y202-F227 AromaticContact CE2-CD2 3.78Å; Y202-F227 HydrophobicContact CE2-CD2 3.78Å; Y202-F227 AromaticContact CE2-CG 3.75Å; Y202-F227 HydrophobicContact CE2-CG 3.75Å; Y202-F227 HydrophobicContact CG-CB 4.29Å; Y202-F227 VanDerWaalsContact CZ-CB 3.48Å; Y202-F227 PolarHBondContact N-O 3.01Å; Y202-F227 VanDerWaalsContact N-O 3.08Å; Y202-F227 PolarHBondContact O-N 3.1Å; Y202-N239 PolarHBondContact OH-ND2 3.02Å; Y202-V252 HydrophobicContact CD2-CG1 3.81Å; Y202-V252 HydrophobicContact CG-CG1 4.05Å; Y202-Y253 CarbonylContact C-O 3.57Å; Y202-Y253 VanDerWaalsContact CA-O 3.26Å; Y202-Y253 WeakPolarHBondContact CA-O 3.38Å; Y202-Y253 WeakPolarHBondContact CB-O 3.36Å
203	K	97.3	Very high	94.7	Very high	45 Å²	45	47.6 Å²	47.6	20%	0.196	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	157.6	166	-68.6	-177.8	175.2	-171.4	0	109.4	D224 I226 Y253 Q255	K203-D224 HydrophobicContact CD-CB 4.16Å; K203-D224 IonicContact NZ-OD2 3.44Å; K203-D224 PolarHBondContact NZ-OD2 2.93Å; K203-I226 HydrophobicContact CG-CG1 4.18Å; K203-Y253 PolarHBondContact N-O 3.32Å; K203-Y253 PolarHBondContact O-N 3.49Å; K203-Q255 HydrophobicContact CG-CG 3.96Å
204	V	97.8	Very high	95.3	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	136.6	175.2	-178.9	0	0	0	0	108.2	Y202 Y216 F227 F241 I245 V250 R251	Y202-V204 HydrophobicContact CD2-CG2 3.8Å; Y202-V204 HydrophobicContact CE2-CG2 3.7Å; V204-Y216 VanDerWaalsContact O-CB 3.26Å; V204-Y216 WeakPolarHBondContact O-CB 3.46Å; V204-Y216 PolarHBondContact O-N 2.96Å; V204-F227 HydrophobicContact CB-CE2 4.16Å; V204-F227 HydrophobicContact CG2-CD2 3.93Å; V204-F227 HydrophobicContact CG2-CE2 3.81Å; V204-F241 HydrophobicContact CG1-CZ 4.25Å; V204-F241 HydrophobicContact CG2-CE1 4.12Å; V204-F241 HydrophobicContact CG2-CZ 3.99Å; V204-I245 HydrophobicContact CG1-CD1 3.92Å; V204-V250 HydrophobicContact CG1-CG1 3.89Å; V204-R251 CarbonylContact C-O 3.59Å; V204-R251 WeakPolarHBondContact CA-O 3.4Å
205	A	97.6	Very high	96	Very high	2 Å²	2	49.2 Å²	49.2	2%	0.017	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	158	168.6	0	0	0	0	0	109.9	W213 R214 R251 Y253	A205-W213 HydrophobicContact CB-CE3 3.95Å; A205-R214 CarbonylContact C-O 3.56Å; A205-R214 WeakPolarHBondContact CA-O 3.39Å; A205-R214 WeakPolarHBondContact CB-O 3.39Å; A205-R251 PolarHBondContact N-O 3.18Å; A205-R251 PolarHBondContact O-N 2.77Å; A205-Y253 HydrophobicContact CB-CD2 4.31Å; A205-Y253 HydrophobicContact CB-CE2 3.67Å
206	Y	97.8	Very high	96.2	Very high	59 Å²	59	48.3 Å²	48.3	23%	0.231	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	158.5	-178.6	61.6	-86.8	0	0	0	111.4	R214 Y216 I245 A247 F249	Y206-R214 WeakPolarHBondContact CD1-O 3.37Å; Y206-R214 HydrophobicContact CE1-CB 4.19Å; Y206-R214 HydrophobicContact CE2-CB 4.17Å; Y206-R214 PolarHBondContact N-O 3.32Å; Y206-R214 PolarHBondContact O-N 3.06Å; Y206-Y216 HydrophobicContact CE1-CD2 4.48Å; Y206-I245 HydrophobicContact CD1-CD1 4.06Å; Y206-I245 HydrophobicContact CD1-CG1 4.14Å; Y206-I245 HydrophobicContact CD1-CG2 3.79Å; Y206-I245 HydrophobicContact CD2-CG2 3.83Å; Y206-I245 HydrophobicContact CE1-CG1 4.44Å; Y206-I245 HydrophobicContact CE1-CG2 4.47Å; Y206-I245 HydrophobicContact CE2-CG2 4.47Å; Y206-I245 HydrophobicContact CG-CG2 3.43Å; Y206-I245 VanDerWaalsContact CG-CG2 3.43Å; Y206-A247 HydrophobicContact CD2-CB 3.92Å; Y206-A247 HydrophobicContact CG-CB 4.29Å; Y206-F249 VanDerWaalsContact CA-O 3.24Å; Y206-F249 WeakPolarHBondContact CA-O 3.3Å
207	S	98.1	Very high	96.2	Very high	4 Å²	4	51 Å²	51	3%	0.028	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	148.4	-174.6	177.9	0	0	0	0	110.8	D209 G210 T212 Q248 F249	S207-D209 PolarHBondContact OG-N 3Å; S207-D209 PolarHBondContact OG-OD1 2.93Å; S207-G210 WeakPolarHBondContact OG-CA 3.3Å; S207-G210 PolarHBondContact OG-N 2.76Å; S207-T212 WeakPolarHBondContact CB-O 3.41Å; S207-T212 PolarHBondContact OG-O 2.84Å; S207-Q248 PolarHBondContact O-N 2.93Å; S207-F249 PolarHBondContact N-O 3.09Å; S207-F249 WeakPolarHBondContact O-CB 3.08Å; S207-F249 WeakPolarHBondContact O-CD2 3.42Å; S207-F249 PolarHBondContact O-N 3.11Å
208	D	96.6	Very high	95.8	Very high	81 Å²	81	53 Å²	53	43%	0.433	26%	0.256	S	S	.	.	S	Bend	trans	-93.6	-24.5	172.1	-69.9	-52.5	0	0	0	112.5	R179 A247	R179-D208 IonicContact NE-OD1 2.7Å; D208-A247 WeakPolarHBondContact OD1-CA 3.19Å
209	D	94.6	Very high	95.1	Very high	76 Å²	76	60.3 Å²	60.3	41%	0.406	29%	0.287	S	S	.	.	S	Bend	trans	-112.4	-8.3	-173.9	63.9	5.8	0	0	0	113.7	S207 K211 T212	S207-D209 PolarHBondContact OG-N 3Å; S207-D209 PolarHBondContact OG-OD1 2.93Å; D209-K211 PolarHBondContact O-N 2.9Å; D209-K211 WeakPolarHBondContact OD1-CA 3.41Å; D209-K211 PolarHBondContact OD1-N 3.07Å; D209-T212 VanDerWaalsContact CG-OG1 3.29Å; D209-T212 PolarHBondContact OD1-N 2.95Å; D209-T212 PolarHBondContact OD1-OG1 2.76Å; D209-T212 VanDerWaalsContact OD1-OG1 3.09Å; D209-T212 PolarHBondContact OD2-OG1 2.88Å
210	G	93.1	Very high	94.4	Very high	21 Å²	21	64.4 Å²	64.4	22%	0.216	33%	0.33	C	S	.	.	S	Bend	trans	73.3	0.7	-174.4	0	0	0	0	0	114.5	S207 W213	S207-G210 WeakPolarHBondContact OG-CA 3.3Å; S207-G210 PolarHBondContact OG-N 2.76Å; G210-W213 PolarHBondContact O-NE1 2.99Å; G210-W213 VanDerWaalsContact O-NE1 3.08Å
211	K	93.5	Very high	93.9	Very high	178 Å²	178	66.1 Å²	66.1	77%	0.774	34%	0.337	S	S	*	.	S	Bend	trans	-110.6	-48.3	-176.9	-63.3	179.7	-177.7	178	0	111.6	D209 W213	D209-K211 PolarHBondContact O-N 2.9Å; D209-K211 WeakPolarHBondContact OD1-CA 3.41Å; D209-K211 PolarHBondContact OD1-N 3.07Å; K211-W213 VanDerWaalsContact O-CD1 3.27Å
212	T	96.4	Very high	93.3	Very high	90 Å²	90	72.3 Å²	72.3	55%	0.552	37%	0.369	S	S	*	.	S	Bend	trans	-96.2	120.8	179.1	58.2	0	0	0	0	109.7	S207 D209	S207-T212 WeakPolarHBondContact CB-O 3.41Å; S207-T212 PolarHBondContact OG-O 2.84Å; D209-T212 VanDerWaalsContact CG-OG1 3.29Å; D209-T212 PolarHBondContact OD1-N 2.95Å; D209-T212 PolarHBondContact OD1-OG1 2.76Å; D209-T212 VanDerWaalsContact OD1-OG1 3.09Å; D209-T212 PolarHBondContact OD2-OG1 2.88Å
213	W	96.3	Very high	92.8	Very high	61 Å²	61	80 Å²	80	23%	0.231	40%	0.404	C	S	.	.			trans	-114.7	135.6	-172	-70.1	86.7	0	0	0	111.2	Q173 A205 G210 K211 F249 R251	Q173-W213 HydrophobicContact CG-CH2 4.03Å; A205-W213 HydrophobicContact CB-CE3 3.95Å; G210-W213 PolarHBondContact O-NE1 2.99Å; G210-W213 VanDerWaalsContact O-NE1 3.08Å; K211-W213 VanDerWaalsContact O-CD1 3.27Å; W213-F249 HydrophobicContact CH2-CB 3.71Å; W213-F249 HydrophobicContact CZ2-CB 4.38Å; W213-F249 HydrophobicContact CZ3-CB 4.3Å; W213-R251 VanDerWaalsContact CE2-CZ 3.4Å; W213-R251 HydrophobicContact CE3-CB 3.99Å; W213-R251 HydrophobicContact CH2-CB 3.65Å; W213-R251 HydrophobicContact CZ3-CB 3.29Å; W213-R251 HydrophobicContact CZ3-CG 4.42Å
214	R	95.4	Very high	92.6	Very high	171 Å²	171	80.6 Å²	80.6	65%	0.645	41%	0.41	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.4	124.7	173.4	-60.3	-178.5	-171.7	-169.6	3.3	109	A205 Y206	A205-R214 CarbonylContact C-O 3.56Å; A205-R214 WeakPolarHBondContact CA-O 3.39Å; A205-R214 WeakPolarHBondContact CB-O 3.39Å; Y206-R214 WeakPolarHBondContact CD1-O 3.37Å; Y206-R214 HydrophobicContact CE1-CB 4.19Å; Y206-R214 HydrophobicContact CE2-CB 4.17Å; Y206-R214 PolarHBondContact N-O 3.32Å; Y206-R214 PolarHBondContact O-N 3.06Å
215	T	95.8	Very high	92.4	Very high	53 Å²	53	83.8 Å²	83.8	33%	0.325	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	139.9	173.1	-49.9	0	0	0	0	109.6	D224	T215-D224 HydrophobicContact CG2-CB 3.94Å
216	Y	96	Very high	92.3	Very high	8 Å²	8	88.1 Å²	88.1	3%	0.031	45%	0.448	C	S	.	.			trans	-66.4	132.3	178.1	-175.1	-97	0	0	0	111.6	V204 Y206 M225 F227 F241 T242 P243 I245	V204-Y216 VanDerWaalsContact O-CB 3.26Å; V204-Y216 WeakPolarHBondContact O-CB 3.46Å; V204-Y216 PolarHBondContact O-N 2.96Å; Y206-Y216 HydrophobicContact CE1-CD2 4.48Å; Y216-M225 HydrophobicContact CD1-CB 3.7Å; Y216-M225 HydrophobicContact CD1-CG 4.04Å; Y216-M225 HydrophobicContact CE1-CB 4.16Å; Y216-M225 HydrophobicContact CE1-CG 4.14Å; Y216-M225 PolarHBondContact O-N 2.63Å; Y216-F227 AromaticContact CD1-CE2 3.74Å; Y216-F227 HydrophobicContact CD1-CE2 3.74Å; Y216-F227 AromaticContact CD1-CZ 3.42Å; Y216-F227 HydrophobicContact CD1-CZ 3.42Å; Y216-F227 VanDerWaalsContact CD1-CZ 3.42Å; Y216-F227 HydrophobicContact CE1-CE1 4.45Å; Y216-F227 HydrophobicContact CE1-CE2 4.34Å; Y216-F227 AromaticContact CE1-CZ 3.58Å; Y216-F227 HydrophobicContact CE1-CZ 3.58Å; Y216-F227 HydrophobicContact CG-CE2 4.42Å; Y216-F227 HydrophobicContact CG-CZ 4.31Å; Y216-F241 HydrophobicContact CE2-CB 4.06Å; Y216-T242 WeakPolarHBondContact OH-CA 3.37Å; Y216-T242 PolarHBondContact OH-N 3.17Å; Y216-T242 PolarHBondContact OH-O 2.79Å; Y216-T242 VanDerWaalsContact OH-O 3.08Å; Y216-P243 WeakPolarHBondContact CE2-O 3.49Å; Y216-P243 PolarHBondContact OH-O 2.94Å; Y216-I245 HydrophobicContact CD2-CD1 3.64Å; Y216-I245 HydrophobicContact CD2-CG1 3.58Å; Y216-I245 HydrophobicContact CE2-CD1 4.22Å; Y216-I245 HydrophobicContact CE2-CG1 3.81Å; Y216-I245 HydrophobicContact CG-CD1 4.33Å
217	K	93.3	Very high	92.2	Very high	86 Å²	86	85.6 Å²	85.6	37%	0.374	44%	0.438	S	S	.	.	B	Isolated β-bridge	trans	-132.7	150.4	179.3	-58.8	-171.6	-178.4	-167.4	0	110.1	D222	K217-D222 WeakPolarHBondContact CE-O 3.31Å; K217-D222 PolarHBondContact NZ-O 3.34Å
218	V	87.8	Confident	92.1	Very high	49 Å²	49	95.6 Å²	95.6	30%	0.297	48%	0.475	S	S	.	.			trans	-75.7	143.1	173.7	-178	0	0	0	0	109	G220 K221 M225	V218-G220 PolarHBondContact O-N 3.05Å; V218-K221 HydrophobicContact CB-CD 4.46Å; V218-K221 PolarHBondContact O-N 3.22Å; V218-M225 HydrophobicContact CG2-CB 4.27Å; V218-M225 HydrophobicContact CG2-CG 4.12Å; V218-M225 HydrophobicContact CG2-SD 3.59Å; V218-M225 VanDerWaalsContact CG2-SD 3.59Å
219	K	81.3	Confident	92	Very high	161 Å²	161	92.1 Å²	92.1	70%	0.7	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	124.2	176.6	-169.2	177.7	-178.9	-177.9	0	109.6	E100	E100-K219 IonicContact OE1-NZ 3.35Å
220	G	81.8	Confident	92.1	Very high	86 Å²	86	88.8 Å²	88.8	89%	0.887	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.1	9.1	179.6	0	0	0	0	0	115.9	V218	V218-G220 PolarHBondContact O-N 3.05Å
221	K	87.7	Confident	92.2	Very high	138 Å²	138	93.8 Å²	93.8	60%	0.6	47%	0.466	S	S	*	.			trans	-123.8	137	171.9	-64.7	-170.9	178.3	-172.8	0	111.1	V218	V218-K221 HydrophobicContact CB-CD 4.46Å; V218-K221 PolarHBondContact O-N 3.22Å
222	D	83.2	Confident	92.1	Very high	149 Å²	149	88.4 Å²	88.4	80%	0.797	45%	0.446	S	S	*	.			trans	-86.1	-11	177.4	-79.4	-29.5	0	0	0	113.9	K217	K217-D222 WeakPolarHBondContact CE-O 3.31Å; K217-D222 PolarHBondContact NZ-O 3.34Å
223	E	88.6	Confident	91.8	Very high	161 Å²	161	85.4 Å²	85.4	75%	0.752	43%	0.426	S	S	*	.	S	Bend	trans	-80.3	144.7	177.7	-64.3	-178.5	174.7	0	0	112.3	M225	E223-M225 PolarHBondContact O-N 2.9Å
224	D	91.4	Very high	91.5	Very high	58 Å²	58	87.1 Å²	87.1	31%	0.31	44%	0.44	S	S	.	.	B	Isolated β-bridge	trans	-63.5	131.4	173	-66.8	-16.1	0	0	0	110.8	K203 T215 I226	K203-D224 HydrophobicContact CD-CB 4.16Å; K203-D224 IonicContact NZ-OD2 3.44Å; K203-D224 PolarHBondContact NZ-OD2 2.93Å; T215-D224 HydrophobicContact CG2-CB 3.94Å; D224-I226 PolarHBondContact O-N 3.19Å
225	M	93.8	Very high	91.5	Very high	67 Å²	67	81.1 Å²	81.1	33%	0.33	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-72.8	128.3	175.9	-177.3	60.4	179	0	0	110.9	Y216 V218 E223 F227	Y216-M225 HydrophobicContact CD1-CB 3.7Å; Y216-M225 HydrophobicContact CD1-CG 4.04Å; Y216-M225 HydrophobicContact CE1-CB 4.16Å; Y216-M225 HydrophobicContact CE1-CG 4.14Å; Y216-M225 PolarHBondContact O-N 2.63Å; V218-M225 HydrophobicContact CG2-CB 4.27Å; V218-M225 HydrophobicContact CG2-CG 4.12Å; V218-M225 HydrophobicContact CG2-SD 3.59Å; V218-M225 VanDerWaalsContact CG2-SD 3.59Å; E223-M225 PolarHBondContact O-N 2.9Å; M225-F227 HydrophobicContact CB-CE2 4.35Å; M225-F227 HydrophobicContact CB-CZ 4.49Å; M225-F227 HydrophobicContact CE-CD1 4.39Å; M225-F227 HydrophobicContact CE-CE1 4.33Å; M225-F227 HydrophobicContact CG-CD1 4.49Å; M225-F227 HydrophobicContact CG-CD2 4.34Å; M225-F227 HydrophobicContact CG-CE1 4.07Å; M225-F227 HydrophobicContact CG-CE2 3.9Å; M225-F227 HydrophobicContact CG-CZ 3.76Å
226	I	95.3	Very high	91.5	Very high	93 Å²	93	82.3 Å²	82.3	48%	0.477	44%	0.436	S	S	.	.			trans	-106.1	115.4	172.7	-58.4	175	0	0	0	108.5	K203 D224	K203-I226 HydrophobicContact CG-CG1 4.18Å; D224-I226 PolarHBondContact O-N 3.19Å
227	F	96.3	Very high	91.5	Very high	6 Å²	6	83.3 Å²	83.3	3%	0.026	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	144.6	178	-64.6	-83.8	0	0	0	111.1	S201 Y202 V204 Y216 M225 N239 F241	S201-F227 WeakPolarHBondContact CA-O 3.36Å; S201-F227 VanDerWaalsContact CB-O 3.3Å; S201-F227 WeakPolarHBondContact CB-O 3.39Å; Y202-F227 HydrophobicContact CD1-CB 4.29Å; Y202-F227 HydrophobicContact CD2-CB 3.91Å; Y202-F227 HydrophobicContact CD2-CD2 4.1Å; Y202-F227 HydrophobicContact CD2-CG 4.34Å; Y202-F227 HydrophobicContact CE1-CB 3.9Å; Y202-F227 HydrophobicContact CE2-CB 3.47Å; Y202-F227 VanDerWaalsContact CE2-CB 3.47Å; Y202-F227 AromaticContact CE2-CD2 3.78Å; Y202-F227 HydrophobicContact CE2-CD2 3.78Å; Y202-F227 AromaticContact CE2-CG 3.75Å; Y202-F227 HydrophobicContact CE2-CG 3.75Å; Y202-F227 HydrophobicContact CG-CB 4.29Å; Y202-F227 VanDerWaalsContact CZ-CB 3.48Å; Y202-F227 PolarHBondContact N-O 3.01Å; Y202-F227 VanDerWaalsContact N-O 3.08Å; Y202-F227 PolarHBondContact O-N 3.1Å; V204-F227 HydrophobicContact CB-CE2 4.16Å; V204-F227 HydrophobicContact CG2-CD2 3.93Å; V204-F227 HydrophobicContact CG2-CE2 3.81Å; Y216-F227 AromaticContact CD1-CE2 3.74Å; Y216-F227 HydrophobicContact CD1-CE2 3.74Å; Y216-F227 AromaticContact CD1-CZ 3.42Å; Y216-F227 HydrophobicContact CD1-CZ 3.42Å; Y216-F227 VanDerWaalsContact CD1-CZ 3.42Å; Y216-F227 HydrophobicContact CE1-CE1 4.45Å; Y216-F227 HydrophobicContact CE1-CE2 4.34Å; Y216-F227 AromaticContact CE1-CZ 3.58Å; Y216-F227 HydrophobicContact CE1-CZ 3.58Å; Y216-F227 HydrophobicContact CG-CE2 4.42Å; Y216-F227 HydrophobicContact CG-CZ 4.31Å; M225-F227 HydrophobicContact CB-CE2 4.35Å; M225-F227 HydrophobicContact CB-CZ 4.49Å; M225-F227 HydrophobicContact CE-CD1 4.39Å; M225-F227 HydrophobicContact CE-CE1 4.33Å; M225-F227 HydrophobicContact CG-CD1 4.49Å; M225-F227 HydrophobicContact CG-CD2 4.34Å; M225-F227 HydrophobicContact CG-CE1 4.07Å; M225-F227 HydrophobicContact CG-CE2 3.9Å; M225-F227 HydrophobicContact CG-CZ 3.76Å; F227-N239 HydrophobicContact CD1-CB 3.74Å; F227-N239 HydrophobicContact CE1-CB 4.33Å; F227-F241 HydrophobicContact CD1-CE1 4.45Å; F227-F241 AromaticContact CE1-CD1 3.69Å; F227-F241 HydrophobicContact CE1-CD1 3.69Å; F227-F241 AromaticContact CE1-CE1 3.74Å; F227-F241 HydrophobicContact CE1-CE1 3.74Å; F227-F241 HydrophobicContact CE2-CD1 4.29Å; F227-F241 AromaticContact CE2-CE1 3.9Å; F227-F241 HydrophobicContact CE2-CE1 3.9Å; F227-F241 AromaticContact CZ-CD1 3.41Å; F227-F241 HydrophobicContact CZ-CD1 3.41Å; F227-F241 VanDerWaalsContact CZ-CD1 3.41Å; F227-F241 AromaticContact CZ-CE1 3.42Å; F227-F241 HydrophobicContact CZ-CE1 3.42Å; F227-F241 VanDerWaalsContact CZ-CE1 3.42Å
228	R	96.3	Very high	91.6	Very high	215 Å²	215	82.5 Å²	82.5	81%	0.811	45%	0.453	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.7	125.1	170.6	-66.3	-178.2	-178.5	178.4	0.8	108.8	N239	R228-N239 PolarHBondContact O-ND2 2.81Å
229	G	94.9	Very high	92	Very high	7 Å²	7	81.7 Å²	81.7	7%	0.072	45%	0.447	C	S	.	.			trans	-86.8	-139.2	178.9	0	0	0	0	0	112.7	V199 K200 S237	V199-G229 CarbonylContact O-C 3.56Å; V199-G229 WeakPolarHBondContact O-CA 3.3Å; K200-G229 WeakPolarHBondContact O-CA 3.27Å; K200-G229 PolarHBondContact O-N 2.98Å; G229-S237 WeakPolarHBondContact O-CB 3.5Å; G229-S237 PolarHBondContact O-OG 3.49Å
230	N	96.8	Very high	92.6	Very high	6 Å²	6	78 Å²	78	3%	0.032	44%	0.442	C	S	.	.			trans	-87.6	153.3	-177.3	-60	97.8	0	0	0	112.8	T187 Q188 Y198 V199 D232 A235	T187-N230 PolarHBondContact O-ND2 2.86Å; T187-N230 PolarHBondContact OG1-OD1 3.05Å; Q188-N230 WeakPolarHBondContact CA-ND2 3.19Å; Q188-N230 PolarHBondContact N-OD1 3.2Å; Y198-N230 HydrophobicContact CD2-CB 3.98Å; Y198-N230 VanDerWaalsContact CD2-O 3.25Å; Y198-N230 WeakPolarHBondContact CD2-O 3.49Å; Y198-N230 WeakPolarHBondContact CE2-O 3.5Å; Y198-N230 HydrophobicContact CG-CB 4.25Å; V199-N230 PolarHBondContact O-N 3.41Å; N230-D232 WeakPolarHBondContact CB-O 3.5Å; N230-A235 PolarHBondContact ND2-O 3.14Å
231	V	94.1	Very high	93.1	Very high	127 Å²	127	74 Å²	74	77%	0.77	40%	0.4	S	S	*	.	S	Bend	trans	-100.1	-21.1	171.9	-175.5	0	0	0	0	111.5	Y198	Y198-V231 PolarHBondContact OH-O 2.75Å
232	D	92.8	Very high	93.2	Very high	65 Å²	65	71.7 Å²	71.7	35%	0.348	40%	0.397	S	S	.	.	S	Bend	trans	-141.3	-172.5	178	68.6	46.4	0	0	0	111.7	Y198 N230 N234 A235	Y198-D232 VanDerWaalsContact CD1-C 3.46Å; Y198-D232 WeakPolarHBondContact CD1-O 3.42Å; N230-D232 WeakPolarHBondContact CB-O 3.5Å; D232-N234 PolarHBondContact OD1-N 2.77Å; D232-A235 WeakPolarHBondContact OD1-CB 3.16Å; D232-A235 PolarHBondContact OD1-N 3Å; D232-A235 VanDerWaalsContact OD2-CB 3.3Å; D232-A235 WeakPolarHBondContact OD2-CB 3.42Å
233	N	89.3	Confident	93.5	Very high	26 Å²	26	67.2 Å²	67.2	14%	0.139	38%	0.377	C	S	.	.	S	Bend	trans	-90.3	-8.6	-177.9	63.4	-77.7	0	0	0	116	G189 A190 P196 R264	G189-N233 CarbonylContact C-O 3.56Å; A190-N233 PolarHBondContact N-O 2.79Å; A190-N233 WeakPolarHBondContact O-CB 3.25Å; P196-N233 HydrophobicContact CB-CB 3.77Å; N233-R264 PolarHBondContact O-NH2 2.95Å
234	N	90.7	Very high	93.8	Very high	98 Å²	98	61.3 Å²	61.3	52%	0.524	35%	0.352	S	S	.	.	S	Bend	trans	-129.5	-32.1	-167.7	-78.7	-20.1	0	0	0	114.1	Q188 D232 P236	Q188-N234 WeakPolarHBondContact CG-O 3.47Å; Q188-N234 PolarHBondContact NE2-O 2.89Å; D232-N234 PolarHBondContact OD1-N 2.77Å; N234-P236 WeakPolarHBondContact O-CD 3.29Å
235	A	94.6	Very high	93.9	Very high	45 Å²	45	58.7 Å²	58.7	37%	0.372	34%	0.338	S	S	.	.	S	Bend	trans	-70.7	125.3	177.3	0	0	0	0	0	109.9	N230 D232	N230-A235 PolarHBondContact ND2-O 3.14Å; D232-A235 WeakPolarHBondContact OD1-CB 3.16Å; D232-A235 PolarHBondContact OD1-N 3Å; D232-A235 VanDerWaalsContact OD2-CB 3.3Å; D232-A235 WeakPolarHBondContact OD2-CB 3.42Å
236	P	95.8	Very high	94	Very high	77 Å²	77	59.3 Å²	59.3	50%	0.5	34%	0.34	S	S	.	.			trans	-66.9	135.8	171	28.4	-32.5	0	0	0	110.1	L152 I186 T187 N234	L152-P236 HydrophobicContact CD1-CB 4.35Å; I186-P236 HydrophobicContact CG2-CB 3.66Å; T187-P236 CarbonylContact O-C 3.58Å; T187-P236 WeakPolarHBondContact O-CA 3.4Å; N234-P236 WeakPolarHBondContact O-CD 3.29Å
237	S	96.4	Very high	94	Very high	30 Å²	30	54.9 Å²	54.9	21%	0.21	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	118.4	174	-179.4	0	0	0	0	108.7	I186 T187 G229	I186-S237 CarbonylContact C-O 3.53Å; I186-S237 WeakPolarHBondContact CA-O 3.49Å; T187-S237 PolarHBondContact N-O 2.77Å; T187-S237 PolarHBondContact O-N 2.95Å; T187-S237 PolarHBondContact OG1-O 2.87Å; G229-S237 WeakPolarHBondContact O-CB 3.5Å; G229-S237 PolarHBondContact O-OG 3.49Å
238	A	95.9	Very high	94	Very high	68 Å²	68	57 Å²	57	56%	0.562	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102	132.8	-178.6	0	0	0	0	0	110.6	I186	I186-A238 HydrophobicContact CG1-CB 4.06Å
239	N	95.3	Very high	94.1	Very high	33 Å²	33	47.8 Å²	47.8	18%	0.176	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	133.8	169.3	-70.5	-86.4	0	0	0	109.7	G184 L185 Y202 F227 R228	G184-N239 CarbonylContact C-O 3.31Å; G184-N239 WeakPolarHBondContact CA-O 3.24Å; L185-N239 PolarHBondContact N-O 2.61Å; L185-N239 PolarHBondContact O-N 3.13Å; Y202-N239 PolarHBondContact OH-ND2 3.02Å; F227-N239 HydrophobicContact CD1-CB 3.74Å; F227-N239 HydrophobicContact CE1-CB 4.33Å; R228-N239 PolarHBondContact O-ND2 2.81Å
240	S	93.9	Very high	94.3	Very high	84 Å²	84	47.5 Å²	47.5	59%	0.587	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.3	152.1	174.4	-52.3	0	0	0	0	111.1	T183	T183-S240 CarbonylContact O-C 3.05Å; T183-S240 WeakPolarHBondContact O-CA 3.48Å
241	F	93.1	Very high	94.3	Very high	1 Å²	1	48.6 Å²	48.6	0%	0.004	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	118.4	175.9	-55.9	-35	0	0	0	108.9	V182 T183 L185 V204 Y216 F227 P243 I245	V182-F241 HydrophobicContact CG1-CD2 4.12Å; V182-F241 HydrophobicContact CG1-CE2 3.86Å; T183-F241 PolarHBondContact O-N 2.81Å; L185-F241 HydrophobicContact CB-CE2 4.42Å; L185-F241 HydrophobicContact CB-CZ 3.77Å; V204-F241 HydrophobicContact CG1-CZ 4.25Å; V204-F241 HydrophobicContact CG2-CE1 4.12Å; V204-F241 HydrophobicContact CG2-CZ 3.99Å; Y216-F241 HydrophobicContact CE2-CB 4.06Å; F227-F241 HydrophobicContact CD1-CE1 4.45Å; F227-F241 AromaticContact CE1-CD1 3.69Å; F227-F241 HydrophobicContact CE1-CD1 3.69Å; F227-F241 AromaticContact CE1-CE1 3.74Å; F227-F241 HydrophobicContact CE1-CE1 3.74Å; F227-F241 HydrophobicContact CE2-CD1 4.29Å; F227-F241 AromaticContact CE2-CE1 3.9Å; F227-F241 HydrophobicContact CE2-CE1 3.9Å; F227-F241 AromaticContact CZ-CD1 3.41Å; F227-F241 HydrophobicContact CZ-CD1 3.41Å; F227-F241 VanDerWaalsContact CZ-CD1 3.41Å; F227-F241 AromaticContact CZ-CE1 3.42Å; F227-F241 HydrophobicContact CZ-CE1 3.42Å; F227-F241 VanDerWaalsContact CZ-CE1 3.42Å; F241-P243 CarbonylContact C-O 3.56Å; F241-P243 CarbonylContact O-C 3.51Å; F241-I245 HydrophobicContact CD2-CD1 3.69Å; F241-I245 HydrophobicContact CD2-CG1 4.1Å; F241-I245 HydrophobicContact CE2-CD1 3.88Å; F241-I245 HydrophobicContact CG-CD1 4.14Å; F241-I245 HydrophobicContact CG-CG1 4.43Å; F241-I245 HydrophobicContact CZ-CD1 4.47Å
242	T	89.4	Confident	94.5	Very high	89 Å²	89	42.6 Å²	42.6	55%	0.546	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	100.4	174	-53.9	0	0	0	0	109.5	Y216	Y216-T242 WeakPolarHBondContact OH-CA 3.37Å; Y216-T242 PolarHBondContact OH-N 3.17Å; Y216-T242 PolarHBondContact OH-O 2.79Å; Y216-T242 VanDerWaalsContact OH-O 3.08Å
243	P	90	Very high	94.8	Very high	56 Å²	56	42 Å²	42	36%	0.364	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	cis	-73.5	159.4	9.8	31.8	-35.9	0	0	0	113.5	Y216 F241	Y216-P243 WeakPolarHBondContact CE2-O 3.49Å; Y216-P243 PolarHBondContact OH-O 2.94Å; F241-P243 CarbonylContact C-O 3.56Å; F241-P243 CarbonylContact O-C 3.51Å
244	P	92.9	Very high	95.1	Very high	36 Å²	36	41.1 Å²	41.1	23%	0.234	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	154.3	172.8	30.1	-36.1	0	0	0	111.5	R181 T183	R181-P244 HydrophobicContact CG-CB 4.14Å; T183-P244 HydrophobicContact CG2-CB 4.09Å
245	I	94.7	Very high	95.4	Very high	3 Å²	3	39.9 Å²	39.9	2%	0.015	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	129.9	179.6	-63.5	172.9	0	0	0	109.3	R181 V182 V204 Y206 Y216 F241 A247	R181-I245 CarbonylContact C-O 3.55Å; R181-I245 WeakPolarHBondContact CA-O 3.25Å; V182-I245 HydrophobicContact CB-CB 4.27Å; V182-I245 PolarHBondContact N-O 2.93Å; V182-I245 PolarHBondContact O-N 2.87Å; V204-I245 HydrophobicContact CG1-CD1 3.92Å; Y206-I245 HydrophobicContact CD1-CD1 4.06Å; Y206-I245 HydrophobicContact CD1-CG1 4.14Å; Y206-I245 HydrophobicContact CD1-CG2 3.79Å; Y206-I245 HydrophobicContact CD2-CG2 3.83Å; Y206-I245 HydrophobicContact CE1-CG1 4.44Å; Y206-I245 HydrophobicContact CE1-CG2 4.47Å; Y206-I245 HydrophobicContact CE2-CG2 4.47Å; Y206-I245 HydrophobicContact CG-CG2 3.43Å; Y206-I245 VanDerWaalsContact CG-CG2 3.43Å; Y216-I245 HydrophobicContact CD2-CD1 3.64Å; Y216-I245 HydrophobicContact CD2-CG1 3.58Å; Y216-I245 HydrophobicContact CE2-CD1 4.22Å; Y216-I245 HydrophobicContact CE2-CG1 3.81Å; Y216-I245 HydrophobicContact CG-CD1 4.33Å; F241-I245 HydrophobicContact CD2-CD1 3.69Å; F241-I245 HydrophobicContact CD2-CG1 4.1Å; F241-I245 HydrophobicContact CE2-CD1 3.88Å; F241-I245 HydrophobicContact CG-CD1 4.14Å; F241-I245 HydrophobicContact CG-CG1 4.43Å; F241-I245 HydrophobicContact CZ-CD1 4.47Å; I245-A247 HydrophobicContact CG2-CB 3.97Å
246	E	95	Very high	95.4	Very high	81 Å²	81	41.4 Å²	41.4	38%	0.379	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	100.4	172.2	-66.3	-175.8	176.3	0	0	110.4	R179 M180 L272	R179-E246 IonicContact CZ-OE2 3.36Å; R179-E246 IonicContact NH2-OE2 3.61Å; R179-E246 PolarHBondContact NH2-OE2 3.32Å; R179-E246 VanDerWaalsContact NH2-OE2 3.13Å; M180-E246 WeakPolarHBondContact O-CA 3.43Å; E246-L272 HydrophobicContact CB-CD2 4.39Å; E246-L272 HydrophobicContact CG-CD2 3.95Å
247	A	96.6	Very high	95.4	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	164.1	-173.9	0	0	0	0	0	112.4	M180 Y206 D208 I245	M180-A247 PolarHBondContact N-O 2.86Å; M180-A247 PolarHBondContact O-N 2.86Å; M180-A247 VanDerWaalsContact O-N 3.1Å; Y206-A247 HydrophobicContact CD2-CB 3.92Å; Y206-A247 HydrophobicContact CG-CB 4.29Å; D208-A247 WeakPolarHBondContact OD1-CA 3.19Å; I245-A247 HydrophobicContact CG2-CB 3.97Å
248	Q	96.6	Very high	95.3	Very high	49 Å²	49	42.9 Å²	42.9	23%	0.229	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	-36.7	169.1	177.4	175.1	-22.1	0	0	112.4	N175 L176 R178 S207	N175-Q248 PolarHBondContact OD1-NE2 2.99Å; L176-Q248 VanDerWaalsContact CB-O 3.27Å; L176-Q248 WeakPolarHBondContact CB-O 3.48Å; L176-Q248 WeakPolarHBondContact CG-O 3.23Å; L176-Q248 PolarHBondContact N-O 2.92Å; R178-Q248 WeakPolarHBondContact O-CA 3.37Å; S207-Q248 PolarHBondContact O-N 2.93Å
249	F	98.3	Very high	95.2	Very high	23 Å²	23	47.4 Å²	47.4	10%	0.101	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	133.5	-177.1	-59.1	-92.6	0	0	0	110.3	I174 N175 Y206 S207 W213	I174-F249 WeakPolarHBondContact O-CA 3.5Å; N175-F249 HydrophobicContact CB-CD1 3.81Å; N175-F249 HydrophobicContact CB-CE1 3.62Å; N175-F249 WeakPolarHBondContact OD1-CE1 3.37Å; Y206-F249 VanDerWaalsContact CA-O 3.24Å; Y206-F249 WeakPolarHBondContact CA-O 3.3Å; S207-F249 PolarHBondContact N-O 3.09Å; S207-F249 WeakPolarHBondContact O-CB 3.08Å; S207-F249 WeakPolarHBondContact O-CD2 3.42Å; S207-F249 PolarHBondContact O-N 3.11Å; W213-F249 HydrophobicContact CH2-CB 3.71Å; W213-F249 HydrophobicContact CZ2-CB 4.38Å; W213-F249 HydrophobicContact CZ3-CB 4.3Å
250	V	98.3	Very high	95	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	134.1	172.4	-179.1	0	0	0	0	108.4	Q173 I174 L176 V182 V204 L267	Q173-V250 CarbonylContact C-O 3.2Å; Q173-V250 WeakPolarHBondContact CA-O 3.32Å; I174-V250 PolarHBondContact N-O 2.7Å; I174-V250 PolarHBondContact O-N 2.9Å; L176-V250 HydrophobicContact CD1-CG2 4.39Å; V182-V250 HydrophobicContact CG2-CG2 3.99Å; V204-V250 HydrophobicContact CG1-CG1 3.89Å; V250-L267 HydrophobicContact CB-CD1 4.4Å; V250-L267 HydrophobicContact CG1-CD2 4.12Å
251	R	97.9	Very high	95.1	Very high	30 Å²	30	45.4 Å²	45.4	11%	0.113	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	132.5	178.8	-171.3	-176.1	-77.8	174	-3.1	110.3	W171 I172 Q173 V204 A205 W213 Y253	W171-R251 HydrophobicContact CB-CG 3.78Å; W171-R251 HydrophobicContact CD2-CG 4.27Å; W171-R251 HydrophobicContact CE3-CG 4.07Å; W171-R251 HydrophobicContact CG-CG 4.18Å; I172-R251 CarbonylContact O-C 3.6Å; I172-R251 VanDerWaalsContact O-CA 3.27Å; I172-R251 WeakPolarHBondContact O-CA 3.3Å; I172-R251 WeakPolarHBondContact O-CG 3.28Å; Q173-R251 HydrophobicContact CB-CB 4.46Å; Q173-R251 HydrophobicContact CB-CG 4.28Å; V204-R251 CarbonylContact C-O 3.59Å; V204-R251 WeakPolarHBondContact CA-O 3.4Å; A205-R251 PolarHBondContact N-O 3.18Å; A205-R251 PolarHBondContact O-N 2.77Å; W213-R251 VanDerWaalsContact CE2-CZ 3.4Å; W213-R251 HydrophobicContact CE3-CB 3.99Å; W213-R251 HydrophobicContact CH2-CB 3.65Å; W213-R251 HydrophobicContact CZ3-CB 3.29Å; W213-R251 HydrophobicContact CZ3-CG 4.42Å; R251-Y253 HydrophobicContact CB-CE2 4.07Å; R251-Y253 VanDerWaalsContact CD-CE2 3.43Å; R251-Y253 WeakPolarHBondContact CD-OH 3.3Å; R251-Y253 HydrophobicContact CG-CD2 4.22Å; R251-Y253 HydrophobicContact CG-CE2 3.65Å; R251-Y253 PolarHBondContact NH1-OH 3.04Å
252	V	98.1	Very high	95.2	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	130.1	179.5	-176.9	0	0	0	0	108.5	W171 I172 L185 Y202 P254 L263 M265	W171-V252 VanDerWaalsContact CA-O 3.3Å; W171-V252 WeakPolarHBondContact CA-O 3.39Å; I172-V252 HydrophobicContact CG2-CB 3.93Å; I172-V252 PolarHBondContact N-O 2.84Å; I172-V252 PolarHBondContact O-N 2.71Å; L185-V252 HydrophobicContact CD2-CG1 4.23Å; L185-V252 HydrophobicContact CD2-CG2 3.73Å; Y202-V252 HydrophobicContact CD2-CG1 3.81Å; Y202-V252 HydrophobicContact CG-CG1 4.05Å; V252-P254 WeakPolarHBondContact O-CD 3.26Å; V252-L263 HydrophobicContact CG1-CD2 4.33Å; V252-M265 HydrophobicContact CB-CE 4.07Å; V252-M265 HydrophobicContact CG1-CE 4.3Å; V252-M265 HydrophobicContact CG2-CE 3.83Å; V252-M265 HydrophobicContact CG2-SD 4.47Å
253	Y	97.3	Very high	95.5	Very high	54 Å²	54	41.1 Å²	41.1	21%	0.212	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	95.5	-178.3	-69.2	-91.9	0	0	0	109.8	W171 Y202 K203 A205 R251 Q255	W171-Y253 HydrophobicContact CB-CD1 3.69Å; W171-Y253 HydrophobicContact CB-CE1 3.67Å; W171-Y253 HydrophobicContact CB-CG 4.29Å; W171-Y253 HydrophobicContact CG-CE1 4.09Å; Y202-Y253 CarbonylContact C-O 3.57Å; Y202-Y253 VanDerWaalsContact CA-O 3.26Å; Y202-Y253 WeakPolarHBondContact CA-O 3.38Å; Y202-Y253 WeakPolarHBondContact CB-O 3.36Å; K203-Y253 PolarHBondContact N-O 3.32Å; K203-Y253 PolarHBondContact O-N 3.49Å; A205-Y253 HydrophobicContact CB-CD2 4.31Å; A205-Y253 HydrophobicContact CB-CE2 3.67Å; R251-Y253 HydrophobicContact CB-CE2 4.07Å; R251-Y253 VanDerWaalsContact CD-CE2 3.43Å; R251-Y253 WeakPolarHBondContact CD-OH 3.3Å; R251-Y253 HydrophobicContact CG-CD2 4.22Å; R251-Y253 HydrophobicContact CG-CE2 3.65Å; R251-Y253 PolarHBondContact NH1-OH 3.04Å; Y253-Q255 PolarHBondContact O-N 2.89Å; Y253-Q255 PolarHBondContact O-NE2 3.44Å
254	P	97.3	Very high	95.9	Very high	6 Å²	6	39 Å²	39	4%	0.039	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-52.7	130.3	170.3	-25.3	35.5	0	0	0	111.1	W161 P170 V199 V252 C261	W161-P254 HydrophobicContact CH2-CG 4.32Å; W161-P254 HydrophobicContact CZ3-CG 4.16Å; P170-P254 HydrophobicContact CG-CB 4.36Å; P170-P254 VanDerWaalsContact O-CD 3.31Å; P170-P254 WeakPolarHBondContact O-CD 3.15Å; V199-P254 HydrophobicContact CG1-CB 3.89Å; V199-P254 HydrophobicContact CG2-CB 3.94Å; V199-P254 HydrophobicContact CG2-CG 4.06Å; V252-P254 WeakPolarHBondContact O-CD 3.26Å; P254-C261 HydrophobicContact CB-CB 4.06Å; P254-C261 HydrophobicContact CG-CB 4.36Å
255	Q	95.3	Very high	96.1	Very high	73 Å²	73	37.2 Å²	37.2	34%	0.341	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	-54.4	179.1	-60.7	-58.9	-69.7	0	0	110.6	S201 K203 Y253	S201-Q255 PolarHBondContact O-N 3.37Å; K203-Q255 HydrophobicContact CG-CG 3.96Å; Y253-Q255 PolarHBondContact O-N 2.89Å; Y253-Q255 PolarHBondContact O-NE2 3.44Å
256	V	96.2	Very high	96.3	Very high	76 Å²	76	37.3 Å²	37.3	46%	0.461	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	129.9	178.8	-176.4	0	0	0	0	108.7	K200 S201	K200-V256 WeakPolarHBondContact CA-O 3.49Å; K200-V256 HydrophobicContact CB-CB 4.28Å; K200-V256 HydrophobicContact CB-CG1 4.18Å; K200-V256 WeakPolarHBondContact CB-O 3.36Å; K200-V256 HydrophobicContact CD-CG1 4.17Å; K200-V256 PolarHBondContact N-O 2.99Å; S201-V256 PolarHBondContact N-O 3.3Å; S201-V256 PolarHBondContact O-N 2.74Å; S201-V256 WeakPolarHBondContact OG-CB 3.49Å; S201-V256 WeakPolarHBondContact OG-CG2 3.13Å; S201-V256 PolarHBondContact OG-N 3.04Å
257	C	95.4	Very high	96.4	Very high	32 Å²	32	33.4 Å²	33.4	22%	0.216	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	149.1	-176.6	-55.5	0	0	0	0	110.6	Y198 C261	Y198-C257 WeakPolarHBondContact O-CA 3.42Å; C257-C261 HydrophobicContact CB-CB 3.98Å; C257-C261 WeakPolarHBondContact CB-SG 3.18Å; C257-C261 WeakPolarHBondContact SG-CA 3.25Å; C257-C261 WeakPolarHBondContact SG-CB 3.44Å; C257-C261 CovalentContact SG-SG 2.04Å; C257-C261 PolarHBondContact SG-SG 2.83Å
258	R	94.9	Very high	96.3	Very high	106 Å²	106	34.8 Å²	34.8	40%	0.4	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	116.5	167.4	-175.2	178.7	-176.7	167.1	-3.3	108.7	Y198 H260	Y198-R258 HydrophobicContact CD1-CB 4.25Å; Y198-R258 HydrophobicContact CD2-CB 4.21Å; Y198-R258 HydrophobicContact CE1-CB 4.06Å; Y198-R258 HydrophobicContact CE1-CG 4.22Å; Y198-R258 HydrophobicContact CE2-CB 4.01Å; Y198-R258 HydrophobicContact CG-CB 4.33Å; Y198-R258 PolarHBondContact O-N 3.35Å; Y198-R258 WeakPolarHBondContact OH-CD 3.47Å; Y198-R258 PolarHBondContact OH-NH1 2.7Å; R258-H260 PolarHBondContact O-N 3.26Å
259	R	92	Very high	96.1	Very high	163 Å²	163	32.6 Å²	32.6	62%	0.615	15%	0.15	S	C	*	.	S	Bend	trans	63.1	-73.7	-175.3	-63	-178.3	169.7	-154.3	8.9	112.8	S195 E197	S195-R259 PolarHBondContact OG-NH1 3.27Å; E197-R259 HydrophobicContact CG-CB 4.22Å
260	H	92.3	Very high	95.7	Very high	49 Å²	49	31.6 Å²	31.6	23%	0.227	15%	0.146	C	C	.	.	S	Bend	trans	-127	153	176.6	-60.8	-78.5	0	0	0	110.7	T162 E165 E197 R258 T262	T162-H260 HydrophobicContact CG2-CB 3.66Å; E165-H260 IonicContact OE1-CE1 3.48Å; E165-H260 PolarHBondContact OE1-CE1 3.42Å; E165-H260 VanDerWaalsContact OE1-CE1 3.3Å; E197-H260 IonicContact OE1-CD2 2.7Å; E197-H260 PolarHBondContact OE1-CD2 3.41Å; R258-H260 PolarHBondContact O-N 3.26Å; H260-T262 VanDerWaalsContact C-N 3.25Å; H260-T262 PolarHBondContact O-N 2.86Å
261	C	95.4	Very high	95.2	Very high	26 Å²	26	32.6 Å²	32.6	18%	0.176	15%	0.15	C	C	.	.			trans	-75.7	83.4	172.9	-61.5	0	0	0	0	109.5	T162 A163 P170 V199 P254 C257	T162-C261 WeakPolarHBondContact CA-O 3.46Å; A163-C261 HydrophobicContact CB-CB 4.22Å; A163-C261 PolarHBondContact N-O 2.84Å; A163-C261 VanDerWaalsContact N-O 3.14Å; P170-C261 HydrophobicContact CG-CB 4.47Å; V199-C261 HydrophobicContact CG2-CB 4.47Å; P254-C261 HydrophobicContact CB-CB 4.06Å; P254-C261 HydrophobicContact CG-CB 4.36Å; C257-C261 HydrophobicContact CB-CB 3.98Å; C257-C261 WeakPolarHBondContact CB-SG 3.18Å; C257-C261 WeakPolarHBondContact SG-CA 3.25Å; C257-C261 WeakPolarHBondContact SG-CB 3.44Å; C257-C261 CovalentContact SG-SG 2.04Å; C257-C261 PolarHBondContact SG-SG 2.83Å
262	T	95.8	Very high	94.6	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	130.5	-178.6	-59.5	0	0	0	0	110.1	W145 A160 W161 T162 A190 E197 Y198 H260	W145-T262 HydrophobicContact CE3-CG2 4.38Å; W145-T262 HydrophobicContact CZ3-CG2 4.23Å; A160-T262 HydrophobicContact CB-CG2 3.63Å; W161-T262 CarbonylContact O-C 3.59Å; W161-T262 VanDerWaalsContact O-CA 3.25Å; W161-T262 WeakPolarHBondContact O-CA 3.5Å; T162-T262 VanDerWaalsContact CG2-OG1 3.26Å; T162-T262 WeakPolarHBondContact CG2-OG1 3.08Å; T162-T262 WeakPolarHBondContact OG1-CG2 3.38Å; T162-T262 PolarHBondContact OG1-OG1 2.95Å; A190-T262 HydrophobicContact CB-CG2 3.64Å; E197-T262 HydrophobicContact CB-CG2 4.36Å; E197-T262 PolarHBondContact OE2-OG1 2.77Å; Y198-T262 WeakPolarHBondContact CA-O 3.48Å; H260-T262 VanDerWaalsContact C-N 3.25Å; H260-T262 PolarHBondContact O-N 2.86Å
263	L	96.3	Very high	93.7	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	132.2	-169	-170.5	58.8	0	0	0	112.7	A150 W161 I172 T187 V199 V252 M265	A150-L263 WeakPolarHBondContact CA-O 3.22Å; W161-L263 HydrophobicContact CE3-CB 4.09Å; W161-L263 HydrophobicContact CZ3-CB 4.49Å; W161-L263 HydrophobicContact CZ3-CD2 4.4Å; W161-L263 PolarHBondContact N-O 2.98Å; W161-L263 VanDerWaalsContact N-O 3.08Å; W161-L263 PolarHBondContact O-N 3.21Å; I172-L263 HydrophobicContact CG2-CD2 4.35Å; T187-L263 HydrophobicContact CG2-CD1 3.82Å; V199-L263 HydrophobicContact CG2-CB 4.27Å; V199-L263 HydrophobicContact CG2-CD1 4.39Å; V252-L263 HydrophobicContact CG1-CD2 4.33Å; L263-M265 HydrophobicContact CD2-CE 3.16Å; L263-M265 HydrophobicContact CG-CE 3.76Å
264	R	97.9	Very high	92.6	Very high	11 Å²	11	36.9 Å²	36.9	4%	0.042	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	143.8	158.8	-71.3	179.9	-74.6	175.8	1.1	107.5	R151 K154 N159 A160 T187 Q188 G189 N233	R151-R264 WeakPolarHBondContact O-CB 3.36Å; R151-R264 WeakPolarHBondContact O-CG 3.4Å; K154-R264 PolarHBondContact O-NH1 2.79Å; N159-R264 VanDerWaalsContact O-CD 3.24Å; N159-R264 WeakPolarHBondContact O-CD 3.25Å; N159-R264 VanDerWaalsContact O-CG 3.28Å; N159-R264 WeakPolarHBondContact O-CG 3.43Å; A160-R264 HydrophobicContact CB-CG 3.69Å; T187-R264 CarbonylContact C-O 3.58Å; T187-R264 WeakPolarHBondContact CA-O 3.45Å; Q188-R264 HydrophobicContact CB-CB 4.06Å; Q188-R264 PolarHBondContact N-O 3.34Å; Q188-R264 PolarHBondContact O-N 3.3Å; G189-R264 PolarHBondContact O-NE 3.44Å; G189-R264 PolarHBondContact O-NH2 3.16Å; N233-R264 PolarHBondContact O-NH2 2.95Å
265	M	97.1	Very high	91.9	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	163	-177.7	62.2	168.3	59.8	0	0	114.5	M120 A150 L152 I172 I174 L185 I186 V252 L263	M120-M265 WeakPolarHBondContact CB-O 3.11Å; M120-M265 HydrophobicContact CE-CG 3.99Å; M120-M265 HydrophobicContact CE-SD 4.26Å; A150-M265 HydrophobicContact CB-CG 4.46Å; A150-M265 VanDerWaalsContact O-CG 3.28Å; A150-M265 WeakPolarHBondContact O-CG 3.17Å; A150-M265 PolarHBondContact O-N 3.46Å; L152-M265 PolarHBondContact N-O 2.87Å; I172-M265 HydrophobicContact CG2-CE 3.65Å; I172-M265 HydrophobicContact CG2-SD 4.48Å; I174-M265 HydrophobicContact CD1-SD 3.77Å; L185-M265 HydrophobicContact CD1-CB 3.95Å; L185-M265 HydrophobicContact CD1-CE 4.3Å; L185-M265 HydrophobicContact CD1-CG 4.48Å; L185-M265 HydrophobicContact CD1-SD 3.96Å; I186-M265 CarbonylContact O-C 3.54Å; I186-M265 WeakPolarHBondContact O-CA 3.26Å; I186-M265 VanDerWaalsContact O-CB 3.25Å; I186-M265 WeakPolarHBondContact O-CB 3.2Å; V252-M265 HydrophobicContact CB-CE 4.07Å; V252-M265 HydrophobicContact CG1-CE 4.3Å; V252-M265 HydrophobicContact CG2-CE 3.83Å; V252-M265 HydrophobicContact CG2-SD 4.47Å; L263-M265 HydrophobicContact CD2-CE 3.16Å; L263-M265 HydrophobicContact CG-CE 3.76Å
266	E	97.6	Very high	91.4	Very high	4 Å²	4	34 Å²	34	2%	0.019	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	132.5	166.8	179.9	61.5	-95.1	0	0	108.8	P117 G119 M120 E121 L152 I186 L268	P117-E266 HydrophobicContact CB-CG 3.87Å; G119-E266 PolarHBondContact N-OE1 2.78Å; G119-E266 VanDerWaalsContact N-OE1 3.08Å; M120-E266 WeakPolarHBondContact CB-OE1 3.41Å; M120-E266 WeakPolarHBondContact CG-OE1 3.43Å; M120-E266 PolarHBondContact N-OE1 3.44Å; M120-E266 PolarHBondContact N-OE2 2.82Å; M120-E266 VanDerWaalsContact N-OE2 3.08Å; E121-E266 WeakPolarHBondContact CB-OE2 3.08Å; E121-E266 PolarHBondContact N-OE2 2.8Å; L152-E266 HydrophobicContact CB-CB 3.94Å; L152-E266 HydrophobicContact CD2-CB 3.92Å; L152-E266 HydrophobicContact CG-CB 4.49Å; I186-E266 HydrophobicContact CB-CB 4.39Å; I186-E266 PolarHBondContact N-O 2.02Å; I186-E266 PolarHBondContact O-N 3.19Å; E266-L268 HydrophobicContact CG-CD2 4.29Å
267	L	97.1	Very high	90.9	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	136.8	173.4	-74.5	169.7	0	0	0	108.6	L118 I174 L176 V182 L185 V250	L118-L267 HydrophobicContact CB-CB 4.2Å; L118-L267 HydrophobicContact CD1-CB 3.92Å; L118-L267 HydrophobicContact CG-CB 4.28Å; L118-L267 PolarHBondContact N-O 3.36Å; I174-L267 HydrophobicContact CB-CD1 3.89Å; I174-L267 HydrophobicContact CD1-CD1 4.42Å; I174-L267 HydrophobicContact CG1-CD1 4.01Å; I174-L267 HydrophobicContact CG2-CD1 3.83Å; L176-L267 HydrophobicContact CD2-CD1 4.17Å; V182-L267 HydrophobicContact CG1-CD2 4.02Å; L185-L267 HydrophobicContact CD1-CD2 3.66Å; L185-L267 HydrophobicContact CD1-CG 4.26Å; V250-L267 HydrophobicContact CB-CD1 4.4Å; V250-L267 HydrophobicContact CG1-CD2 4.12Å
268	L	95.1	Very high	90.7	Very high	29 Å²	29	34.4 Å²	34.4	15%	0.152	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	140.6	176.4	-56.1	179.9	0	0	0	109.9	G116 V182 T183 G184 I186 E266	G116-L268 CarbonylContact O-C 3.55Å; G116-L268 VanDerWaalsContact O-CA 3.31Å; G116-L268 WeakPolarHBondContact O-CA 3.42Å; V182-L268 CarbonylContact C-O 3.29Å; V182-L268 WeakPolarHBondContact CA-O 3.48Å; V182-L268 WeakPolarHBondContact CG1-O 3.38Å; T183-L268 PolarHBondContact N-O 2.8Å; T183-L268 PolarHBondContact OG1-O 3.44Å; G184-L268 PolarHBondContact N-O 2.7Å; G184-L268 PolarHBondContact O-N 2.75Å; I186-L268 HydrophobicContact CD1-CD1 4.02Å; I186-L268 HydrophobicContact CD1-CD2 3.97Å; I186-L268 HydrophobicContact CD1-CG 4.28Å; I186-L268 HydrophobicContact CG1-CD1 3.87Å; I186-L268 HydrophobicContact CG1-CD2 4.32Å; I186-L268 HydrophobicContact CG1-CG 4.12Å; E266-L268 HydrophobicContact CG-CD2 4.29Å
269	G	92.7	Very high	90.6	Very high	3 Å²	3	31.2 Å²	31.2	3%	0.031	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	162.4	-161.6	-179.4	0	0	0	0	0	113	G116 L118 R181	G116-G269 PolarHBondContact N-O 3.42Å; G116-G269 PolarHBondContact O-N 3.07Å; G116-G269 VanDerWaalsContact O-O 3.05Å; L118-G269 VanDerWaalsContact CD2-C 3.48Å; R181-G269 CarbonylContact O-C 3.52Å; R181-G269 WeakPolarHBondContact O-CA 3.24Å
270	C	89.8	Confident	90.6	Very high	2 Å²	2	23.5 Å²	23.5	1%	0.014	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159	178.2	-180	69.2	0	0	0	0	110.9	M106 C114 R181	M106-C270 PolarHBondContact SD-SG 2.86Å; C114-C270 HydrophobicContact CB-CB 3.94Å; C114-C270 WeakPolarHBondContact CB-SG 3.38Å; C114-C270 WeakPolarHBondContact SG-CB 2.92Å; C114-C270 PolarHBondContact SG-N 2.84Å; C114-C270 CovalentContact SG-SG 2.02Å; C114-C270 PolarHBondContact SG-SG 2.9Å; R181-C270 PolarHBondContact N-O 2.86Å; R181-C270 PolarHBondContact O-N 3.17Å
271	E	87.6	Confident	90.8	Very high	21 Å²	21	21.2 Å²	21.2	10%	0.098	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	151.2	172.1	-64.1	-172	-155.4	0	0	111.2	R178 M180 T273 G274 S276 K400	R178-E271 IonicContact NH1-OE1 2.77Å; R178-E271 IonicContact NH1-OE2 3.31Å; R178-E271 PolarHBondContact NH1-OE2 2.95Å; M180-E271 HydrophobicContact CE-CB 4.49Å; M180-E271 HydrophobicContact CE-CG 3.65Å; M180-E271 HydrophobicContact SD-CB 4.49Å; M180-E271 HydrophobicContact SD-CG 3.83Å; E271-T273 PolarHBondContact O-N 2.97Å; E271-T273 VanDerWaalsContact O-N 3.09Å; E271-G274 PolarHBondContact O-N 3.14Å; E271-S276 PolarHBondContact N-OG 2.62Å; E271-K400 WeakPolarHBondContact OE1-CE 3.35Å; E271-K400 IonicContact OE1-NZ 3.66Å; E271-K400 PolarHBondContact OE1-NZ 3.29Å
272	L	85.6	Confident	90.7	Very high	68 Å²	68	25.4 Å²	25.4	36%	0.356	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-20.6	-178	-68.5	172.7	0	0	0	114	M106 R179 R181 E246 G274	M106-L272 WeakPolarHBondContact CE-O 3.29Å; R179-L272 HydrophobicContact CB-CD1 3.99Å; R179-L272 HydrophobicContact CG-CD1 3.94Å; R181-L272 HydrophobicContact CB-CD2 4.11Å; E246-L272 HydrophobicContact CB-CD2 4.39Å; E246-L272 HydrophobicContact CG-CD2 3.95Å; L272-G274 VanDerWaalsContact C-N 3.28Å
273	T	78.6	Confident	90.5	Very high	106 Å²	106	28.9 Å²	28.9	65%	0.65	16%	0.161	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-17.2	174.7	56.8	0	0	0	0	112.7	E271 C275	E271-T273 PolarHBondContact O-N 2.97Å; E271-T273 VanDerWaalsContact O-N 3.09Å; T273-C275 PolarHBondContact O-N 3.47Å; T273-C275 VanDerWaalsContact O-N 3.16Å
274	G	74.7	Confident	90.4	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	18%	0.175	C	C	.	.	S	Bend	trans	72.6	-3.9	178	0	0	0	0	0	116.5	M106 Y112 E271 L272 S276	M106-G274 VanDerWaalsContact CE-N 3.28Å; M106-G274 WeakPolarHBondContact SD-CA 3.44Å; Y112-G274 WeakPolarHBondContact CB-O 3.22Å; E271-G274 PolarHBondContact O-N 3.14Å; L272-G274 VanDerWaalsContact C-N 3.28Å; G274-S276 PolarHBondContact O-N 2.92Å
275	C	83	Confident	90.2	Very high	7 Å²	7	36.5 Å²	36.5	5%	0.047	20%	0.204	C	C	.	.			trans	-101.4	53.9	-178	-170.7	0	0	0	0	110.6	T273 T345 G431 C432	T273-C275 PolarHBondContact O-N 3.47Å; T273-C275 VanDerWaalsContact O-N 3.16Å; C275-T345 HydrophobicContact CB-CG2 4.04Å; C275-T345 VanDerWaalsContact O-CB 3.3Å; C275-T345 WeakPolarHBondContact O-CB 3.36Å; C275-T345 WeakPolarHBondContact O-CG2 3.49Å; C275-T345 PolarHBondContact O-OG1 2.84Å; C275-G431 VanDerWaalsContact SG-C 3.59Å; C275-C432 HydrophobicContact CB-CB 4Å; C275-C432 WeakPolarHBondContact CB-SG 3.27Å; C275-C432 WeakPolarHBondContact SG-CB 3.31Å; C275-C432 PolarHBondContact SG-N 3.06Å; C275-C432 CovalentContact SG-SG 2.03Å; C275-C432 PolarHBondContact SG-SG 3.1Å
276	S	84.6	Confident	90.1	Very high	12 Å²	12	36.8 Å²	36.8	8%	0.084	21%	0.206	C	C	.	.			trans	-127.2	19.9	-177.4	65	0	0	0	0	113.2	E271 G274	E271-S276 PolarHBondContact N-OG 2.62Å; G274-S276 PolarHBondContact O-N 2.92Å
277	E	85.1	Confident	90.1	Very high	44 Å²	44	40.8 Å²	40.8	21%	0.206	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	148.7	-177.1	-68.1	-56.1	110.9	0	0	111.2	K113 L279 L430 G431	K113-E277 WeakPolarHBondContact O-CG 3.15Å; E277-L279 PolarHBondContact O-N 3.47Å; E277-L430 VanDerWaalsContact O-CA 3.31Å; E277-L430 WeakPolarHBondContact O-CA 3.16Å; E277-G431 PolarHBondContact O-N 2.93Å
278	P	91.1	Very high	90	Very high	71 Å²	71	44.6 Å²	44.6	46%	0.461	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	126.5	175.1	28.2	-33.5	0	0	0	110.5	G280 E428 L430	P278-G280 PolarHBondContact O-N 3.03Å; P278-E428 HydrophobicContact CB-CG 3.83Å; P278-L430 HydrophobicContact CB-CD2 4.37Å
279	L	92.7	Very high	90.1	Very high	39 Å²	39	51 Å²	51	20%	0.204	27%	0.268	C	S	.	.			trans	-76.6	-10.4	178.1	-63.2	-177.6	0	0	0	112.8	E277 L338 T342 I429	E277-L279 PolarHBondContact O-N 3.47Å; L279-L338 HydrophobicContact CD1-CD1 3.96Å; L279-L338 HydrophobicContact CD1-CD2 3.94Å; L279-T342 HydrophobicContact CD1-CG2 3.79Å; L279-T342 HydrophobicContact CD2-CG2 4.01Å; L279-I429 HydrophobicContact CD1-CB 4.23Å; L279-I429 HydrophobicContact CD1-CG2 3.7Å; L279-I429 HydrophobicContact CG-CG2 4.5Å; L279-I429 PolarHBondContact N-O 2.55Å
280	G	93	Very high	90.3	Very high	1 Å²	1	51.4 Å²	51.4	1%	0.01	27%	0.27	C	S	.	.	S	Bend	trans	112.9	32.2	158.8	0	0	0	0	0	115.5	P278 S283 G284 H285 V286 E428	P278-G280 PolarHBondContact O-N 3.03Å; G280-S283 WeakPolarHBondContact CA-OG 3.27Å; G280-G284 PolarHBondContact O-N 3.04Å; G280-G284 VanDerWaalsContact O-N 3.11Å; G280-H285 PolarHBondContact O-N 3.4Å; G280-H285 VanDerWaalsContact O-N 3.08Å; G280-V286 PolarHBondContact O-N 2.82Å; G280-V286 VanDerWaalsContact O-N 3.13Å; G280-E428 PolarHBondContact N-OE1 3.46Å
281	M	95.6	Very high	90.7	Very high	1 Å²	1	51.5 Å²	51.5	1%	0.005	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-48	165.9	-64.1	-64.9	-73.2	0	0	110.2	V286 V291 R313 V336 V427 E428 I429	M281-V286 HydrophobicContact SD-CB 3.98Å; M281-V286 HydrophobicContact SD-CG1 3.76Å; M281-V286 HydrophobicContact SD-CG2 4.16Å; M281-V291 HydrophobicContact CE-CG1 4.24Å; M281-V291 HydrophobicContact CE-CG2 3.92Å; M281-V291 HydrophobicContact SD-CG2 4.25Å; M281-R313 WeakPolarHBondContact O-CB 3.46Å; M281-R313 WeakPolarHBondContact O-CD 3.47Å; M281-R313 WeakPolarHBondContact O-CG 3.27Å; M281-R313 PolarHBondContact O-NH1 2.73Å; M281-V336 HydrophobicContact CE-CG2 3.83Å; M281-V336 HydrophobicContact SD-CG1 3.89Å; M281-V336 HydrophobicContact SD-CG2 3.93Å; M281-V427 WeakPolarHBondContact CB-O 3.37Å; M281-V427 HydrophobicContact CE-CG2 3.65Å; M281-E428 VanDerWaalsContact CB-OE1 3.32Å; M281-E428 WeakPolarHBondContact CB-OE1 3.37Å; M281-E428 PolarHBondContact N-OE1 2.99Å; M281-E428 PolarHBondContact N-OE2 2.98Å; M281-I429 HydrophobicContact CG-CG1 4.39Å
282	K	94.1	Very high	91.2	Very high	115 Å²	115	53.1 Å²	53.1	50%	0.5	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-43.1	179.4	-179.6	170.9	175.3	175.6	0	112.7	G284 L314 D315 E428	K282-G284 PolarHBondContact O-N 2.79Å; K282-L314 HydrophobicContact CB-CB 4.26Å; K282-L314 HydrophobicContact CD-CB 4.44Å; K282-L314 WeakPolarHBondContact CG-O 3.4Å; K282-D315 HydrophobicContact CD-CB 4.41Å; K282-D315 IonicContact NZ-OD2 3.39Å; K282-D315 PolarHBondContact NZ-OD2 3.43Å; K282-E428 WeakPolarHBondContact CB-OE2 3.34Å; K282-E428 PolarHBondContact N-OE2 3.1Å
283	S	91.8	Very high	91.8	Very high	73 Å²	73	51 Å²	51	51%	0.51	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-16.3	-175.9	62.9	0	0	0	0	113.3	G280 H285	G280-S283 WeakPolarHBondContact CA-OG 3.27Å; S283-H285 WeakPolarHBondContact CB-ND1 3.36Å; S283-H285 PolarHBondContact OG-ND1 2.85Å
284	G	92.6	Very high	92.7	Very high	28 Å²	28	48 Å²	48	29%	0.289	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.3	13.4	-177	0	0	0	0	0	114	G280 K282 Q287	G280-G284 PolarHBondContact O-N 3.04Å; G280-G284 VanDerWaalsContact O-N 3.11Å; K282-G284 PolarHBondContact O-N 2.79Å; G284-Q287 PolarHBondContact O-NE2 2.76Å
285	H	93.7	Very high	93.8	Very high	142 Å²	142	49 Å²	49	66%	0.657	26%	0.264	S	S	*	.			trans	-69.1	-42	172.4	-70.3	56.8	0	0	0	110.5	G280 S283 Q287	G280-H285 PolarHBondContact O-N 3.4Å; G280-H285 VanDerWaalsContact O-N 3.08Å; S283-H285 WeakPolarHBondContact CB-ND1 3.36Å; S283-H285 PolarHBondContact OG-ND1 2.85Å; H285-Q287 PolarHBondContact O-N 3.08Å; H285-Q287 PolarHBondContact O-NE2 2.74Å; H285-Q287 VanDerWaalsContact O-NE2 3.09Å
286	V	96.2	Very high	94.4	Very high	6 Å²	6	52.3 Å²	52.3	4%	0.036	28%	0.281	C	S	.	.	S	Bend	trans	-70.5	117.9	164.5	179.4	0	0	0	0	107.5	G280 M281 Q290 V291 R313 V336	G280-V286 PolarHBondContact O-N 2.82Å; G280-V286 VanDerWaalsContact O-N 3.13Å; M281-V286 HydrophobicContact SD-CB 3.98Å; M281-V286 HydrophobicContact SD-CG1 3.76Å; M281-V286 HydrophobicContact SD-CG2 4.16Å; V286-Q290 HydrophobicContact CG1-CB 3.79Å; V286-V291 HydrophobicContact CG1-CG2 3.92Å; V286-R313 PolarHBondContact O-NH1 2.81Å; V286-R313 PolarHBondContact O-NH2 3.22Å; V286-V336 HydrophobicContact CG1-CG1 3.92Å
287	Q	97	Very high	94.8	Very high	89 Å²	89	53.5 Å²	53.5	42%	0.416	29%	0.285	S	S	.	.			trans	-80.7	161	-178.4	-59.5	-52.9	-45.2	0	0	112.3	G284 H285 Y289 Q290	G284-Q287 PolarHBondContact O-NE2 2.76Å; H285-Q287 PolarHBondContact O-N 3.08Å; H285-Q287 PolarHBondContact O-NE2 2.74Å; H285-Q287 VanDerWaalsContact O-NE2 3.09Å; Q287-Y289 VanDerWaalsContact C-N 3.26Å; Q287-Y289 HydrophobicContact CB-CD1 3.49Å; Q287-Y289 VanDerWaalsContact CB-CD1 3.49Å; Q287-Y289 HydrophobicContact CB-CE1 3.28Å; Q287-Y289 HydrophobicContact CB-CG 4.45Å; Q287-Y289 HydrophobicContact CG-CD1 4.34Å; Q287-Y289 HydrophobicContact CG-CE1 3.69Å; Q287-Y289 PolarHBondContact O-N 2.82Å; Q287-Q290 HydrophobicContact CB-CG 4.48Å; Q287-Q290 WeakPolarHBondContact O-CB 3.19Å; Q287-Q290 PolarHBondContact O-N 3.43Å
288	D	96.1	Very high	95.1	Very high	80 Å²	80	57.2 Å²	57.2	43%	0.428	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-60.2	-34.5	-176.9	-75.8	-0.1	0	0	0	112.6	Q290 V291 R313	D288-Q290 PolarHBondContact O-N 3.31Å; D288-V291 PolarHBondContact O-N 3.01Å; D288-V291 VanDerWaalsContact O-N 3.15Å; D288-R313 IonicContact OD1-CZ 3.95Å; D288-R313 IonicContact OD1-NE 3.96Å; D288-R313 PolarHBondContact OD1-NE 2.74Å; D288-R313 IonicContact OD1-NH2 2.71Å; D288-R313 PolarHBondContact OD1-NH2 3.1Å
289	Y	96.6	Very high	94.8	Very high	162 Å²	162	54.3 Å²	54.3	64%	0.635	28%	0.278	S	S	*	.	G	3₁₀ helix	trans	-66.8	-20.3	177.7	73.4	-97.9	0	0	0	113.6	Q287 V291 L339	Q287-Y289 VanDerWaalsContact C-N 3.26Å; Q287-Y289 HydrophobicContact CB-CD1 3.49Å; Q287-Y289 VanDerWaalsContact CB-CD1 3.49Å; Q287-Y289 HydrophobicContact CB-CE1 3.28Å; Q287-Y289 HydrophobicContact CB-CG 4.45Å; Q287-Y289 HydrophobicContact CG-CD1 4.34Å; Q287-Y289 HydrophobicContact CG-CE1 3.69Å; Q287-Y289 PolarHBondContact O-N 2.82Å; Y289-V291 VanDerWaalsContact C-N 3.27Å; Y289-L339 HydrophobicContact CE2-CD2 4.43Å
290	Q	97.8	Very high	94.3	Very high	12 Å²	12	58.8 Å²	58.8	6%	0.056	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-80.2	-11.2	177.8	-65.5	174.1	-112.2	0	0	112.2	V286 Q287 D288 V336 D337 L339	V286-Q290 HydrophobicContact CG1-CB 3.79Å; Q287-Q290 HydrophobicContact CB-CG 4.48Å; Q287-Q290 WeakPolarHBondContact O-CB 3.19Å; Q287-Q290 PolarHBondContact O-N 3.43Å; D288-Q290 PolarHBondContact O-N 3.31Å; Q290-V336 WeakPolarHBondContact O-CA 3.42Å; Q290-D337 HydrophobicContact CB-CB 4.45Å; Q290-D337 WeakPolarHBondContact CB-O 3.43Å; Q290-D337 PolarHBondContact NE2-O 3.01Å; Q290-D337 PolarHBondContact O-N 2.98Å; Q290-L339 HydrophobicContact CG-CD2 4.16Å; Q290-L339 HydrophobicContact CG-CG 4.35Å
291	V	98.1	Very high	93.9	Very high	5 Å²	5	65.6 Å²	65.6	3%	0.03	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	114.6	-176.1	-165.9	0	0	0	0	109.2	M281 V286 D288 Y289 P309 L334 Q335 V336	M281-V291 HydrophobicContact CE-CG1 4.24Å; M281-V291 HydrophobicContact CE-CG2 3.92Å; M281-V291 HydrophobicContact SD-CG2 4.25Å; V286-V291 HydrophobicContact CG1-CG2 3.92Å; D288-V291 PolarHBondContact O-N 3.01Å; D288-V291 VanDerWaalsContact O-N 3.15Å; Y289-V291 VanDerWaalsContact C-N 3.27Å; V291-P309 HydrophobicContact CG1-CB 4.02Å; V291-P309 WeakPolarHBondContact CG1-O 3.4Å; V291-L334 HydrophobicContact CG1-CD1 3.85Å; V291-L334 HydrophobicContact CG1-CG 4.5Å; V291-Q335 WeakPolarHBondContact CA-O 3.23Å; V291-V336 HydrophobicContact CG1-CG2 4.35Å
292	T	97.9	Very high	93.3	Very high	55 Å²	55	69.6 Å²	69.6	34%	0.337	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	161.6	-179.8	60.3	0	0	0	0	110.3	Q335	T292-Q335 PolarHBondContact N-O 2.81Å; T292-Q335 PolarHBondContact O-N 3.34Å
293	A	97.9	Very high	92.7	Very high	22 Å²	22	69.6 Å²	69.6	18%	0.182	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	162.3	179.2	0	0	0	0	0	111.4	P309 W323 W333 L334	A293-P309 HydrophobicContact CB-CB 3.91Å; A293-P309 HydrophobicContact CB-CG 4.32Å; A293-W323 HydrophobicContact CB-CD2 4.34Å; A293-W323 VanDerWaalsContact CB-CE2 3.5Å; A293-W323 HydrophobicContact CB-CZ2 3.74Å; A293-W323 VanDerWaalsContact CB-NE1 3.26Å; A293-W333 VanDerWaalsContact CA-CZ3 3.49Å; A293-W333 VanDerWaalsContact CA-O 3.3Å; A293-W333 WeakPolarHBondContact CA-O 3.46Å; A293-W333 WeakPolarHBondContact CB-O 3.24Å; A293-L334 HydrophobicContact CB-CD1 4.14Å
294	S	97.3	Very high	92.3	Very high	43 Å²	43	72.7 Å²	72.7	30%	0.301	37%	0.37	S	S	.	.	S	Bend	trans	-63.9	-39.2	176.2	52.8	0	0	0	0	113.5	Q332 W333	S294-Q332 VanDerWaalsContact OG-CA 3.27Å; S294-Q332 WeakPolarHBondContact OG-CA 3.19Å; S294-Q332 PolarHBondContact OG-OE1 3.49Å; S294-W333 PolarHBondContact N-O 3.15Å; S294-W333 PolarHBondContact OG-N 2.94Å; S294-W333 PolarHBondContact OG-O 2.82Å
295	S	97.1	Very high	92	Very high	22 Å²	22	72.4 Å²	72.4	15%	0.154	36%	0.361	C	S	.	.			trans	-157.7	166	-179.1	70.8	0	0	0	0	111.1	W323 G326 Q332	S295-W323 PolarHBondContact O-NE1 2.87Å; S295-G326 PolarHBondContact OG-N 2.74Å; S295-Q332 PolarHBondContact OG-OE1 3.02Å
296	I	96.2	Very high	92	Very high	77 Å²	77	66.5 Å²	66.5	40%	0.395	34%	0.335	S	S	.	.			trans	-135.3	135.1	-174.9	-57.5	175.3	0	0	0	109.5	T306 P309	I296-T306 HydrophobicContact CG2-CG2 3.5Å; I296-T306 VanDerWaalsContact CG2-CG2 3.5Å; I296-P309 HydrophobicContact CD1-CG 4.38Å
297	F	93.4	Very high	91.9	Very high	37 Å²	37	66.2 Å²	66.2	16%	0.162	33%	0.334	C	S	.	.			trans	-93.1	141.2	173.1	-176.6	-109.4	0	0	0	112	W307 T324	F297-W307 AromaticContact CD1-CD1 3.86Å; F297-W307 PolarHBondContact O-N 2.69Å; F297-T324 HydrophobicContact CB-CG2 3.74Å; F297-T324 WeakPolarHBondContact CB-O 3.08Å; F297-T324 HydrophobicContact CD1-CG2 4.14Å; F297-T324 HydrophobicContact CG-CG2 4.14Å; F297-T324 PolarHBondContact N-O 3.23Å
298	R	91.3	Very high	91.9	Very high	121 Å²	121	66.2 Å²	66.2	46%	0.457	33%	0.333	S	S	.	.	B	Isolated β-bridge	trans	-118.4	118.9	172.7	-62.3	-172.1	-172.2	-179.7	8	109.5	L300 N301 D303 T306	R298-L300 PolarHBondContact O-N 2.72Å; R298-N301 PolarHBondContact O-N 2.81Å; R298-D303 IonicContact CZ-OD1 3.41Å; R298-D303 IonicContact NE-OD1 3.84Å; R298-D303 IonicContact NH1-OD1 3.27Å; R298-D303 PolarHBondContact NH1-OD1 3.17Å; R298-T306 HydrophobicContact CG-CG2 3.93Å
299	T	84.4	Confident	91.9	Very high	11 Å²	11	63.2 Å²	63.2	7%	0.067	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-71.7	128.6	174.7	-53.9	0	0	0	0	109	N301 M302 F305 W307 D354 F355	T299-N301 PolarHBondContact O-N 2.76Å; T299-N301 VanDerWaalsContact O-N 3.1Å; T299-M302 PolarHBondContact O-N 2.99Å; T299-F305 PolarHBondContact N-O 3.31Å; T299-W307 PolarHBondContact OG1-NE1 3.05Å; T299-D354 PolarHBondContact OG1-OD2 2.86Å; T299-D354 VanDerWaalsContact OG1-OD2 3.14Å; T299-F355 HydrophobicContact CG2-CD2 4.04Å; T299-F355 HydrophobicContact CG2-CE2 3.67Å
300	L	83	Confident	91.8	Very high	132 Å²	132	55.8 Å²	55.8	69%	0.691	29%	0.291	S	S	*	.	G	3₁₀ helix	trans	57.2	20.5	-177.7	-56.4	170.9	0	0	0	114.8	R298 M302	R298-L300 PolarHBondContact O-N 2.72Å; L300-M302 HydrophobicContact CB-CG 4.22Å; L300-M302 HydrophobicContact CB-SD 4.37Å; L300-M302 PolarHBondContact O-N 2.97Å; L300-M302 VanDerWaalsContact O-N 3.14Å
301	N	83.2	Confident	91.7	Very high	145 Å²	145	58.2 Å²	58.2	78%	0.775	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	53.6	27.2	-173.2	-65.9	-20.7	0	0	0	114.1	R298 T299	R298-N301 PolarHBondContact O-N 2.81Å; T299-N301 PolarHBondContact O-N 2.76Å; T299-N301 VanDerWaalsContact O-N 3.1Å
302	M	83.4	Confident	91.7	Very high	84 Å²	84	58 Å²	58	41%	0.414	30%	0.3	S	S	.	.			trans	-99.9	129.8	176.8	-66	-179.9	70.5	0	0	110.5	T299 L300 M304 F305	T299-M302 PolarHBondContact O-N 2.99Å; L300-M302 HydrophobicContact CB-CG 4.22Å; L300-M302 HydrophobicContact CB-SD 4.37Å; L300-M302 PolarHBondContact O-N 2.97Å; L300-M302 VanDerWaalsContact O-N 3.14Å; M302-M304 HydrophobicContact CE-CE 4.31Å; M302-M304 PolarHBondContact O-N 2.91Å; M302-F305 HydrophobicContact CB-CD2 3.97Å; M302-F305 HydrophobicContact CE-CD2 4.44Å; M302-F305 HydrophobicContact CE-CE2 4.2Å; M302-F305 CarbonylContact O-C 3.56Å; M302-F305 PolarHBondContact O-N 2.9Å; M302-F305 HydrophobicContact SD-CD2 3.96Å; M302-F305 HydrophobicContact SD-CE2 3.99Å
303	D	81.9	Confident	91.7	Very high	115 Å²	115	56.3 Å²	56.3	62%	0.615	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-60.2	-33.6	-178	-66.9	-25.5	0	0	0	112.7	R298 F305 T306	R298-D303 IonicContact CZ-OD1 3.41Å; R298-D303 IonicContact NE-OD1 3.84Å; R298-D303 IonicContact NH1-OD1 3.27Å; R298-D303 PolarHBondContact NH1-OD1 3.17Å; D303-F305 PolarHBondContact O-N 3.08Å; D303-F305 VanDerWaalsContact O-N 3.17Å; D303-T306 WeakPolarHBondContact CA-OG1 3.35Å; D303-T306 WeakPolarHBondContact O-CB 3.19Å; D303-T306 PolarHBondContact O-N 2.86Å; D303-T306 PolarHBondContact O-OG1 3.08Å
304	M	82.6	Confident	91.5	Very high	138 Å²	138	55.8 Å²	55.8	68%	0.68	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-62.5	-20.1	175.5	-173	174.8	64	0	0	113.7	M302	M302-M304 HydrophobicContact CE-CE 4.31Å; M302-M304 PolarHBondContact O-N 2.91Å
305	F	87.8	Confident	91.3	Very high	23 Å²	23	55.9 Å²	55.9	10%	0.101	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-114.1	35.5	178.3	-59.4	-63.9	0	0	0	112.6	T299 M302 D303 K319 V320 F355	T299-F305 PolarHBondContact N-O 3.31Å; M302-F305 HydrophobicContact CB-CD2 3.97Å; M302-F305 HydrophobicContact CE-CD2 4.44Å; M302-F305 HydrophobicContact CE-CE2 4.2Å; M302-F305 CarbonylContact O-C 3.56Å; M302-F305 PolarHBondContact O-N 2.9Å; M302-F305 HydrophobicContact SD-CD2 3.96Å; M302-F305 HydrophobicContact SD-CE2 3.99Å; D303-F305 PolarHBondContact O-N 3.08Å; D303-F305 VanDerWaalsContact O-N 3.17Å; F305-K319 HydrophobicContact CE1-CB 4.27Å; F305-K319 HydrophobicContact CE1-CD 3.84Å; F305-V320 HydrophobicContact CB-CG2 4.27Å; F305-V320 HydrophobicContact CD1-CG2 4.16Å; F305-F355 HydrophobicContact CE1-CZ 4.48Å
306	T	92.7	Very high	91.1	Very high	17 Å²	17	59 Å²	59	10%	0.104	29%	0.289	C	S	.	.	B	Isolated β-bridge	trans	-85.8	124.4	177.4	-55.5	0	0	0	0	111.6	I296 R298 D303 E308 V320	I296-T306 HydrophobicContact CG2-CG2 3.5Å; I296-T306 VanDerWaalsContact CG2-CG2 3.5Å; R298-T306 HydrophobicContact CG-CG2 3.93Å; D303-T306 WeakPolarHBondContact CA-OG1 3.35Å; D303-T306 WeakPolarHBondContact O-CB 3.19Å; D303-T306 PolarHBondContact O-N 2.86Å; D303-T306 PolarHBondContact O-OG1 3.08Å; T306-E308 VanDerWaalsContact C-N 3.28Å; T306-E308 HydrophobicContact CG2-CG 3.59Å; T306-E308 PolarHBondContact O-N 2.74Å; T306-V320 WeakPolarHBondContact O-CG1 3.44Å
307	W	94.8	Very high	90.9	Very high	1 Å²	1	62.3 Å²	62.3	0%	0.004	30%	0.303	C	S	.	.			trans	-85.6	62.2	-179.2	-64.9	74.5	0	0	0	112.1	F297 T299 V320 A322 T324 A352 D354 T424	F297-W307 AromaticContact CD1-CD1 3.86Å; F297-W307 PolarHBondContact O-N 2.69Å; T299-W307 PolarHBondContact OG1-NE1 3.05Å; W307-V320 HydrophobicContact CB-CG1 4.23Å; W307-V320 HydrophobicContact CD2-CG1 3.73Å; W307-V320 HydrophobicContact CE3-CG1 4.01Å; W307-V320 HydrophobicContact CG-CG1 3.84Å; W307-A322 HydrophobicContact CE3-CB 3.9Å; W307-A322 HydrophobicContact CZ3-CB 3.77Å; W307-T324 PolarHBondContact O-N 3.15Å; W307-A352 HydrophobicContact CH2-CB 4.41Å; W307-A352 HydrophobicContact CZ3-CB 3.93Å; W307-D354 HydrophobicContact CH2-CB 4.08Å; W307-D354 HydrophobicContact CZ2-CB 3.61Å; W307-D354 WeakPolarHBondContact CZ2-OD1 3.48Å; W307-T424 HydrophobicContact CE3-CG2 4.42Å; W307-T424 HydrophobicContact CZ3-CG2 4.25Å
308	E	95.7	Very high	90.7	Very high	88 Å²	88	63.1 Å²	63.1	41%	0.411	32%	0.323	S	S	.	.			trans	-62.5	151	-174.3	-60.5	179.8	132	0	0	113.8	T306 G310 K311	T306-E308 VanDerWaalsContact C-N 3.28Å; T306-E308 HydrophobicContact CG2-CG 3.59Å; T306-E308 PolarHBondContact O-N 2.74Å; E308-G310 VanDerWaalsContact C-N 3.28Å; E308-G310 PolarHBondContact O-N 3.09Å; E308-K311 HydrophobicContact CB-CG 4.34Å; E308-K311 WeakPolarHBondContact O-CB 3.21Å; E308-K311 PolarHBondContact O-N 3.32Å
309	P	96.9	Very high	90.5	Very high	17 Å²	17	65.1 Å²	65.1	11%	0.11	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-55.7	-38.1	176.7	20.9	-32.5	0	0	0	113.5	V291 A293 I296 K311 A312 L334	V291-P309 HydrophobicContact CG1-CB 4.02Å; V291-P309 WeakPolarHBondContact CG1-O 3.4Å; A293-P309 HydrophobicContact CB-CB 3.91Å; A293-P309 HydrophobicContact CB-CG 4.32Å; I296-P309 HydrophobicContact CD1-CG 4.38Å; P309-K311 PolarHBondContact O-N 3.38Å; P309-A312 WeakPolarHBondContact O-CB 3.37Å; P309-A312 PolarHBondContact O-N 3.39Å; P309-L334 HydrophobicContact CB-CD1 3.92Å
310	G	95.4	Very high	90.8	Very high	7 Å²	7	65.8 Å²	65.8	7%	0.072	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-61.3	-15.9	176.9	0	0	0	0	0	114.7	E308 R313	E308-G310 VanDerWaalsContact C-N 3.28Å; E308-G310 PolarHBondContact O-N 3.09Å; G310-R313 PolarHBondContact O-NE 3.48Å
311	K	95.6	Very high	91.3	Very high	62 Å²	62	60.1 Å²	60.1	27%	0.27	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-86	-5.9	174.4	-52.8	-54.3	-179.9	-153.3	0	113.4	E308 P309 R313 N321 A322	E308-K311 HydrophobicContact CB-CG 4.34Å; E308-K311 WeakPolarHBondContact O-CB 3.21Å; E308-K311 PolarHBondContact O-N 3.32Å; P309-K311 PolarHBondContact O-N 3.38Å; K311-R313 PolarHBondContact O-N 2.89Å; K311-N321 CarbonylContact O-C 3.5Å; K311-A322 WeakPolarHBondContact O-CA 3.28Å
312	A	97.3	Very high	91.9	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.272	C	S	.	.			trans	-71.1	43.9	-178.7	0	0	0	0	0	114	P309 W323 L334 V427	P309-A312 WeakPolarHBondContact O-CB 3.37Å; P309-A312 PolarHBondContact O-N 3.39Å; A312-W323 HydrophobicContact CB-CB 3.65Å; A312-L334 HydrophobicContact CB-CD1 4.2Å; A312-L334 HydrophobicContact CB-CD2 3.65Å; A312-V427 WeakPolarHBondContact O-CG2 3.37Å; A312-V427 PolarHBondContact O-N 2.76Å
313	R	97.1	Very high	92.6	Very high	21 Å²	21	49.2 Å²	49.2	8%	0.079	25%	0.252	C	S	.	.	B	Isolated β-bridge	trans	-104.5	134.4	-173.3	-59.5	178	179	-86.9	2.5	109.8	M281 V286 D288 G310 K311 D315 K316 R426	M281-R313 WeakPolarHBondContact O-CB 3.46Å; M281-R313 WeakPolarHBondContact O-CD 3.47Å; M281-R313 WeakPolarHBondContact O-CG 3.27Å; M281-R313 PolarHBondContact O-NH1 2.73Å; V286-R313 PolarHBondContact O-NH1 2.81Å; V286-R313 PolarHBondContact O-NH2 3.22Å; D288-R313 IonicContact OD1-CZ 3.95Å; D288-R313 IonicContact OD1-NE 3.96Å; D288-R313 PolarHBondContact OD1-NE 2.74Å; D288-R313 IonicContact OD1-NH2 2.71Å; D288-R313 PolarHBondContact OD1-NH2 3.1Å; G310-R313 PolarHBondContact O-NE 3.48Å; K311-R313 PolarHBondContact O-N 2.89Å; R313-D315 PolarHBondContact O-N 2.87Å; R313-K316 HydrophobicContact CB-CB 4.32Å; R313-K316 WeakPolarHBondContact O-CB 3.26Å; R313-K316 PolarHBondContact O-N 3.48Å; R313-R426 WeakPolarHBondContact O-CB 3.33Å; R313-R426 WeakPolarHBondContact O-CD 3.4Å; R313-R426 WeakPolarHBondContact O-CG 3.49Å
314	L	94.7	Very high	93.4	Very high	10 Å²	10	43.8 Å²	43.8	5%	0.052	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.7	137.8	179	-166.9	73.5	0	0	0	111.7	K282 K316 I348 Q350 V427 E428	K282-L314 HydrophobicContact CB-CB 4.26Å; K282-L314 HydrophobicContact CD-CB 4.44Å; K282-L314 WeakPolarHBondContact CG-O 3.4Å; L314-K316 PolarHBondContact O-N 2.84Å; L314-I348 HydrophobicContact CD1-CG2 3.79Å; L314-I348 HydrophobicContact CD2-CB 4.41Å; L314-I348 HydrophobicContact CD2-CD1 4.38Å; L314-I348 HydrophobicContact CD2-CG2 4.01Å; L314-Q350 HydrophobicContact CD1-CB 3.76Å; L314-V427 PolarHBondContact N-O 3.3Å; L314-V427 VanDerWaalsContact N-O 3.11Å; L314-E428 HydrophobicContact CB-CB 3.9Å; L314-E428 HydrophobicContact CD2-CB 3.84Å; L314-E428 HydrophobicContact CG-CB 4.4Å
315	D	92.9	Very high	94.1	Very high	45 Å²	45	37.2 Å²	37.2	24%	0.241	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.1	12.4	-179	-63.1	-38.2	0	0	0	116.5	K282 R313 Q317 Q350 H398	K282-D315 HydrophobicContact CD-CB 4.41Å; K282-D315 IonicContact NZ-OD2 3.39Å; K282-D315 PolarHBondContact NZ-OD2 3.43Å; R313-D315 PolarHBondContact O-N 2.87Å; D315-Q317 PolarHBondContact O-N 2.92Å; D315-Q317 PolarHBondContact O-NE2 2.84Å; D315-Q350 PolarHBondContact OD1-NE2 2.79Å; D315-H398 VanDerWaalsContact CG-NE2 3.31Å; D315-H398 IonicContact OD1-CD2 2.8Å; D315-H398 IonicContact OD1-CE1 3.76Å; D315-H398 PolarHBondContact OD1-CE1 3.04Å; D315-H398 IonicContact OD1-NE2 3.66Å; D315-H398 PolarHBondContact OD1-NE2 3.08Å; D315-H398 IonicContact OD2-CE1 3.59Å; D315-H398 PolarHBondContact OD2-CE1 2.99Å; D315-H398 VanDerWaalsContact OD2-CE1 3.27Å; D315-H398 IonicContact OD2-NE2 2.87Å; D315-H398 PolarHBondContact OD2-NE2 2.89Å
316	K	93.3	Very high	94.4	Very high	87 Å²	87	37.1 Å²	37.1	38%	0.378	20%	0.196	S	C	.	.			trans	-55.9	133.8	174.5	-171.6	70.2	177.5	174	0	109.7	R313 L314 N321 R426	R313-K316 HydrophobicContact CB-CB 4.32Å; R313-K316 WeakPolarHBondContact O-CB 3.26Å; R313-K316 PolarHBondContact O-N 3.48Å; L314-K316 PolarHBondContact O-N 2.84Å; K316-N321 HydrophobicContact CB-CB 4.32Å; K316-N321 WeakPolarHBondContact CB-O 3.16Å; K316-N321 HydrophobicContact CG-CB 4.12Å; K316-N321 WeakPolarHBondContact O-CB 3.35Å; K316-N321 PolarHBondContact O-ND2 2.86Å; K316-R426 PolarHBondContact O-NH1 2.99Å; K316-R426 VanDerWaalsContact O-NH1 3.07Å
317	Q	90.9	Very high	94.5	Very high	147 Å²	147	42.2 Å²	42.2	69%	0.687	22%	0.219	S	C	*	.			trans	-109.7	155	177.3	-57.1	-59.6	-48.1	0	0	109.6	D315	D315-Q317 PolarHBondContact O-N 2.92Å; D315-Q317 PolarHBondContact O-NE2 2.84Å
318	G	88.8	Confident	94.5	Very high	55 Å²	55	44.6 Å²	44.6	57%	0.567	24%	0.236	S	C	*	.	S	Bend	trans	139	176.3	-179.4	0	0	0	0	0	111.6
319	K	87.1	Confident	94.5	Very high	163 Å²	163	43.1 Å²	43.1	71%	0.709	23%	0.23	S	C	*	.	S	Bend	trans	-68.1	-41.5	174.2	-65.1	-174.4	-177.7	178.1	0	111.5	F305	F305-K319 HydrophobicContact CE1-CB 4.27Å; F305-K319 HydrophobicContact CE1-CD 3.84Å
320	V	90.8	Very high	94.5	Very high	24 Å²	24	47.3 Å²	47.3	15%	0.145	25%	0.249	C	C	.	.	S	Bend	trans	-113	120.6	165.9	-176.5	0	0	0	0	107.1	F305 T306 W307	F305-V320 HydrophobicContact CB-CG2 4.27Å; F305-V320 HydrophobicContact CD1-CG2 4.16Å; T306-V320 WeakPolarHBondContact O-CG1 3.44Å; W307-V320 HydrophobicContact CB-CG1 4.23Å; W307-V320 HydrophobicContact CD2-CG1 3.73Å; W307-V320 HydrophobicContact CE3-CG1 4.01Å; W307-V320 HydrophobicContact CG-CG1 3.84Å
321	N	94.1	Very high	94.5	Very high	14 Å²	14	51.1 Å²	51.1	8%	0.075	27%	0.274	C	S	.	.			trans	-142.1	13.7	-170.8	70.4	-31.5	0	0	0	113.4	K311 K316 R426	K311-N321 CarbonylContact O-C 3.5Å; K316-N321 HydrophobicContact CB-CB 4.32Å; K316-N321 WeakPolarHBondContact CB-O 3.16Å; K316-N321 HydrophobicContact CG-CB 4.12Å; K316-N321 WeakPolarHBondContact O-CB 3.35Å; K316-N321 PolarHBondContact O-ND2 2.86Å; N321-R426 PolarHBondContact ND2-NH1 2.69Å; N321-R426 WeakPolarHBondContact O-CD 3.38Å; N321-R426 VanDerWaalsContact O-CG 3.26Å; N321-R426 WeakPolarHBondContact O-CG 3.05Å
322	A	96.9	Very high	94.6	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.263	C	S	.	.	S	Bend	trans	-147.1	173.8	177.7	0	0	0	0	0	110.2	W307 K311 A352 T424 R426	W307-A322 HydrophobicContact CE3-CB 3.9Å; W307-A322 HydrophobicContact CZ3-CB 3.77Å; K311-A322 WeakPolarHBondContact O-CA 3.28Å; A322-A352 HydrophobicContact CB-CB 3.68Å; A322-T424 HydrophobicContact CB-CG2 3.65Å; A322-R426 HydrophobicContact CB-CG 3.67Å
323	W	97.6	Very high	94.6	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	137.8	161.2	166.8	66.7	0	0	0	109.8	A293 S295 A312 A325 L334 P416 I423 T424 L425	A293-W323 HydrophobicContact CB-CD2 4.34Å; A293-W323 VanDerWaalsContact CB-CE2 3.5Å; A293-W323 HydrophobicContact CB-CZ2 3.74Å; A293-W323 VanDerWaalsContact CB-NE1 3.26Å; S295-W323 PolarHBondContact O-NE1 2.87Å; A312-W323 HydrophobicContact CB-CB 3.65Å; W323-A325 HydrophobicContact CH2-CB 4.1Å; W323-A325 HydrophobicContact CZ2-CB 3.74Å; W323-L334 HydrophobicContact CB-CD1 4.3Å; W323-L334 HydrophobicContact CD2-CB 4.33Å; W323-L334 HydrophobicContact CD2-CD1 3.87Å; W323-L334 HydrophobicContact CE3-CB 3.74Å; W323-L334 HydrophobicContact CE3-CD1 4Å; W323-L334 HydrophobicContact CE3-CD2 4.07Å; W323-L334 HydrophobicContact CE3-CG 4.15Å; W323-L334 HydrophobicContact CG-CD1 4Å; W323-L334 HydrophobicContact CH2-CB 4.05Å; W323-L334 HydrophobicContact CZ3-CB 3.59Å; W323-L334 HydrophobicContact CZ3-CG 4.5Å; W323-P416 HydrophobicContact CZ3-CG 4.47Å; W323-I423 HydrophobicContact CH2-CG2 4.05Å; W323-I423 HydrophobicContact CZ3-CG2 3.99Å; W323-T424 CarbonylContact O-C 3.48Å; W323-T424 VanDerWaalsContact O-CA 3.25Å; W323-T424 WeakPolarHBondContact O-CA 3.34Å; W323-L425 HydrophobicContact CE3-CB 4.13Å; W323-L425 HydrophobicContact CE3-CD1 4.42Å; W323-L425 HydrophobicContact CZ3-CD1 4.08Å; W323-L425 PolarHBondContact N-O 2.77Å; W323-L425 PolarHBondContact O-N 3.38Å
324	T	97.3	Very high	94.7	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	129.1	172.1	-60.1	0	0	0	0	109	F297 W307 R422 I423 T424	F297-T324 HydrophobicContact CB-CG2 3.74Å; F297-T324 WeakPolarHBondContact CB-O 3.08Å; F297-T324 HydrophobicContact CD1-CG2 4.14Å; F297-T324 HydrophobicContact CG-CG2 4.14Å; F297-T324 PolarHBondContact N-O 3.23Å; W307-T324 PolarHBondContact O-N 3.15Å; T324-R422 HydrophobicContact CG2-CB 3.88Å; T324-I423 CarbonylContact C-O 3.53Å; T324-I423 VanDerWaalsContact CA-O 3.23Å; T324-I423 WeakPolarHBondContact CA-O 3.25Å; T324-T424 WeakPolarHBondContact CG2-OG1 3.47Å; T324-T424 WeakPolarHBondContact OG1-CG2 3.44Å; T324-T424 PolarHBondContact OG1-OG1 2.78Å
325	A	97.4	Very high	94.9	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.273	C	S	.	.			trans	-69.4	141.6	178.8	0	0	0	0	0	111	W323 H327 Q332 I423	W323-A325 HydrophobicContact CH2-CB 4.1Å; W323-A325 HydrophobicContact CZ2-CB 3.74Å; A325-H327 VanDerWaalsContact C-N 3.3Å; A325-H327 VanDerWaalsContact CB-O 3.3Å; A325-H327 WeakPolarHBondContact CB-O 3.49Å; A325-H327 PolarHBondContact O-N 2.81Å; A325-Q332 HydrophobicContact CB-CB 4.2Å; A325-Q332 HydrophobicContact CB-CG 3.97Å; A325-I423 HydrophobicContact CB-CB 3.89Å; A325-I423 HydrophobicContact CB-CD1 4.42Å; A325-I423 HydrophobicContact CB-CG2 3.97Å; A325-I423 PolarHBondContact N-O 3.32Å
326	G	95.2	Very high	95.1	Very high	21 Å²	21	49 Å²	49	22%	0.216	26%	0.262	C	S	.	.	S	Bend	trans	-65.5	-34.8	177.4	0	0	0	0	0	112.5	S295	S295-G326 PolarHBondContact OG-N 2.74Å
327	H	95	Very high	95.3	Very high	124 Å²	124	46 Å²	46	57%	0.574	25%	0.25	S	S	*	.	S	Bend	trans	-116.7	150.3	174.7	-56.8	-77.3	0	0	0	110.6	A325 D329 Q332	A325-H327 VanDerWaalsContact C-N 3.3Å; A325-H327 VanDerWaalsContact CB-O 3.3Å; A325-H327 WeakPolarHBondContact CB-O 3.49Å; A325-H327 PolarHBondContact O-N 2.81Å; H327-D329 VanDerWaalsContact CB-OD2 3.28Å; H327-D329 WeakPolarHBondContact CB-OD2 3.46Å; H327-Q332 WeakPolarHBondContact O-CG 3.42Å
328	S	94.3	Very high	95.6	Very high	52 Å²	52	39.8 Å²	39.8	36%	0.364	22%	0.222	S	C	.	.			trans	-109.3	75.3	179.6	-65.5	0	0	0	0	109.7	W419	S328-W419 VanDerWaalsContact C-CZ2 3.46Å; S328-W419 VanDerWaalsContact O-CZ2 3.25Å; S328-W419 WeakPolarHBondContact O-CZ2 3.48Å
329	D	96.4	Very high	95.9	Very high	56 Å²	56	40.7 Å²	40.7	30%	0.299	21%	0.213	S	C	.	.	S	Bend	trans	-136	169.9	177.6	62.4	65.8	0	0	0	110.3	H327 S331 Q332 I423	H327-D329 VanDerWaalsContact CB-OD2 3.28Å; H327-D329 WeakPolarHBondContact CB-OD2 3.46Å; D329-S331 PolarHBondContact O-N 3.38Å; D329-S331 WeakPolarHBondContact OD1-CA 3.31Å; D329-S331 VanDerWaalsContact OD1-CB 3.3Å; D329-S331 WeakPolarHBondContact OD1-CB 3.18Å; D329-S331 PolarHBondContact OD1-N 3.15Å; D329-S331 PolarHBondContact OD1-OG 3.31Å; D329-Q332 VanDerWaalsContact CG-NE2 3.32Å; D329-Q332 WeakPolarHBondContact O-CG 3.27Å; D329-Q332 PolarHBondContact OD1-N 3.36Å; D329-Q332 PolarHBondContact OD1-NE2 2.87Å; D329-Q332 PolarHBondContact OD2-NE2 2.8Å; D329-I423 WeakPolarHBondContact O-CD1 3.31Å
330	Q	95.6	Very high	96.2	Very high	105 Å²	105	36.5 Å²	36.5	49%	0.491	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	0.2	-176	-66.5	-179.2	-24	0	0	114	Q332 W417 W419	Q330-Q332 VanDerWaalsContact C-N 3.32Å; Q330-W417 HydrophobicContact CG-CE3 4.31Å; Q330-W417 HydrophobicContact CG-CZ3 4.42Å; Q330-W417 PolarHBondContact NE2-O 3.07Å; Q330-W419 HydrophobicContact CG-CH2 4.17Å; Q330-W419 HydrophobicContact CG-CZ3 4.21Å
331	S	96.1	Very high	96.3	Very high	87 Å²	87	39.6 Å²	39.6	61%	0.608	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-7	175.2	77.4	0	0	0	0	112.7	D329	D329-S331 PolarHBondContact O-N 3.38Å; D329-S331 WeakPolarHBondContact OD1-CA 3.31Å; D329-S331 VanDerWaalsContact OD1-CB 3.3Å; D329-S331 WeakPolarHBondContact OD1-CB 3.18Å; D329-S331 PolarHBondContact OD1-N 3.15Å; D329-S331 PolarHBondContact OD1-OG 3.31Å
332	Q	98.3	Very high	96.3	Very high	9 Å²	9	39.1 Å²	39.1	4%	0.042	22%	0.219	C	C	.	.			trans	-71.4	149.3	-179.2	-55.7	-53.2	-48	0	0	112.3	S294 S295 A325 H327 D329 Q330 P416 I423	S294-Q332 VanDerWaalsContact OG-CA 3.27Å; S294-Q332 WeakPolarHBondContact OG-CA 3.19Å; S294-Q332 PolarHBondContact OG-OE1 3.49Å; S295-Q332 PolarHBondContact OG-OE1 3.02Å; A325-Q332 HydrophobicContact CB-CB 4.2Å; A325-Q332 HydrophobicContact CB-CG 3.97Å; H327-Q332 WeakPolarHBondContact O-CG 3.42Å; D329-Q332 VanDerWaalsContact CG-NE2 3.32Å; D329-Q332 WeakPolarHBondContact O-CG 3.27Å; D329-Q332 PolarHBondContact OD1-N 3.36Å; D329-Q332 PolarHBondContact OD1-NE2 2.87Å; D329-Q332 PolarHBondContact OD2-NE2 2.8Å; Q330-Q332 VanDerWaalsContact C-N 3.32Å; Q332-P416 WeakPolarHBondContact O-CD 3.45Å; Q332-I423 HydrophobicContact CB-CD1 3.96Å; Q332-I423 HydrophobicContact CG-CD1 3.88Å
333	W	97.8	Very high	96.1	Very high	62 Å²	62	41.4 Å²	41.4	24%	0.235	23%	0.229	C	C	.	.			trans	-151.4	149.5	178	54.7	-98	0	0	0	111.9	A293 S294 Q335 R413 I414 L415	A293-W333 VanDerWaalsContact CA-CZ3 3.49Å; A293-W333 VanDerWaalsContact CA-O 3.3Å; A293-W333 WeakPolarHBondContact CA-O 3.46Å; A293-W333 WeakPolarHBondContact CB-O 3.24Å; S294-W333 PolarHBondContact N-O 3.15Å; S294-W333 PolarHBondContact OG-N 2.94Å; S294-W333 PolarHBondContact OG-O 2.82Å; W333-Q335 HydrophobicContact CE3-CB 3.58Å; W333-Q335 HydrophobicContact CZ3-CB 3.39Å; W333-Q335 HydrophobicContact CZ3-CG 4.45Å; W333-R413 HydrophobicContact CE3-CG 4.31Å; W333-I414 WeakPolarHBondContact CA-O 3.48Å; W333-L415 HydrophobicContact CB-CD2 3.55Å
334	L	98.3	Very high	96	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.005	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	127.6	164.7	-179.2	70.3	0	0	0	107.9	V291 A293 P309 A312 W323 R413 I414 V427	V291-L334 HydrophobicContact CG1-CD1 3.85Å; V291-L334 HydrophobicContact CG1-CG 4.5Å; A293-L334 HydrophobicContact CB-CD1 4.14Å; P309-L334 HydrophobicContact CB-CD1 3.92Å; A312-L334 HydrophobicContact CB-CD1 4.2Å; A312-L334 HydrophobicContact CB-CD2 3.65Å; W323-L334 HydrophobicContact CB-CD1 4.3Å; W323-L334 HydrophobicContact CD2-CB 4.33Å; W323-L334 HydrophobicContact CD2-CD1 3.87Å; W323-L334 HydrophobicContact CE3-CB 3.74Å; W323-L334 HydrophobicContact CE3-CD1 4Å; W323-L334 HydrophobicContact CE3-CD2 4.07Å; W323-L334 HydrophobicContact CE3-CG 4.15Å; W323-L334 HydrophobicContact CG-CD1 4Å; W323-L334 HydrophobicContact CH2-CB 4.05Å; W323-L334 HydrophobicContact CZ3-CB 3.59Å; W323-L334 HydrophobicContact CZ3-CG 4.5Å; L334-R413 CarbonylContact O-C 3.34Å; L334-R413 VanDerWaalsContact O-CA 3.31Å; L334-R413 WeakPolarHBondContact O-CA 3.46Å; L334-I414 PolarHBondContact N-O 2.77Å; L334-I414 PolarHBondContact O-N 2.93Å; L334-V427 HydrophobicContact CD2-CG1 4.22Å; L334-V427 HydrophobicContact CD2-CG2 3.95Å
335	Q	97.9	Very high	95.8	Very high	21 Å²	21	42.1 Å²	42.1	10%	0.098	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	141.4	-177.9	-179.6	179	-56.5	0	0	110.5	V291 T292 W333 W375 V412 R413	V291-Q335 WeakPolarHBondContact CA-O 3.23Å; T292-Q335 PolarHBondContact N-O 2.81Å; T292-Q335 PolarHBondContact O-N 3.34Å; W333-Q335 HydrophobicContact CE3-CB 3.58Å; W333-Q335 HydrophobicContact CZ3-CB 3.39Å; W333-Q335 HydrophobicContact CZ3-CG 4.45Å; Q335-W375 HydrophobicContact CG-CH2 4.17Å; Q335-V412 CarbonylContact C-O 3.54Å; Q335-V412 VanDerWaalsContact CA-O 3.3Å; Q335-V412 WeakPolarHBondContact CA-O 3.36Å; Q335-R413 HydrophobicContact CB-CG 3.77Å; Q335-R413 HydrophobicContact CG-CG 3.99Å; Q335-R413 VanDerWaalsContact OE1-CZ 3.23Å
336	V	98.3	Very high	95.6	Very high	2 Å²	2	42.1 Å²	42.1	1%	0.012	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	125.7	170.3	-175.8	0	0	0	0	108.7	M281 V286 Q290 V291 L338 F411 V412 I429	M281-V336 HydrophobicContact CE-CG2 3.83Å; M281-V336 HydrophobicContact SD-CG1 3.89Å; M281-V336 HydrophobicContact SD-CG2 3.93Å; V286-V336 HydrophobicContact CG1-CG1 3.92Å; Q290-V336 WeakPolarHBondContact O-CA 3.42Å; V291-V336 HydrophobicContact CG1-CG2 4.35Å; V336-L338 HydrophobicContact CG1-CD2 4.04Å; V336-F411 WeakPolarHBondContact O-CA 3.49Å; V336-V412 PolarHBondContact N-O 3.09Å; V336-V412 PolarHBondContact O-N 3.5Å; V336-I429 HydrophobicContact CB-CD1 3.69Å; V336-I429 HydrophobicContact CG1-CD1 3.88Å; V336-I429 HydrophobicContact CG2-CD1 3.81Å
337	D	97.7	Very high	95.7	Very high	23 Å²	23	41.2 Å²	41.2	12%	0.123	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	113.4	169.1	-175.6	0.5	0	0	0	109.6	Q290 L339 R410 F411	Q290-D337 HydrophobicContact CB-CB 4.45Å; Q290-D337 WeakPolarHBondContact CB-O 3.43Å; Q290-D337 PolarHBondContact NE2-O 3.01Å; Q290-D337 PolarHBondContact O-N 2.98Å; D337-L339 PolarHBondContact O-N 3.04Å; D337-L339 WeakPolarHBondContact OD1-CA 3.43Å; D337-L339 PolarHBondContact OD1-N 2.92Å; D337-R410 VanDerWaalsContact OD1-CG 3.29Å; D337-R410 WeakPolarHBondContact OD1-CG 3.43Å; D337-R410 IonicContact OD1-CZ 2.74Å; D337-R410 IonicContact OD1-NE 2.84Å; D337-R410 PolarHBondContact OD1-NE 3.18Å; D337-R410 IonicContact OD1-NH2 3.77Å; D337-R410 IonicContact OD2-CZ 3.13Å; D337-R410 IonicContact OD2-NE 3.57Å; D337-R410 IonicContact OD2-NH2 3.04Å; D337-R410 PolarHBondContact OD2-NH2 3.14Å; D337-F411 HydrophobicContact CB-CD1 3.77Å; D337-F411 HydrophobicContact CB-CE1 3.65Å; D337-F411 WeakPolarHBondContact OD2-CE1 3.46Å
338	L	96	Very high	95.7	Very high	17 Å²	17	36 Å²	36	9%	0.089	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	-0.5	178.3	-57.9	175.2	0	0	0	112.9	L279 V336 V340 T342 V344 R410 V412 I429	L279-L338 HydrophobicContact CD1-CD1 3.96Å; L279-L338 HydrophobicContact CD1-CD2 3.94Å; V336-L338 HydrophobicContact CG1-CD2 4.04Å; L338-V340 PolarHBondContact O-N 2.83Å; L338-T342 HydrophobicContact CD1-CG2 4.29Å; L338-V344 HydrophobicContact CD1-CG2 3.87Å; L338-R410 VanDerWaalsContact CB-O 3.28Å; L338-R410 WeakPolarHBondContact CB-O 3.25Å; L338-R410 WeakPolarHBondContact CG-O 3.38Å; L338-R410 PolarHBondContact N-O 3.39Å; L338-V412 HydrophobicContact CD1-CG2 4.1Å; L338-I429 HydrophobicContact CD2-CD1 4.37Å
339	L	95.3	Very high	95.9	Very high	74 Å²	74	33.5 Å²	33.5	39%	0.387	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	66.2	-35.2	-177.1	-54.6	176.1	0	0	0	115.1	Y289 Q290 D337 R410	Y289-L339 HydrophobicContact CE2-CD2 4.43Å; Q290-L339 HydrophobicContact CG-CD2 4.16Å; Q290-L339 HydrophobicContact CG-CG 4.35Å; D337-L339 PolarHBondContact O-N 3.04Å; D337-L339 WeakPolarHBondContact OD1-CA 3.43Å; D337-L339 PolarHBondContact OD1-N 2.92Å; L339-R410 PolarHBondContact O-NE 2.93Å
340	V	93.3	Very high	95.9	Very high	74 Å²	74	31 Å²	31	45%	0.448	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	147.6	176.9	-63.9	0	0	0	0	110.5	L338 T342 T433	L338-V340 PolarHBondContact O-N 2.83Å; V340-T342 PolarHBondContact O-N 3.36Å; V340-T342 VanDerWaalsContact O-N 3.08Å; V340-T342 PolarHBondContact O-OG1 2.87Å; V340-T433 HydrophobicContact CG2-CG2 3.97Å
341	P	93.7	Very high	95.9	Very high	90 Å²	90	26 Å²	26	58%	0.584	15%	0.146	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-54.4	118.2	170.9	-24.7	34.9	0	0	0	110.2
342	T	93.6	Very high	95.9	Very high	4 Å²	4	21.9 Å²	21.9	3%	0.025	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	145.4	-172.3	-57.3	0	0	0	0	109.3	L279 L338 V340 V344 A409 C432 T433	L279-T342 HydrophobicContact CD1-CG2 3.79Å; L279-T342 HydrophobicContact CD2-CG2 4.01Å; L338-T342 HydrophobicContact CD1-CG2 4.29Å; V340-T342 PolarHBondContact O-N 3.36Å; V340-T342 VanDerWaalsContact O-N 3.08Å; V340-T342 PolarHBondContact O-OG1 2.87Å; T342-V344 PolarHBondContact O-N 3.31Å; T342-A409 PolarHBondContact N-O 2.8Å; T342-A409 PolarHBondContact O-N 2.8Å; T342-A409 VanDerWaalsContact O-N 3.08Å; T342-C432 VanDerWaalsContact CG2-O 3.26Å; T342-C432 WeakPolarHBondContact CG2-O 3.5Å; T342-T433 HydrophobicContact CG2-CG2 4.18Å
343	K	93.7	Very high	95.7	Very high	47 Å²	47	25.7 Å²	25.7	20%	0.204	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	109.3	173.8	-171.4	177.8	-168.1	155.5	0	109.2	T345 P406 Y408 G431 C432 E434	K343-T345 HydrophobicContact CG-CG2 4.3Å; K343-P406 HydrophobicContact CG-CB 4.15Å; K343-Y408 HydrophobicContact CB-CD1 4.05Å; K343-Y408 HydrophobicContact CB-CE1 3.69Å; K343-Y408 HydrophobicContact CD-CE1 4Å; K343-Y408 HydrophobicContact CD-CE2 4.3Å; K343-Y408 VanDerWaalsContact CD-OH 3.31Å; K343-Y408 WeakPolarHBondContact CD-OH 3.46Å; K343-Y408 VanDerWaalsContact CE-OH 3.22Å; K343-Y408 WeakPolarHBondContact CE-OH 3.27Å; K343-Y408 HydrophobicContact CG-CD1 4.38Å; K343-Y408 HydrophobicContact CG-CE1 3.85Å; K343-Y408 HydrophobicContact CG-CE2 4.13Å; K343-Y408 PolarHBondContact NZ-OH 3.04Å; K343-G431 CarbonylContact O-C 3.59Å; K343-G431 WeakPolarHBondContact O-CA 3.33Å; K343-C432 WeakPolarHBondContact CB-O 3.22Å; K343-C432 PolarHBondContact N-O 3.02Å; K343-C432 PolarHBondContact O-N 3.3Å; K343-E434 IonicContact NZ-OE1 2.7Å
344	V	94.9	Very high	95.2	Very high	1 Å²	1	23.5 Å²	23.5	1%	0.006	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	121.2	-179.7	-175.7	0	0	0	0	109.4	L338 T342 I403 P406 V407 V412 I429	L338-V344 HydrophobicContact CD1-CG2 3.87Å; T342-V344 PolarHBondContact O-N 3.31Å; V344-I403 HydrophobicContact CG1-CD1 3.82Å; V344-P406 WeakPolarHBondContact O-CA 3.47Å; V344-P406 WeakPolarHBondContact O-CB 3.32Å; V344-V407 PolarHBondContact N-O 3.26Å; V344-V407 PolarHBondContact O-N 2.78Å; V344-V412 HydrophobicContact CG2-CG2 3.95Å; V344-I429 HydrophobicContact CG1-CG2 3.71Å; V344-I429 HydrophobicContact CG2-CG2 4.41Å
345	T	92.9	Very high	94.6	Very high	14 Å²	14	29.9 Å²	29.9	9%	0.086	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	-14.5	-172.7	60	0	0	0	0	113	C275 K343 I403 P406 L430	C275-T345 HydrophobicContact CB-CG2 4.04Å; C275-T345 VanDerWaalsContact O-CB 3.3Å; C275-T345 WeakPolarHBondContact O-CB 3.36Å; C275-T345 WeakPolarHBondContact O-CG2 3.49Å; C275-T345 PolarHBondContact O-OG1 2.84Å; K343-T345 HydrophobicContact CG-CG2 4.3Å; T345-I403 PolarHBondContact O-N 3.33Å; T345-P406 HydrophobicContact CG2-CB 4.03Å; T345-L430 PolarHBondContact N-O 2.87Å; T345-L430 PolarHBondContact OG1-O 2.89Å
346	G	93.8	Very high	94.1	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.01	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-170.5	166.1	177.1	0	0	0	0	0	113.7	N401 L430	G346-N401 CarbonylContact C-O 3.57Å; G346-N401 WeakPolarHBondContact CA-O 3.47Å; G346-L430 PolarHBondContact N-O 3.09Å; G346-L430 PolarHBondContact O-N 2.84Å
347	I	96.2	Very high	93.7	Very high	1 Å²	1	38.3 Å²	38.3	1%	0.005	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	134	175.7	-63.7	174.5	0	0	0	107.8	T349 L366 N401 I403 V412 I414 E428	I347-T349 HydrophobicContact CG2-CG2 3.91Å; I347-L366 HydrophobicContact CD1-CD1 3.45Å; I347-L366 VanDerWaalsContact CD1-CD1 3.45Å; I347-L366 HydrophobicContact CD1-CD2 4.35Å; I347-L366 HydrophobicContact CD1-CG 4.49Å; I347-N401 PolarHBondContact N-O 2.83Å; I347-N401 PolarHBondContact O-N 2.9Å; I347-I403 HydrophobicContact CD1-CD1 4.17Å; I347-I403 HydrophobicContact CG1-CD1 4.05Å; I347-V412 HydrophobicContact CD1-CG1 4.29Å; I347-I414 HydrophobicContact CD1-CD1 4.48Å; I347-I414 HydrophobicContact CD1-CG1 4.27Å; I347-I414 HydrophobicContact CG2-CD1 4.01Å; I347-E428 WeakPolarHBondContact CA-O 3.46Å
348	I	96.2	Very high	93.5	Very high	14 Å²	14	39.3 Å²	39.3	7%	0.072	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	127.8	170	-53.1	173.6	0	0	0	107.9	I124 L314 H398 R399 K400 V427 E428 L430	I124-I348 HydrophobicContact CD1-CD1 4Å; L314-I348 HydrophobicContact CD1-CG2 3.79Å; L314-I348 HydrophobicContact CD2-CB 4.41Å; L314-I348 HydrophobicContact CD2-CD1 4.38Å; L314-I348 HydrophobicContact CD2-CG2 4.01Å; I348-H398 HydrophobicContact CG2-CB 3.81Å; I348-R399 CarbonylContact C-O 3.03Å; I348-R399 VanDerWaalsContact CA-O 3.29Å; I348-R399 WeakPolarHBondContact CA-O 3.31Å; I348-K400 HydrophobicContact CG1-CB 4.13Å; I348-K400 HydrophobicContact CG1-CG 4.12Å; I348-V427 CarbonylContact O-C 3.56Å; I348-V427 VanDerWaalsContact O-CA 3.25Å; I348-V427 WeakPolarHBondContact O-CA 3.21Å; I348-E428 HydrophobicContact CB-CB 4.25Å; I348-E428 PolarHBondContact N-O 2.95Å; I348-E428 PolarHBondContact O-N 2.77Å; I348-L430 HydrophobicContact CD1-CD1 4.05Å; I348-L430 HydrophobicContact CD1-CD2 4Å; I348-L430 HydrophobicContact CD1-CG 4.3Å; I348-L430 HydrophobicContact CG1-CD1 3.99Å; I348-L430 HydrophobicContact CG1-CD2 4.47Å; I348-L430 HydrophobicContact CG1-CG 4.27Å
349	T	97.3	Very high	93.5	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	150.4	175.6	65.6	0	0	0	0	111.2	I347 Y364 N392 R399 L425 R426 V427	I347-T349 HydrophobicContact CG2-CG2 3.91Å; T349-Y364 HydrophobicContact CG2-CD1 4.37Å; T349-Y364 HydrophobicContact CG2-CE1 3.68Å; T349-N392 VanDerWaalsContact CB-OD1 3.27Å; T349-N392 WeakPolarHBondContact CB-OD1 2.93Å; T349-N392 PolarHBondContact O-ND2 2.78Å; T349-N392 PolarHBondContact OG1-OD1 2.04Å; T349-R399 PolarHBondContact N-O 2.81Å; T349-R399 PolarHBondContact O-N 2.78Å; T349-L425 HydrophobicContact CG2-CD2 4.2Å; T349-R426 CarbonylContact C-O 3.53Å; T349-R426 WeakPolarHBondContact CA-O 3.33Å; T349-V427 HydrophobicContact CG2-CG1 4.38Å
350	Q	97	Very high	93.6	Very high	5 Å²	5	36.7 Å²	36.7	2%	0.023	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	143.2	177	-174.5	-173.2	43.7	0	0	108.6	L314 D315 N392 D396 H398 R426	L314-Q350 HydrophobicContact CD1-CB 3.76Å; D315-Q350 PolarHBondContact OD1-NE2 2.79Å; Q350-N392 WeakPolarHBondContact CA-ND2 3.19Å; Q350-N392 PolarHBondContact N-OD1 2.84Å; Q350-D396 PolarHBondContact NE2-O 2.99Å; Q350-H398 PolarHBondContact NE2-CD2 3.37Å; Q350-H398 VanDerWaalsContact NE2-CD2 3.34Å; Q350-H398 PolarHBondContact NE2-NE2 2.87Å; Q350-R426 HydrophobicContact CB-CB 4.05Å; Q350-R426 VanDerWaalsContact CD-NH2 3.25Å; Q350-R426 PolarHBondContact N-O 2.83Å; Q350-R426 PolarHBondContact O-N 3.17Å; Q350-R426 VanDerWaalsContact OE1-NE 3.08Å
351	G	96.2	Very high	93.8	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.181	C	C	.	.			trans	-82.4	-161.6	176.6	0	0	0	0	0	113.1	N395 R426	G351-N395 CarbonylContact C-O 3.53Å; G351-N395 WeakPolarHBondContact CA-O 3.45Å; G351-N395 PolarHBondContact N-O 3.28Å; G351-R426 PolarHBondContact O-NE 2.63Å; G351-R426 PolarHBondContact O-NH2 2.6Å
352	A	95.8	Very high	94	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	-178.2	170.5	0	0	0	0	0	112.2	W307 A322 Q359 N395 T424	W307-A352 HydrophobicContact CH2-CB 4.41Å; W307-A352 HydrophobicContact CZ3-CB 3.93Å; A322-A352 HydrophobicContact CB-CB 3.68Å; A352-Q359 PolarHBondContact N-O 2.83Å; A352-Q359 PolarHBondContact O-N 2.86Å; A352-N395 WeakPolarHBondContact O-CB 3.48Å; A352-T424 HydrophobicContact CB-CG2 3.63Å
353	K	93.1	Very high	94.2	Very high	88 Å²	88	29.7 Å²	29.7	38%	0.383	16%	0.16	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	130.6	175.1	-80.5	165.8	177.3	143.2	0	109.1	H357 V358 N395 D396	K353-H357 CarbonylContact C-O 3.57Å; K353-H357 VanDerWaalsContact CA-O 3.28Å; K353-H357 WeakPolarHBondContact CA-O 3.38Å; K353-V358 HydrophobicContact CD-CG2 4.26Å; K353-V358 VanDerWaalsContact CE-CG2 3.48Å; K353-V358 HydrophobicContact CG-CG2 3.83Å; K353-N395 WeakPolarHBondContact CD-ND2 3.29Å; K353-N395 WeakPolarHBondContact CE-ND2 3.25Å; K353-N395 WeakPolarHBondContact CE-OD1 3.05Å; K353-N395 HydrophobicContact CG-CB 4.09Å; K353-N395 WeakPolarHBondContact CG-ND2 3.32Å; K353-N395 PolarHBondContact NZ-ND2 3.37Å; K353-N395 VanDerWaalsContact NZ-ND2 3.15Å; K353-N395 PolarHBondContact NZ-OD1 3.48Å; K353-D396 IonicContact NZ-OD2 2.72Å; K353-D396 PolarHBondContact NZ-OD2 3.23Å
354	D	88.6	Confident	94.4	Very high	17 Å²	17	27.5 Å²	27.5	9%	0.091	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	114.7	171.9	-172.5	21.6	0	0	0	108.9	T299 W307 G356 H357	T299-D354 PolarHBondContact OG1-OD2 2.86Å; T299-D354 VanDerWaalsContact OG1-OD2 3.14Å; W307-D354 HydrophobicContact CH2-CB 4.08Å; W307-D354 HydrophobicContact CZ2-CB 3.61Å; W307-D354 WeakPolarHBondContact CZ2-OD1 3.48Å; D354-G356 PolarHBondContact O-N 2.92Å; D354-H357 PolarHBondContact N-O 2.77Å; D354-H357 WeakPolarHBondContact O-CA 3.28Å; D354-H357 WeakPolarHBondContact O-CB 3.4Å; D354-H357 PolarHBondContact O-N 3.07Å
355	F	86	Confident	94.5	Very high	135 Å²	135	29 Å²	29	59%	0.592	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	45.9	38	-175.3	-69.1	-85.2	0	0	0	114.8	T299 F305 H357	T299-F355 HydrophobicContact CG2-CD2 4.04Å; T299-F355 HydrophobicContact CG2-CE2 3.67Å; F305-F355 HydrophobicContact CE1-CZ 4.48Å; F355-H357 VanDerWaalsContact C-N 3.32Å
356	G	85.6	Confident	94.7	Very high	62 Å²	62	28.5 Å²	28.5	64%	0.639	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	88.6	-11.7	-179.1	0	0	0	0	0	114.8	D354 V358	D354-G356 PolarHBondContact O-N 2.92Å; G356-V358 PolarHBondContact O-N 2.84Å
357	H	90.8	Very high	94.9	Very high	137 Å²	137	28.6 Å²	28.6	63%	0.634	16%	0.155	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-79.8	117.9	172.6	-61.2	-77.3	0	0	0	110.7	K353 D354 F355	K353-H357 CarbonylContact C-O 3.57Å; K353-H357 VanDerWaalsContact CA-O 3.28Å; K353-H357 WeakPolarHBondContact CA-O 3.38Å; D354-H357 PolarHBondContact N-O 2.77Å; D354-H357 WeakPolarHBondContact O-CA 3.28Å; D354-H357 WeakPolarHBondContact O-CB 3.4Å; D354-H357 PolarHBondContact O-N 3.07Å; F355-H357 VanDerWaalsContact C-N 3.32Å
358	V	94.2	Very high	95	Very high	45 Å²	45	31.8 Å²	31.8	27%	0.273	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	132.7	177.7	166.7	0	0	0	0	110.7	K353 G356 F360 N395 Y420	K353-V358 HydrophobicContact CD-CG2 4.26Å; K353-V358 VanDerWaalsContact CE-CG2 3.48Å; K353-V358 HydrophobicContact CG-CG2 3.83Å; G356-V358 PolarHBondContact O-N 2.84Å; V358-F360 HydrophobicContact CG1-CD1 3.61Å; V358-F360 HydrophobicContact CG1-CE1 3.67Å; V358-N395 HydrophobicContact CG1-CB 4.11Å; V358-Y420 HydrophobicContact CB-CE1 4.34Å; V358-Y420 HydrophobicContact CG1-CD1 4.16Å; V358-Y420 HydrophobicContact CG1-CE1 4.22Å; V358-Y420 WeakPolarHBondContact O-CD1 3.48Å; V358-Y420 WeakPolarHBondContact O-CE1 3.3Å
359	Q	95.9	Very high	95.1	Very high	14 Å²	14	31.4 Å²	31.4	7%	0.065	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	134.5	177.9	-56.5	177.4	15.1	0	0	110.3	A352 Y420 T424	A352-Q359 PolarHBondContact N-O 2.83Å; A352-Q359 PolarHBondContact O-N 2.86Å; Q359-Y420 WeakPolarHBondContact CA-O 3.28Å; Q359-T424 PolarHBondContact OE1-OG1 3.05Å; Q359-T424 VanDerWaalsContact OE1-OG1 3.09Å
360	F	97.3	Very high	95	Very high	22 Å²	22	35.7 Å²	35.7	10%	0.096	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.4	159.2	-179.3	58.7	-95.3	0	0	0	112.4	V358 N392 F393 W419 Y420	V358-F360 HydrophobicContact CG1-CD1 3.61Å; V358-F360 HydrophobicContact CG1-CE1 3.67Å; F360-N392 HydrophobicContact CB-CB 4.14Å; F360-N392 HydrophobicContact CD2-CB 4.11Å; F360-N392 WeakPolarHBondContact CD2-O 3.47Å; F360-N392 WeakPolarHBondContact CE2-O 3.32Å; F360-N392 HydrophobicContact CG-CB 4.34Å; F360-F393 VanDerWaalsContact CZ-C 3.44Å; F360-F393 VanDerWaalsContact CZ-O 3.3Å; F360-F393 WeakPolarHBondContact CZ-O 3.41Å; F360-W419 CarbonylContact O-C 3.51Å; F360-W419 VanDerWaalsContact O-CA 3.29Å; F360-W419 WeakPolarHBondContact O-CA 3.14Å; F360-W419 WeakPolarHBondContact O-CB 3.45Å; F360-Y420 HydrophobicContact CD1-CD1 4.2Å; F360-Y420 HydrophobicContact CD1-CG 4.47Å; F360-Y420 AromaticContact CE1-CD1 3.65Å; F360-Y420 HydrophobicContact CE1-CD1 3.65Å; F360-Y420 AromaticContact CE1-CG 3.75Å; F360-Y420 HydrophobicContact CE1-CG 3.75Å; F360-Y420 HydrophobicContact CZ-CD1 4.2Å; F360-Y420 AromaticContact CZ-CG 3.8Å; F360-Y420 HydrophobicContact CZ-CG 3.8Å; F360-Y420 PolarHBondContact N-O 2.9Å; F360-Y420 VanDerWaalsContact N-O 3.14Å; F360-Y420 PolarHBondContact O-N 3.18Å
361	V	98.1	Very high	94.9	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.006	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	122.1	170.6	173.6	0	0	0	0	109.9	S363 N392 P416 S418 I423 T424 L425	V361-S363 WeakPolarHBondContact CG1-O 3.49Å; V361-N392 PolarHBondContact O-N 3.14Å; V361-P416 HydrophobicContact CG1-CB 4.13Å; V361-P416 HydrophobicContact CG2-CB 4.04Å; V361-P416 HydrophobicContact CG2-CG 4.26Å; V361-S418 CarbonylContact C-O 3.58Å; V361-I423 HydrophobicContact CG2-CG2 3.99Å; V361-T424 PolarHBondContact N-O 3.13Å; V361-L425 HydrophobicContact CB-CD1 4.43Å; V361-L425 HydrophobicContact CB-CD2 3.8Å; V361-L425 HydrophobicContact CB-CG 4.06Å; V361-L425 HydrophobicContact CG2-CD1 3.88Å; V361-L425 HydrophobicContact CG2-CD2 3.92Å; V361-L425 HydrophobicContact CG2-CG 3.57Å
362	G	96.8	Very high	94.8	Very high	12 Å²	12	40.6 Å²	40.6	12%	0.124	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	-26.1	-178.8	0	0	0	0	0	113.8	G391 N392 S418	G362-G391 WeakPolarHBondContact O-CA 3.14Å; G362-G391 PolarHBondContact O-N 2.85Å; G362-N392 WeakPolarHBondContact CA-O 3.28Å; G362-S418 PolarHBondContact N-O 2.87Å
363	S	97.8	Very high	94.6	Very high	7 Å²	7	48.3 Å²	48.3	5%	0.049	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	154.8	169.3	66.2	0	0	0	0	111.2	V361 F389 W417 S418	V361-S363 WeakPolarHBondContact CG1-O 3.49Å; S363-F389 CarbonylContact C-O 3.6Å; S363-F389 WeakPolarHBondContact CA-O 3.46Å; S363-F389 VanDerWaalsContact CB-O 3.28Å; S363-F389 WeakPolarHBondContact CB-O 3.08Å; S363-W417 PolarHBondContact O-N 2.85Å; S363-S418 WeakPolarHBondContact CB-OG 3.44Å; S363-S418 PolarHBondContact N-O 3.1Å; S363-S418 VanDerWaalsContact N-O 3.11Å; S363-S418 PolarHBondContact N-OG 3.29Å; S363-S418 VanDerWaalsContact N-OG 3.14Å; S363-S418 PolarHBondContact O-N 2.85Å; S363-S418 VanDerWaalsContact O-N 3.15Å; S363-S418 WeakPolarHBondContact OG-CB 3.43Å; S363-S418 PolarHBondContact OG-N 3.08Å; S363-S418 PolarHBondContact OG-OG 2.85Å
364	Y	98.1	Very high	94.8	Very high	2 Å²	2	53.5 Å²	53.5	1%	0.008	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	157.9	-179.1	64.6	-86.6	0	0	0	112.1	T349 F389 N401 I414 L415	T349-Y364 HydrophobicContact CG2-CD1 4.37Å; T349-Y364 HydrophobicContact CG2-CE1 3.68Å; Y364-F389 HydrophobicContact CD1-CB 4.18Å; Y364-F389 HydrophobicContact CD2-CB 4.15Å; Y364-F389 HydrophobicContact CD2-CD2 4.24Å; Y364-F389 HydrophobicContact CE1-CB 3.81Å; Y364-F389 HydrophobicContact CE2-CB 3.8Å; Y364-F389 AromaticContact CE2-CD2 3.9Å; Y364-F389 HydrophobicContact CE2-CD2 3.9Å; Y364-F389 HydrophobicContact CE2-CG 4.02Å; Y364-F389 HydrophobicContact CG-CB 4.34Å; Y364-F389 PolarHBondContact N-O 2.8Å; Y364-F389 PolarHBondContact O-N 2.97Å; Y364-N401 WeakPolarHBondContact OH-CB 3.26Å; Y364-N401 PolarHBondContact OH-ND2 3.38Å; Y364-I414 HydrophobicContact CD2-CG2 3.79Å; Y364-I414 HydrophobicContact CE2-CG2 4.45Å; Y364-I414 HydrophobicContact CG-CG2 3.95Å; Y364-L415 CarbonylContact C-O 3.6Å; Y364-L415 WeakPolarHBondContact CA-O 3.43Å; Y364-L415 WeakPolarHBondContact CB-O 3.46Å
365	K	97.5	Very high	95.2	Very high	33 Å²	33	55.8 Å²	55.8	14%	0.143	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	159.6	165.8	-61.8	178.5	176.7	-174.6	0	109.4	V377 D386 V388 L415 W417	K365-V377 HydrophobicContact CB-CG1 4.47Å; K365-D386 HydrophobicContact CD-CB 3.98Å; K365-D386 IonicContact NZ-OD2 3.38Å; K365-D386 PolarHBondContact NZ-OD2 3.46Å; K365-V388 HydrophobicContact CG-CG2 4.23Å; K365-L415 HydrophobicContact CB-CB 4.17Å; K365-L415 HydrophobicContact CB-CD1 4.38Å; K365-L415 PolarHBondContact N-O 3.3Å; K365-L415 PolarHBondContact O-N 3.42Å; K365-W417 HydrophobicContact CD-CE3 4.32Å
366	L	97.7	Very high	95.7	Very high	2 Å²	2	52.3 Å²	52.3	1%	0.01	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	129.5	177.7	-179.3	65.7	0	0	0	108.8	I347 V377 Y378 F389 I403 V412	I347-L366 HydrophobicContact CD1-CD1 3.45Å; I347-L366 VanDerWaalsContact CD1-CD1 3.45Å; I347-L366 HydrophobicContact CD1-CD2 4.35Å; I347-L366 HydrophobicContact CD1-CG 4.49Å; L366-V377 CarbonylContact O-C 3.56Å; L366-V377 WeakPolarHBondContact O-CA 3.46Å; L366-Y378 HydrophobicContact CD2-CG 4.42Å; L366-Y378 WeakPolarHBondContact O-CB 3.5Å; L366-Y378 PolarHBondContact O-N 3.47Å; L366-F389 HydrophobicContact CB-CD2 4.38Å; L366-F389 HydrophobicContact CB-CE2 3.81Å; L366-F389 HydrophobicContact CD2-CE2 4.49Å; L366-I403 HydrophobicContact CD2-CD1 3.51Å; L366-I403 HydrophobicContact CD2-CG1 4.07Å; L366-V412 HydrophobicContact CD1-CG1 3.48Å; L366-V412 VanDerWaalsContact CD1-CG1 3.48Å
367	A	97.8	Very high	96.2	Very high	4 Å²	4	51.6 Å²	51.6	3%	0.033	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	150.7	167.3	0	0	0	0	0	110	W375 S376 V377 R413 L415	A367-W375 HydrophobicContact CB-CE3 4.09Å; A367-S376 CarbonylContact C-O 3.59Å; A367-S376 VanDerWaalsContact CA-O 3.24Å; A367-S376 WeakPolarHBondContact CA-O 3.48Å; A367-V377 HydrophobicContact CB-CG2 4.38Å; A367-R413 HydrophobicContact CB-CB 4.05Å; A367-R413 PolarHBondContact N-O 2.92Å; A367-R413 PolarHBondContact O-N 3.07Å; A367-L415 HydrophobicContact CB-CD1 3.89Å; A367-L415 HydrophobicContact CB-CG 4.28Å
368	Y	97.7	Very high	96.5	Very high	68 Å²	68	45.9 Å²	45.9	27%	0.267	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	155.7	-176.5	62.3	-88.8	0	0	0	111.6	S376 Y378 V407 A409 F411	Y368-S376 VanDerWaalsContact CD1-O 3.32Å; Y368-S376 WeakPolarHBondContact CD1-O 3.23Å; Y368-S376 PolarHBondContact N-O 2.84Å; Y368-S376 PolarHBondContact O-N 3.42Å; Y368-Y378 HydrophobicContact CE1-CD2 4.42Å; Y368-V407 HydrophobicContact CD1-CG1 3.69Å; Y368-V407 HydrophobicContact CD1-CG2 4.25Å; Y368-V407 HydrophobicContact CD2-CG1 3.41Å; Y368-V407 VanDerWaalsContact CD2-CG1 3.41Å; Y368-V407 HydrophobicContact CE1-CG1 4.07Å; Y368-V407 HydrophobicContact CE1-CG2 4.16Å; Y368-V407 HydrophobicContact CE2-CG1 3.81Å; Y368-V407 HydrophobicContact CG-CG1 3.34Å; Y368-A409 HydrophobicContact CD2-CB 4.19Å; Y368-A409 HydrophobicContact CG-CB 4.38Å; Y368-F411 VanDerWaalsContact CA-O 3.29Å; Y368-F411 WeakPolarHBondContact CA-O 3.49Å
369	S	97.8	Very high	96.5	Very high	6 Å²	6	48.7 Å²	48.7	4%	0.042	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.3	156	-177.7	179.3	0	0	0	0	111.5	D371 G372 R374 R410 F411	S369-D371 PolarHBondContact OG-N 2.91Å; S369-D371 PolarHBondContact OG-OD1 3.08Å; S369-G372 PolarHBondContact OG-N 2.81Å; S369-R374 WeakPolarHBondContact CB-O 3.25Å; S369-R374 PolarHBondContact OG-O 3.38Å; S369-R410 PolarHBondContact O-N 2.79Å; S369-F411 PolarHBondContact N-O 3.24Å; S369-F411 PolarHBondContact O-N 2.8Å
370	N	96.1	Very high	96.2	Very high	89 Å²	89	49.5 Å²	49.5	48%	0.476	25%	0.245	S	C	.	.	S	Bend	trans	-106.5	-21	170.7	-77.3	-41.2	0	0	0	113.2	A409 R410	N370-A409 WeakPolarHBondContact OD1-CA 3.19Å; N370-R410 PolarHBondContact OD1-N 3.14Å
371	D	94.6	Very high	95.6	Very high	85 Å²	85	56 Å²	56	46%	0.455	28%	0.275	S	S	.	.	S	Bend	trans	-107.3	-16.3	-177.8	56.6	18.9	0	0	0	113.1	S369 E373 R374	S369-D371 PolarHBondContact OG-N 2.91Å; S369-D371 PolarHBondContact OG-OD1 3.08Å; D371-E373 PolarHBondContact O-N 2.76Å; D371-E373 PolarHBondContact OD1-N 2.8Å; D371-R374 PolarHBondContact OD1-N 2.8Å
372	G	92.9	Very high	94.9	Very high	23 Å²	23	65.3 Å²	65.3	24%	0.237	32%	0.316	C	S	.	.	S	Bend	trans	81.8	-7	-176.2	0	0	0	0	0	114	S369 W375	S369-G372 PolarHBondContact OG-N 2.81Å; G372-W375 PolarHBondContact O-NE1 3.4Å
373	E	93.3	Very high	94.4	Very high	163 Å²	163	71.3 Å²	71.3	76%	0.762	34%	0.341	S	S	*	.	S	Bend	trans	-104.3	-47.7	-177.9	-64.3	-173.6	172.4	0	0	111.5	D371 W375	D371-E373 PolarHBondContact O-N 2.76Å; D371-E373 PolarHBondContact OD1-N 2.8Å; E373-W375 VanDerWaalsContact O-CD1 3.26Å
374	R	96	Very high	93.7	Very high	197 Å²	197	73.4 Å²	73.4	74%	0.743	36%	0.363	S	S	*	.	S	Bend	trans	-96.8	121.4	-179.6	-63.9	179.9	-179.7	-174	1.6	109.4	S369 D371	S369-R374 WeakPolarHBondContact CB-O 3.25Å; S369-R374 PolarHBondContact OG-O 3.38Å; D371-R374 PolarHBondContact OD1-N 2.8Å
375	W	96.8	Very high	93.4	Very high	64 Å²	64	80.2 Å²	80.2	24%	0.242	39%	0.393	C	S	.	.			trans	-113.6	131.8	-175.8	-67.8	85.1	0	0	0	110.9	Q335 A367 G372 E373 F411 R413	Q335-W375 HydrophobicContact CG-CH2 4.17Å; A367-W375 HydrophobicContact CB-CE3 4.09Å; G372-W375 PolarHBondContact O-NE1 3.4Å; E373-W375 VanDerWaalsContact O-CD1 3.26Å; W375-F411 HydrophobicContact CH2-CB 3.55Å; W375-F411 HydrophobicContact CH2-CG 4.43Å; W375-F411 HydrophobicContact CZ2-CB 4.27Å; W375-F411 HydrophobicContact CZ3-CB 4.1Å; W375-R413 VanDerWaalsContact CE2-NH1 3.35Å; W375-R413 HydrophobicContact CE3-CB 4.27Å; W375-R413 HydrophobicContact CE3-CG 4.16Å; W375-R413 HydrophobicContact CH2-CB 4.32Å; W375-R413 VanDerWaalsContact CH2-CD 3.47Å; W375-R413 HydrophobicContact CH2-CG 3.51Å; W375-R413 VanDerWaalsContact CH2-NE 3.31Å; W375-R413 HydrophobicContact CZ2-CG 4.33Å; W375-R413 VanDerWaalsContact CZ2-NH2 3.33Å; W375-R413 HydrophobicContact CZ3-CB 3.73Å; W375-R413 VanDerWaalsContact CZ3-CD 3.46Å; W375-R413 HydrophobicContact CZ3-CG 3.43Å; W375-R413 VanDerWaalsContact CZ3-CG 3.43Å
376	S	96.3	Very high	93.2	Very high	62 Å²	62	81.6 Å²	81.6	43%	0.434	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	132.5	169.4	-66.8	0	0	0	0	109.4	A367 Y368	A367-S376 CarbonylContact C-O 3.59Å; A367-S376 VanDerWaalsContact CA-O 3.24Å; A367-S376 WeakPolarHBondContact CA-O 3.48Å; Y368-S376 VanDerWaalsContact CD1-O 3.32Å; Y368-S376 WeakPolarHBondContact CD1-O 3.23Å; Y368-S376 PolarHBondContact N-O 2.84Å; Y368-S376 PolarHBondContact O-N 3.42Å
377	V	96.6	Very high	93.1	Very high	48 Å²	48	84.9 Å²	84.9	29%	0.291	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	135.2	173.2	-176.9	0	0	0	0	108.1	K365 L366 A367 Q379 D386	K365-V377 HydrophobicContact CB-CG1 4.47Å; L366-V377 CarbonylContact O-C 3.56Å; L366-V377 WeakPolarHBondContact O-CA 3.46Å; A367-V377 HydrophobicContact CB-CG2 4.38Å; V377-Q379 PolarHBondContact O-N 2.72Å; V377-D386 HydrophobicContact CG1-CB 4.06Å
378	Y	96.8	Very high	93	Very high	16 Å²	16	87.2 Å²	87.2	6%	0.063	43%	0.429	C	S	.	.			trans	-66.3	125.7	178.4	-173.1	-102.2	0	0	0	110.6	L366 Y368 K387 F389 I403 D404 P405 V407	L366-Y378 HydrophobicContact CD2-CG 4.42Å; L366-Y378 WeakPolarHBondContact O-CB 3.5Å; L366-Y378 PolarHBondContact O-N 3.47Å; Y368-Y378 HydrophobicContact CE1-CD2 4.42Å; Y378-K387 HydrophobicContact CD1-CB 3.63Å; Y378-K387 HydrophobicContact CD1-CG 4.04Å; Y378-K387 HydrophobicContact CE1-CB 4.05Å; Y378-K387 HydrophobicContact CE1-CG 4.09Å; Y378-K387 PolarHBondContact O-N 2.81Å; Y378-F389 AromaticContact CD1-CE2 3.81Å; Y378-F389 HydrophobicContact CD1-CE2 3.81Å; Y378-F389 AromaticContact CD1-CZ 3.57Å; Y378-F389 HydrophobicContact CD1-CZ 3.57Å; Y378-F389 HydrophobicContact CE1-CE2 4.44Å; Y378-F389 AromaticContact CE1-CZ 3.75Å; Y378-F389 HydrophobicContact CE1-CZ 3.75Å; Y378-I403 HydrophobicContact CD2-CG2 4.25Å; Y378-I403 HydrophobicContact CE1-CG2 4.47Å; Y378-I403 HydrophobicContact CE2-CG2 3.7Å; Y378-D404 PolarHBondContact OH-N 2.94Å; Y378-D404 PolarHBondContact OH-O 2.76Å; Y378-P405 WeakPolarHBondContact OH-CD 3.43Å; Y378-P405 PolarHBondContact OH-O 3.02Å; Y378-V407 HydrophobicContact CD2-CG2 3.51Å; Y378-V407 HydrophobicContact CE2-CG2 3.72Å
379	Q	94.5	Very high	92.9	Very high	104 Å²	104	84.5 Å²	84.5	49%	0.486	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	147.9	-175.1	-68.7	179.7	-13.8	0	0	111.6	V377 Q381 K385	V377-Q379 PolarHBondContact O-N 2.72Å; Q379-Q381 PolarHBondContact O-N 3.1Å; Q379-K385 CarbonylContact C-O 3.52Å; Q379-K385 WeakPolarHBondContact CA-O 3.28Å
380	D	89.6	Confident	92.8	Very high	32 Å²	32	88.9 Å²	88.9	17%	0.171	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	115.5	169.7	-164	-47.9	0	0	0	109.5	K382 Q383 G384 K385 K387	D380-K382 PolarHBondContact O-N 2.63Å; D380-K382 VanDerWaalsContact O-N 3.1Å; D380-K382 WeakPolarHBondContact OD1-CB 3.45Å; D380-K382 PolarHBondContact OD1-N 3.01Å; D380-Q383 PolarHBondContact O-N 3.24Å; D380-Q383 VanDerWaalsContact O-N 3.09Å; D380-G384 PolarHBondContact O-N 2.89Å; D380-K385 PolarHBondContact N-O 3.38Å; D380-K387 HydrophobicContact CB-CD 3.97Å; D380-K387 WeakPolarHBondContact OD2-CD 3.02Å; D380-K387 IonicContact OD2-NZ 3.8Å; D380-K387 PolarHBondContact OD2-NZ 2.86Å
381	Q	84.2	Confident	92.7	Very high	157 Å²	157	84.7 Å²	84.7	73%	0.734	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-25.9	-177.8	-68.8	-147.8	-25.8	0	0	113.7	Q379 P405	Q379-Q381 PolarHBondContact O-N 3.1Å; Q381-P405 HydrophobicContact CG-CG 4.44Å
382	K	84.8	Confident	92.8	Very high	197 Å²	197	80.8 Å²	80.8	86%	0.857	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-25.8	-179.3	-63.7	-175.6	179.5	-177.5	0	112.9	D380	D380-K382 PolarHBondContact O-N 2.63Å; D380-K382 VanDerWaalsContact O-N 3.1Å; D380-K382 WeakPolarHBondContact OD1-CB 3.45Å; D380-K382 PolarHBondContact OD1-N 3.01Å
383	Q	85.4	Confident	92.8	Very high	139 Å²	139	86.9 Å²	86.9	65%	0.65	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.5	-13.4	-169.8	-61.4	-173.5	9.2	0	0	113.7	D380 K385	D380-Q383 PolarHBondContact O-N 3.24Å; D380-Q383 VanDerWaalsContact O-N 3.09Å; Q383-K385 HydrophobicContact CB-CB 4.5Å; Q383-K385 PolarHBondContact O-N 2.77Å
384	G	84	Confident	92.8	Very high	51 Å²	51	81.7 Å²	81.7	53%	0.526	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.6	20.4	-175.9	0	0	0	0	0	113.5	D380	D380-G384 PolarHBondContact O-N 2.89Å
385	K	90.6	Very high	92.6	Very high	145 Å²	145	72.9 Å²	72.9	63%	0.63	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.5	154.3	179.2	-71	-174.9	178.7	-178.7	0	110.2	Q379 D380 Q383 K387	Q379-K385 CarbonylContact C-O 3.52Å; Q379-K385 WeakPolarHBondContact CA-O 3.28Å; D380-K385 PolarHBondContact N-O 3.38Å; Q383-K385 HydrophobicContact CB-CB 4.5Å; Q383-K385 PolarHBondContact O-N 2.77Å; K385-K387 PolarHBondContact O-N 3.2Å
386	D	93.2	Very high	92.3	Very high	62 Å²	62	73.6 Å²	73.6	33%	0.332	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-49.6	126.4	173.5	-61.5	-4.5	0	0	0	111.1	K365 V377 V388	K365-D386 HydrophobicContact CD-CB 3.98Å; K365-D386 IonicContact NZ-OD2 3.38Å; K365-D386 PolarHBondContact NZ-OD2 3.46Å; V377-D386 HydrophobicContact CG1-CB 4.06Å; D386-V388 PolarHBondContact O-N 3.09Å
387	K	95.6	Very high	92.1	Very high	71 Å²	71	73.5 Å²	73.5	31%	0.309	37%	0.366	S	S	.	.			trans	-74.6	122.7	176.9	-174.6	64.7	168.6	-175.9	0	109.3	Y378 D380 K385 F389	Y378-K387 HydrophobicContact CD1-CB 3.63Å; Y378-K387 HydrophobicContact CD1-CG 4.04Å; Y378-K387 HydrophobicContact CE1-CB 4.05Å; Y378-K387 HydrophobicContact CE1-CG 4.09Å; Y378-K387 PolarHBondContact O-N 2.81Å; D380-K387 HydrophobicContact CB-CD 3.97Å; D380-K387 WeakPolarHBondContact OD2-CD 3.02Å; D380-K387 IonicContact OD2-NZ 3.8Å; D380-K387 PolarHBondContact OD2-NZ 2.86Å; K385-K387 PolarHBondContact O-N 3.2Å; K387-F389 HydrophobicContact CB-CE2 4.3Å; K387-F389 HydrophobicContact CG-CD1 4.5Å; K387-F389 HydrophobicContact CG-CD2 4.36Å; K387-F389 HydrophobicContact CG-CE1 4.14Å; K387-F389 HydrophobicContact CG-CE2 3.97Å; K387-F389 HydrophobicContact CG-CZ 3.86Å
388	V	95.9	Very high	92	Very high	52 Å²	52	72 Å²	72	32%	0.315	36%	0.356	S	S	.	.			trans	-96.2	115.2	169.6	-177.3	0	0	0	0	108.8	K365 D386 W417	K365-V388 HydrophobicContact CG-CG2 4.23Å; D386-V388 PolarHBondContact O-N 3.09Å; V388-W417 HydrophobicContact CG1-CG 4.49Å
389	F	96.4	Very high	91.9	Very high	11 Å²	11	76 Å²	76	5%	0.048	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	137.2	174.6	-65.7	-82.8	0	0	0	110.3	S363 Y364 L366 Y378 K387 G391 N401 I403	S363-F389 CarbonylContact C-O 3.6Å; S363-F389 WeakPolarHBondContact CA-O 3.46Å; S363-F389 VanDerWaalsContact CB-O 3.28Å; S363-F389 WeakPolarHBondContact CB-O 3.08Å; Y364-F389 HydrophobicContact CD1-CB 4.18Å; Y364-F389 HydrophobicContact CD2-CB 4.15Å; Y364-F389 HydrophobicContact CD2-CD2 4.24Å; Y364-F389 HydrophobicContact CE1-CB 3.81Å; Y364-F389 HydrophobicContact CE2-CB 3.8Å; Y364-F389 AromaticContact CE2-CD2 3.9Å; Y364-F389 HydrophobicContact CE2-CD2 3.9Å; Y364-F389 HydrophobicContact CE2-CG 4.02Å; Y364-F389 HydrophobicContact CG-CB 4.34Å; Y364-F389 PolarHBondContact N-O 2.8Å; Y364-F389 PolarHBondContact O-N 2.97Å; L366-F389 HydrophobicContact CB-CD2 4.38Å; L366-F389 HydrophobicContact CB-CE2 3.81Å; L366-F389 HydrophobicContact CD2-CE2 4.49Å; Y378-F389 AromaticContact CD1-CE2 3.81Å; Y378-F389 HydrophobicContact CD1-CE2 3.81Å; Y378-F389 AromaticContact CD1-CZ 3.57Å; Y378-F389 HydrophobicContact CD1-CZ 3.57Å; Y378-F389 HydrophobicContact CE1-CE2 4.44Å; Y378-F389 AromaticContact CE1-CZ 3.75Å; Y378-F389 HydrophobicContact CE1-CZ 3.75Å; K387-F389 HydrophobicContact CB-CE2 4.3Å; K387-F389 HydrophobicContact CG-CD1 4.5Å; K387-F389 HydrophobicContact CG-CD2 4.36Å; K387-F389 HydrophobicContact CG-CE1 4.14Å; K387-F389 HydrophobicContact CG-CE2 3.97Å; K387-F389 HydrophobicContact CG-CZ 3.86Å; F389-G391 PolarHBondContact O-N 3.11Å; F389-N401 HydrophobicContact CD1-CB 3.72Å; F389-N401 HydrophobicContact CE1-CB 4.33Å; F389-N401 HydrophobicContact CG-CB 4.41Å; F389-I403 HydrophobicContact CZ-CG1 4.26Å
390	Q	96.1	Very high	91.8	Very high	99 Å²	99	73.5 Å²	73.5	46%	0.463	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	122.1	173.2	-65	-62.5	-35.8	0	0	109	R399 N401	Q390-R399 WeakPolarHBondContact O-CG 3.44Å; Q390-N401 PolarHBondContact O-ND2 3.14Å; Q390-N401 PolarHBondContact O-OD1 2.89Å
391	G	94.4	Very high	91.9	Very high	0 Å²	0	72.9 Å²	72.9	0%	0	36%	0.355	C	S	.	.			trans	-89.3	-143.8	-179.4	0	0	0	0	0	112.4	G362 F389 R399	G362-G391 WeakPolarHBondContact O-CA 3.14Å; G362-G391 PolarHBondContact O-N 2.85Å; F389-G391 PolarHBondContact O-N 3.11Å; G391-R399 WeakPolarHBondContact O-CD 3.48Å; G391-R399 VanDerWaalsContact O-CG 3.28Å; G391-R399 WeakPolarHBondContact O-CG 3.44Å
392	N	95.9	Very high	92.3	Very high	3 Å²	3	67.4 Å²	67.4	2%	0.016	33%	0.333	C	S	.	.			trans	-86.9	155.9	-174.3	-60.3	87.2	0	0	0	111.8	T349 Q350 F360 V361 G362 D394 T397	T349-N392 VanDerWaalsContact CB-OD1 3.27Å; T349-N392 WeakPolarHBondContact CB-OD1 2.93Å; T349-N392 PolarHBondContact O-ND2 2.78Å; T349-N392 PolarHBondContact OG1-OD1 2.04Å; Q350-N392 WeakPolarHBondContact CA-ND2 3.19Å; Q350-N392 PolarHBondContact N-OD1 2.84Å; F360-N392 HydrophobicContact CB-CB 4.14Å; F360-N392 HydrophobicContact CD2-CB 4.11Å; F360-N392 WeakPolarHBondContact CD2-O 3.47Å; F360-N392 WeakPolarHBondContact CE2-O 3.32Å; F360-N392 HydrophobicContact CG-CB 4.34Å; V361-N392 PolarHBondContact O-N 3.14Å; G362-N392 WeakPolarHBondContact CA-O 3.28Å; N392-D394 WeakPolarHBondContact CB-O 3.45Å; N392-T397 PolarHBondContact ND2-O 3.27Å
393	F	93.7	Very high	92.6	Very high	151 Å²	151	58.2 Å²	58.2	66%	0.662	29%	0.293	S	S	*	.	S	Bend	trans	-112.8	-6.2	172.1	-60.8	-80.4	0	0	0	112.4	F360	F360-F393 VanDerWaalsContact CZ-C 3.44Å; F360-F393 VanDerWaalsContact CZ-O 3.3Å; F360-F393 WeakPolarHBondContact CZ-O 3.41Å
394	D	92.8	Very high	92.8	Very high	55 Å²	55	57.7 Å²	57.7	29%	0.294	29%	0.294	S	S	.	.	S	Bend	trans	-149.2	-175.6	178.3	67.1	46.7	0	0	0	109.4	N392 D396 T397	N392-D394 WeakPolarHBondContact CB-O 3.45Å; D394-D396 PolarHBondContact OD1-N 2.69Å; D394-T397 VanDerWaalsContact CG-OG1 3.31Å; D394-T397 VanDerWaalsContact OD1-CB 3.25Å; D394-T397 WeakPolarHBondContact OD1-CB 3.05Å; D394-T397 PolarHBondContact OD1-N 2.85Å; D394-T397 PolarHBondContact OD1-OG1 3Å; D394-T397 VanDerWaalsContact OD2-CB 3.23Å; D394-T397 WeakPolarHBondContact OD2-CB 3.43Å; D394-T397 PolarHBondContact OD2-OG1 2.87Å
395	N	91.9	Very high	93.1	Very high	12 Å²	12	57.4 Å²	57.4	6%	0.064	28%	0.284	C	S	.	.	S	Bend	trans	-90.9	-14.9	-176.8	69.3	-71.1	0	0	0	115.7	G351 A352 K353 V358 R426	G351-N395 CarbonylContact C-O 3.53Å; G351-N395 WeakPolarHBondContact CA-O 3.45Å; G351-N395 PolarHBondContact N-O 3.28Å; A352-N395 WeakPolarHBondContact O-CB 3.48Å; K353-N395 WeakPolarHBondContact CD-ND2 3.29Å; K353-N395 WeakPolarHBondContact CE-ND2 3.25Å; K353-N395 WeakPolarHBondContact CE-OD1 3.05Å; K353-N395 HydrophobicContact CG-CB 4.09Å; K353-N395 WeakPolarHBondContact CG-ND2 3.32Å; K353-N395 PolarHBondContact NZ-ND2 3.37Å; K353-N395 VanDerWaalsContact NZ-ND2 3.15Å; K353-N395 PolarHBondContact NZ-OD1 3.48Å; V358-N395 HydrophobicContact CG1-CB 4.11Å; N395-R426 PolarHBondContact O-NH2 3.43Å
396	D	89.6	Confident	93.2	Very high	79 Å²	79	52.7 Å²	52.7	42%	0.422	27%	0.268	S	S	.	.	S	Bend	trans	-122.6	-30.2	-166.1	-72.1	-39.4	0	0	0	113.5	Q350 K353 D394 H398 R426	Q350-D396 PolarHBondContact NE2-O 2.99Å; K353-D396 IonicContact NZ-OD2 2.72Å; K353-D396 PolarHBondContact NZ-OD2 3.23Å; D394-D396 PolarHBondContact OD1-N 2.69Å; D396-H398 PolarHBondContact O-N 3.09Å; D396-R426 IonicContact OD1-NH2 3.86Å; D396-R426 PolarHBondContact OD1-NH2 3.29Å
397	T	92.4	Very high	93.2	Very high	59 Å²	59	50.2 Å²	50.2	36%	0.362	26%	0.255	S	S	.	.	S	Bend	trans	-70.8	128.5	179.5	-56.6	0	0	0	0	110.1	N392 D394	N392-T397 PolarHBondContact ND2-O 3.27Å; D394-T397 VanDerWaalsContact CG-OG1 3.31Å; D394-T397 VanDerWaalsContact OD1-CB 3.25Å; D394-T397 WeakPolarHBondContact OD1-CB 3.05Å; D394-T397 PolarHBondContact OD1-N 2.85Å; D394-T397 PolarHBondContact OD1-OG1 3Å; D394-T397 VanDerWaalsContact OD2-CB 3.23Å; D394-T397 WeakPolarHBondContact OD2-CB 3.43Å; D394-T397 PolarHBondContact OD2-OG1 2.87Å
398	H	94.5	Very high	93.1	Very high	17 Å²	17	51.4 Å²	51.4	8%	0.079	26%	0.258	C	S	.	.			trans	-68.6	136.5	174	-61.5	161.1	0	0	0	110.9	G122 I124 D315 I348 Q350 D396	G122-H398 VanDerWaalsContact CA-CE1 3.5Å; G122-H398 WeakPolarHBondContact CA-CE1 3.3Å; G122-H398 WeakPolarHBondContact CA-ND1 3.33Å; G122-H398 VanDerWaalsContact O-CB 3.27Å; G122-H398 WeakPolarHBondContact O-CB 3.34Å; G122-H398 VanDerWaalsContact O-CG 3.23Å; G122-H398 PolarHBondContact O-N 3.42Å; G122-H398 PolarHBondContact O-ND1 2.67Å; I124-H398 HydrophobicContact CD1-CB 4.29Å; I124-H398 HydrophobicContact CG1-CB 3.56Å; D315-H398 VanDerWaalsContact CG-NE2 3.31Å; D315-H398 IonicContact OD1-CD2 2.8Å; D315-H398 IonicContact OD1-CE1 3.76Å; D315-H398 PolarHBondContact OD1-CE1 3.04Å; D315-H398 IonicContact OD1-NE2 3.66Å; D315-H398 PolarHBondContact OD1-NE2 3.08Å; D315-H398 IonicContact OD2-CE1 3.59Å; D315-H398 PolarHBondContact OD2-CE1 2.99Å; D315-H398 VanDerWaalsContact OD2-CE1 3.27Å; D315-H398 IonicContact OD2-NE2 2.87Å; D315-H398 PolarHBondContact OD2-NE2 2.89Å; I348-H398 HydrophobicContact CG2-CB 3.81Å; Q350-H398 PolarHBondContact NE2-CD2 3.37Å; Q350-H398 VanDerWaalsContact NE2-CD2 3.34Å; Q350-H398 PolarHBondContact NE2-NE2 2.87Å; D396-H398 PolarHBondContact O-N 3.09Å
399	R	94.2	Very high	93.1	Very high	101 Å²	101	48.9 Å²	48.9	38%	0.381	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	109.7	169.3	-175	74.2	-177.3	164.1	1	109.5	I348 T349 Q390 G391	I348-R399 CarbonylContact C-O 3.03Å; I348-R399 VanDerWaalsContact CA-O 3.29Å; I348-R399 WeakPolarHBondContact CA-O 3.31Å; T349-R399 PolarHBondContact N-O 2.81Å; T349-R399 PolarHBondContact O-N 2.78Å; Q390-R399 WeakPolarHBondContact O-CG 3.44Å; G391-R399 WeakPolarHBondContact O-CD 3.48Å; G391-R399 VanDerWaalsContact O-CG 3.28Å; G391-R399 WeakPolarHBondContact O-CG 3.44Å
400	K	92.4	Very high	93.1	Very high	50 Å²	50	52.2 Å²	52.2	22%	0.217	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	125.9	172.6	-176.6	175.9	169	179.9	0	109.9	I124 E271 I348 L430	I124-K400 HydrophobicContact CD1-CB 4.17Å; I124-K400 HydrophobicContact CG1-CB 4.29Å; I124-K400 HydrophobicContact CG2-CB 3.7Å; I124-K400 HydrophobicContact CG2-CD 4.31Å; E271-K400 WeakPolarHBondContact OE1-CE 3.35Å; E271-K400 IonicContact OE1-NZ 3.66Å; E271-K400 PolarHBondContact OE1-NZ 3.29Å; I348-K400 HydrophobicContact CG1-CB 4.13Å; I348-K400 HydrophobicContact CG1-CG 4.12Å; K400-L430 HydrophobicContact CD-CD1 3.97Å; K400-L430 HydrophobicContact CG-CD1 4.27Å
401	N	93.1	Very high	93.2	Very high	19 Å²	19	48.6 Å²	48.6	10%	0.102	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	130.7	166.8	-73	-63.3	0	0	0	109.2	G346 I347 Y364 F389 Q390	G346-N401 CarbonylContact C-O 3.57Å; G346-N401 WeakPolarHBondContact CA-O 3.47Å; I347-N401 PolarHBondContact N-O 2.83Å; I347-N401 PolarHBondContact O-N 2.9Å; Y364-N401 WeakPolarHBondContact OH-CB 3.26Å; Y364-N401 PolarHBondContact OH-ND2 3.38Å; F389-N401 HydrophobicContact CD1-CB 3.72Å; F389-N401 HydrophobicContact CE1-CB 4.33Å; F389-N401 HydrophobicContact CG-CB 4.41Å; Q390-N401 PolarHBondContact O-ND2 3.14Å; Q390-N401 PolarHBondContact O-OD1 2.89Å
402	V	90.6	Very high	93.4	Very high	42 Å²	42	48.7 Å²	48.7	26%	0.255	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	138.1	175	179.6	0	0	0	0	108.5
403	I	92	Very high	93.5	Very high	5 Å²	5	50.8 Å²	50.8	3%	0.026	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	107.3	178.1	-61.6	162.5	0	0	0	106.6	V344 T345 I347 L366 Y378 F389 P405 V407	V344-I403 HydrophobicContact CG1-CD1 3.82Å; T345-I403 PolarHBondContact O-N 3.33Å; I347-I403 HydrophobicContact CD1-CD1 4.17Å; I347-I403 HydrophobicContact CG1-CD1 4.05Å; L366-I403 HydrophobicContact CD2-CD1 3.51Å; L366-I403 HydrophobicContact CD2-CG1 4.07Å; Y378-I403 HydrophobicContact CD2-CG2 4.25Å; Y378-I403 HydrophobicContact CE1-CG2 4.47Å; Y378-I403 HydrophobicContact CE2-CG2 3.7Å; F389-I403 HydrophobicContact CZ-CG1 4.26Å; I403-P405 WeakPolarHBondContact CG2-O 3.5Å; I403-P405 CarbonylContact O-C 3.29Å; I403-V407 HydrophobicContact CG2-CG2 3.81Å
404	D	88.6	Confident	93.7	Very high	127 Å²	127	43.7 Å²	43.7	68%	0.679	22%	0.215	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-134.9	112.5	-177.5	-176.6	26.7	0	0	0	109.8	Y378	Y378-D404 PolarHBondContact OH-N 2.94Å; Y378-D404 PolarHBondContact OH-O 2.76Å
405	P	90.8	Very high	93.9	Very high	46 Å²	46	42.9 Å²	42.9	30%	0.299	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	cis	-70	153.9	1.9	31	-37.4	0	0	0	113.8	Y378 Q381 I403	Y378-P405 WeakPolarHBondContact OH-CD 3.43Å; Y378-P405 PolarHBondContact OH-O 3.02Å; Q381-P405 HydrophobicContact CG-CG 4.44Å; I403-P405 WeakPolarHBondContact CG2-O 3.5Å; I403-P405 CarbonylContact O-C 3.29Å
406	P	92.4	Very high	94.2	Very high	46 Å²	46	42.4 Å²	42.4	30%	0.299	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	153.7	178.9	29.3	-36.2	0	0	0	112.1	K343 V344 T345	K343-P406 HydrophobicContact CG-CB 4.15Å; V344-P406 WeakPolarHBondContact O-CA 3.47Å; V344-P406 WeakPolarHBondContact O-CB 3.32Å; T345-P406 HydrophobicContact CG2-CB 4.03Å
407	V	94.1	Very high	94.6	Very high	9 Å²	9	43.5 Å²	43.5	6%	0.055	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	137.5	-177.2	171.9	0	0	0	0	110.1	V344 Y368 Y378 I403 A409	V344-V407 PolarHBondContact N-O 3.26Å; V344-V407 PolarHBondContact O-N 2.78Å; Y368-V407 HydrophobicContact CD1-CG1 3.69Å; Y368-V407 HydrophobicContact CD1-CG2 4.25Å; Y368-V407 HydrophobicContact CD2-CG1 3.41Å; Y368-V407 VanDerWaalsContact CD2-CG1 3.41Å; Y368-V407 HydrophobicContact CE1-CG1 4.07Å; Y368-V407 HydrophobicContact CE1-CG2 4.16Å; Y368-V407 HydrophobicContact CE2-CG1 3.81Å; Y368-V407 HydrophobicContact CG-CG1 3.34Å; Y378-V407 HydrophobicContact CD2-CG2 3.51Å; Y378-V407 HydrophobicContact CE2-CG2 3.72Å; I403-V407 HydrophobicContact CG2-CG2 3.81Å; V407-A409 HydrophobicContact CG1-CB 4Å
408	Y	93.9	Very high	94.8	Very high	96 Å²	96	43.1 Å²	43.1	38%	0.376	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	109	172	-72.9	-94.6	0	0	0	109.7	K343 E434	K343-Y408 HydrophobicContact CB-CD1 4.05Å; K343-Y408 HydrophobicContact CB-CE1 3.69Å; K343-Y408 HydrophobicContact CD-CE1 4Å; K343-Y408 HydrophobicContact CD-CE2 4.3Å; K343-Y408 VanDerWaalsContact CD-OH 3.31Å; K343-Y408 WeakPolarHBondContact CD-OH 3.46Å; K343-Y408 VanDerWaalsContact CE-OH 3.22Å; K343-Y408 WeakPolarHBondContact CE-OH 3.27Å; K343-Y408 HydrophobicContact CG-CD1 4.38Å; K343-Y408 HydrophobicContact CG-CE1 3.85Å; K343-Y408 HydrophobicContact CG-CE2 4.13Å; K343-Y408 PolarHBondContact NZ-OH 3.04Å; Y408-E434 WeakPolarHBondContact CE1-OE2 3.46Å; Y408-E434 PolarHBondContact OH-OE1 3.01Å
409	A	95.6	Very high	95	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	149.9	-175.1	0	0	0	0	0	112.4	T342 Y368 N370 V407	T342-A409 PolarHBondContact N-O 2.8Å; T342-A409 PolarHBondContact O-N 2.8Å; T342-A409 VanDerWaalsContact O-N 3.08Å; Y368-A409 HydrophobicContact CD2-CB 4.19Å; Y368-A409 HydrophobicContact CG-CB 4.38Å; N370-A409 WeakPolarHBondContact OD1-CA 3.19Å; V407-A409 HydrophobicContact CG1-CB 4Å
410	R	96.2	Very high	95.1	Very high	81 Å²	81	47.6 Å²	47.6	31%	0.306	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	-42.7	165.1	175	177.9	166.5	179.1	-2.2	111.3	D337 L338 L339 S369 N370	D337-R410 VanDerWaalsContact OD1-CG 3.29Å; D337-R410 WeakPolarHBondContact OD1-CG 3.43Å; D337-R410 IonicContact OD1-CZ 2.74Å; D337-R410 IonicContact OD1-NE 2.84Å; D337-R410 PolarHBondContact OD1-NE 3.18Å; D337-R410 IonicContact OD1-NH2 3.77Å; D337-R410 IonicContact OD2-CZ 3.13Å; D337-R410 IonicContact OD2-NE 3.57Å; D337-R410 IonicContact OD2-NH2 3.04Å; D337-R410 PolarHBondContact OD2-NH2 3.14Å; L338-R410 VanDerWaalsContact CB-O 3.28Å; L338-R410 WeakPolarHBondContact CB-O 3.25Å; L338-R410 WeakPolarHBondContact CG-O 3.38Å; L338-R410 PolarHBondContact N-O 3.39Å; L339-R410 PolarHBondContact O-NE 2.93Å; S369-R410 PolarHBondContact O-N 2.79Å; N370-R410 PolarHBondContact OD1-N 3.14Å
411	F	98.1	Very high	95.2	Very high	22 Å²	22	47.8 Å²	47.8	10%	0.096	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	133.6	-178.5	-58.1	-86.5	0	0	0	110.9	V336 D337 Y368 S369 W375	V336-F411 WeakPolarHBondContact O-CA 3.49Å; D337-F411 HydrophobicContact CB-CD1 3.77Å; D337-F411 HydrophobicContact CB-CE1 3.65Å; D337-F411 WeakPolarHBondContact OD2-CE1 3.46Å; Y368-F411 VanDerWaalsContact CA-O 3.29Å; Y368-F411 WeakPolarHBondContact CA-O 3.49Å; S369-F411 PolarHBondContact N-O 3.24Å; S369-F411 PolarHBondContact O-N 2.8Å; W375-F411 HydrophobicContact CH2-CB 3.55Å; W375-F411 HydrophobicContact CH2-CG 4.43Å; W375-F411 HydrophobicContact CZ2-CB 4.27Å; W375-F411 HydrophobicContact CZ3-CB 4.1Å
412	V	98.1	Very high	95.3	Very high	3 Å²	3	51 Å²	51	2%	0.018	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	127.7	177.2	-176.8	0	0	0	0	109.2	Q335 V336 L338 V344 I347 L366 I429	Q335-V412 CarbonylContact C-O 3.54Å; Q335-V412 VanDerWaalsContact CA-O 3.3Å; Q335-V412 WeakPolarHBondContact CA-O 3.36Å; V336-V412 PolarHBondContact N-O 3.09Å; V336-V412 PolarHBondContact O-N 3.5Å; L338-V412 HydrophobicContact CD1-CG2 4.1Å; V344-V412 HydrophobicContact CG2-CG2 3.95Å; I347-V412 HydrophobicContact CD1-CG1 4.29Å; L366-V412 HydrophobicContact CD1-CG1 3.48Å; L366-V412 VanDerWaalsContact CD1-CG1 3.48Å; V412-I429 HydrophobicContact CB-CD1 4.21Å; V412-I429 HydrophobicContact CG1-CD1 4.4Å
413	R	97.9	Very high	95.7	Very high	47 Å²	47	49 Å²	49	18%	0.177	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	126.7	175.2	-88	-179.1	-173.2	168.6	7	111.1	W333 L334 Q335 A367 W375 L415	W333-R413 HydrophobicContact CE3-CG 4.31Å; L334-R413 CarbonylContact O-C 3.34Å; L334-R413 VanDerWaalsContact O-CA 3.31Å; L334-R413 WeakPolarHBondContact O-CA 3.46Å; Q335-R413 HydrophobicContact CB-CG 3.77Å; Q335-R413 HydrophobicContact CG-CG 3.99Å; Q335-R413 VanDerWaalsContact OE1-CZ 3.23Å; A367-R413 HydrophobicContact CB-CB 4.05Å; A367-R413 PolarHBondContact N-O 2.92Å; A367-R413 PolarHBondContact O-N 3.07Å; W375-R413 VanDerWaalsContact CE2-NH1 3.35Å; W375-R413 HydrophobicContact CE3-CB 4.27Å; W375-R413 HydrophobicContact CE3-CG 4.16Å; W375-R413 HydrophobicContact CH2-CB 4.32Å; W375-R413 VanDerWaalsContact CH2-CD 3.47Å; W375-R413 HydrophobicContact CH2-CG 3.51Å; W375-R413 VanDerWaalsContact CH2-NE 3.31Å; W375-R413 HydrophobicContact CZ2-CG 4.33Å; W375-R413 VanDerWaalsContact CZ2-NH2 3.33Å; W375-R413 HydrophobicContact CZ3-CB 3.73Å; W375-R413 VanDerWaalsContact CZ3-CD 3.46Å; W375-R413 HydrophobicContact CZ3-CG 3.43Å; W375-R413 VanDerWaalsContact CZ3-CG 3.43Å; R413-L415 HydrophobicContact CB-CD2 4.03Å
414	I	98.3	Very high	95.9	Very high	2 Å²	2	48.8 Å²	48.8	1%	0.01	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	121	169.4	-60.9	170	0	0	0	107	W333 L334 I347 Y364 P416 L425 V427	W333-I414 WeakPolarHBondContact CA-O 3.48Å; L334-I414 PolarHBondContact N-O 2.77Å; L334-I414 PolarHBondContact O-N 2.93Å; I347-I414 HydrophobicContact CD1-CD1 4.48Å; I347-I414 HydrophobicContact CD1-CG1 4.27Å; I347-I414 HydrophobicContact CG2-CD1 4.01Å; Y364-I414 HydrophobicContact CD2-CG2 3.79Å; Y364-I414 HydrophobicContact CE2-CG2 4.45Å; Y364-I414 HydrophobicContact CG-CG2 3.95Å; I414-P416 WeakPolarHBondContact O-CD 3.38Å; I414-L425 HydrophobicContact CG2-CD1 3.8Å; I414-V427 HydrophobicContact CD1-CB 4.1Å; I414-V427 HydrophobicContact CD1-CG1 3.66Å; I414-V427 HydrophobicContact CD1-CG2 4.27Å
415	L	98	Very high	96.3	Very high	38 Å²	38	42.7 Å²	42.7	20%	0.199	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	100	-177	-48.8	-178.9	0	0	0	109.2	W333 Y364 K365 A367 R413 W417	W333-L415 HydrophobicContact CB-CD2 3.55Å; Y364-L415 CarbonylContact C-O 3.6Å; Y364-L415 WeakPolarHBondContact CA-O 3.43Å; Y364-L415 WeakPolarHBondContact CB-O 3.46Å; K365-L415 HydrophobicContact CB-CB 4.17Å; K365-L415 HydrophobicContact CB-CD1 4.38Å; K365-L415 PolarHBondContact N-O 3.3Å; K365-L415 PolarHBondContact O-N 3.42Å; A367-L415 HydrophobicContact CB-CD1 3.89Å; A367-L415 HydrophobicContact CB-CG 4.28Å; R413-L415 HydrophobicContact CB-CD2 4.03Å; L415-W417 PolarHBondContact O-N 2.9Å
416	P	98	Very high	96.7	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.006	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60	131.3	179.7	-24.6	38.2	0	0	0	111.6	W323 Q332 V361 I414 W419 I423 L425	W323-P416 HydrophobicContact CZ3-CG 4.47Å; Q332-P416 WeakPolarHBondContact O-CD 3.45Å; V361-P416 HydrophobicContact CG1-CB 4.13Å; V361-P416 HydrophobicContact CG2-CB 4.04Å; V361-P416 HydrophobicContact CG2-CG 4.26Å; I414-P416 WeakPolarHBondContact O-CD 3.38Å; P416-W419 HydrophobicContact CB-CE3 4.36Å; P416-I423 HydrophobicContact CB-CD1 4.13Å; P416-I423 HydrophobicContact CB-CG1 4.23Å; P416-I423 HydrophobicContact CB-CG2 3.76Å; P416-I423 HydrophobicContact CG-CG2 3.44Å; P416-I423 VanDerWaalsContact CG-CG2 3.44Å; P416-L425 HydrophobicContact CG-CD1 4.36Å
417	W	97	Very high	96.9	Very high	103 Å²	103	38.4 Å²	38.4	39%	0.39	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	-39.5	-176.3	-174.6	-105.7	0	0	0	112.5	Q330 S363 K365 V388 L415	Q330-W417 HydrophobicContact CG-CE3 4.31Å; Q330-W417 HydrophobicContact CG-CZ3 4.42Å; Q330-W417 PolarHBondContact NE2-O 3.07Å; S363-W417 PolarHBondContact O-N 2.85Å; K365-W417 HydrophobicContact CD-CE3 4.32Å; V388-W417 HydrophobicContact CG1-CG 4.49Å; L415-W417 PolarHBondContact O-N 2.9Å
418	S	97.6	Very high	97	Very high	50 Å²	50	38.2 Å²	38.2	35%	0.35	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	152.9	168.5	71.9	0	0	0	0	110.6	V361 G362 S363	V361-S418 CarbonylContact C-O 3.58Å; G362-S418 PolarHBondContact N-O 2.87Å; S363-S418 WeakPolarHBondContact CB-OG 3.44Å; S363-S418 PolarHBondContact N-O 3.1Å; S363-S418 VanDerWaalsContact N-O 3.11Å; S363-S418 PolarHBondContact N-OG 3.29Å; S363-S418 VanDerWaalsContact N-OG 3.14Å; S363-S418 PolarHBondContact O-N 2.85Å; S363-S418 VanDerWaalsContact O-N 3.15Å; S363-S418 WeakPolarHBondContact OG-CB 3.43Å; S363-S418 PolarHBondContact OG-N 3.08Å; S363-S418 PolarHBondContact OG-OG 2.85Å
419	W	97.8	Very high	97.1	Very high	74 Å²	74	33.7 Å²	33.7	28%	0.28	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	164.6	-176	53.6	88	0	0	0	111.5	S328 Q330 F360 P416 I423	S328-W419 VanDerWaalsContact C-CZ2 3.46Å; S328-W419 VanDerWaalsContact O-CZ2 3.25Å; S328-W419 WeakPolarHBondContact O-CZ2 3.48Å; Q330-W419 HydrophobicContact CG-CH2 4.17Å; Q330-W419 HydrophobicContact CG-CZ3 4.21Å; F360-W419 CarbonylContact O-C 3.51Å; F360-W419 VanDerWaalsContact O-CA 3.29Å; F360-W419 WeakPolarHBondContact O-CA 3.14Å; F360-W419 WeakPolarHBondContact O-CB 3.45Å; P416-W419 HydrophobicContact CB-CE3 4.36Å; W419-I423 HydrophobicContact CB-CG1 4.24Å; W419-I423 HydrophobicContact CD2-CD1 4.01Å; W419-I423 HydrophobicContact CD2-CG1 3.43Å; W419-I423 VanDerWaalsContact CD2-CG1 3.43Å; W419-I423 HydrophobicContact CE3-CD1 3.83Å; W419-I423 HydrophobicContact CE3-CG1 3.6Å; W419-I423 HydrophobicContact CG-CG1 3.7Å; W419-I423 HydrophobicContact CH2-CD1 4.12Å; W419-I423 HydrophobicContact CZ2-CD1 4.29Å; W419-I423 HydrophobicContact CZ2-CG1 4.45Å; W419-I423 HydrophobicContact CZ3-CD1 3.88Å; W419-I423 HydrophobicContact CZ3-CG1 4.19Å
420	Y	97	Very high	97	Very high	139 Å²	139	34.1 Å²	34.1	55%	0.545	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	129.1	171.2	-179.1	-92.3	0	0	0	109.3	V358 Q359 F360 R422	V358-Y420 HydrophobicContact CB-CE1 4.34Å; V358-Y420 HydrophobicContact CG1-CD1 4.16Å; V358-Y420 HydrophobicContact CG1-CE1 4.22Å; V358-Y420 WeakPolarHBondContact O-CD1 3.48Å; V358-Y420 WeakPolarHBondContact O-CE1 3.3Å; Q359-Y420 WeakPolarHBondContact CA-O 3.28Å; F360-Y420 HydrophobicContact CD1-CD1 4.2Å; F360-Y420 HydrophobicContact CD1-CG 4.47Å; F360-Y420 AromaticContact CE1-CD1 3.65Å; F360-Y420 HydrophobicContact CE1-CD1 3.65Å; F360-Y420 AromaticContact CE1-CG 3.75Å; F360-Y420 HydrophobicContact CE1-CG 3.75Å; F360-Y420 HydrophobicContact CZ-CD1 4.2Å; F360-Y420 AromaticContact CZ-CG 3.8Å; F360-Y420 HydrophobicContact CZ-CG 3.8Å; F360-Y420 PolarHBondContact N-O 2.9Å; F360-Y420 VanDerWaalsContact N-O 3.14Å; F360-Y420 PolarHBondContact O-N 3.18Å; Y420-R422 PolarHBondContact O-N 3.27Å
421	G	94.8	Very high	96.8	Very high	53 Å²	53	30.3 Å²	30.3	55%	0.546	15%	0.145	S	C	.	.	S	Bend	trans	71	-108.1	-172.1	0	0	0	0	0	110.9
422	R	95.1	Very high	96.4	Very high	87 Å²	87	29.8 Å²	29.8	33%	0.328	14%	0.143	S	C	.	.	S	Bend	trans	-112.8	160	174.1	-56.5	178.6	176.6	-83.5	-3.7	110.7	T324 Y420 T424	T324-R422 HydrophobicContact CG2-CB 3.88Å; Y420-R422 PolarHBondContact O-N 3.27Å; R422-T424 PolarHBondContact O-N 3.44Å
423	I	97.8	Very high	95.7	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.162	C	C	.	.			trans	-64.4	102.7	170.5	-63.4	173.4	0	0	0	108.5	W323 T324 A325 D329 Q332 V361 P416 W419	W323-I423 HydrophobicContact CH2-CG2 4.05Å; W323-I423 HydrophobicContact CZ3-CG2 3.99Å; T324-I423 CarbonylContact C-O 3.53Å; T324-I423 VanDerWaalsContact CA-O 3.23Å; T324-I423 WeakPolarHBondContact CA-O 3.25Å; A325-I423 HydrophobicContact CB-CB 3.89Å; A325-I423 HydrophobicContact CB-CD1 4.42Å; A325-I423 HydrophobicContact CB-CG2 3.97Å; A325-I423 PolarHBondContact N-O 3.32Å; D329-I423 WeakPolarHBondContact O-CD1 3.31Å; Q332-I423 HydrophobicContact CB-CD1 3.96Å; Q332-I423 HydrophobicContact CG-CD1 3.88Å; V361-I423 HydrophobicContact CG2-CG2 3.99Å; P416-I423 HydrophobicContact CB-CD1 4.13Å; P416-I423 HydrophobicContact CB-CG1 4.23Å; P416-I423 HydrophobicContact CB-CG2 3.76Å; P416-I423 HydrophobicContact CG-CG2 3.44Å; P416-I423 VanDerWaalsContact CG-CG2 3.44Å; W419-I423 HydrophobicContact CB-CG1 4.24Å; W419-I423 HydrophobicContact CD2-CD1 4.01Å; W419-I423 HydrophobicContact CD2-CG1 3.43Å; W419-I423 VanDerWaalsContact CD2-CG1 3.43Å; W419-I423 HydrophobicContact CE3-CD1 3.83Å; W419-I423 HydrophobicContact CE3-CG1 3.6Å; W419-I423 HydrophobicContact CG-CG1 3.7Å; W419-I423 HydrophobicContact CH2-CD1 4.12Å; W419-I423 HydrophobicContact CZ2-CD1 4.29Å; W419-I423 HydrophobicContact CZ2-CG1 4.45Å; W419-I423 HydrophobicContact CZ3-CD1 3.88Å; W419-I423 HydrophobicContact CZ3-CG1 4.19Å
424	T	97.4	Very high	94.4	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	129.9	-178.6	-61.5	0	0	0	0	110.6	W307 A322 W323 T324 A352 Q359 V361 R422	W307-T424 HydrophobicContact CE3-CG2 4.42Å; W307-T424 HydrophobicContact CZ3-CG2 4.25Å; A322-T424 HydrophobicContact CB-CG2 3.65Å; W323-T424 CarbonylContact O-C 3.48Å; W323-T424 VanDerWaalsContact O-CA 3.25Å; W323-T424 WeakPolarHBondContact O-CA 3.34Å; T324-T424 WeakPolarHBondContact CG2-OG1 3.47Å; T324-T424 WeakPolarHBondContact OG1-CG2 3.44Å; T324-T424 PolarHBondContact OG1-OG1 2.78Å; A352-T424 HydrophobicContact CB-CG2 3.63Å; Q359-T424 PolarHBondContact OE1-OG1 3.05Å; Q359-T424 VanDerWaalsContact OE1-OG1 3.09Å; V361-T424 PolarHBondContact N-O 3.13Å; R422-T424 PolarHBondContact O-N 3.44Å
425	L	97	Very high	92.4	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	136.4	-174.5	-80.1	170.7	0	0	0	112.9	W323 T349 V361 I414 P416 V427	W323-L425 HydrophobicContact CE3-CB 4.13Å; W323-L425 HydrophobicContact CE3-CD1 4.42Å; W323-L425 HydrophobicContact CZ3-CD1 4.08Å; W323-L425 PolarHBondContact N-O 2.77Å; W323-L425 PolarHBondContact O-N 3.38Å; T349-L425 HydrophobicContact CG2-CD2 4.2Å; V361-L425 HydrophobicContact CB-CD1 4.43Å; V361-L425 HydrophobicContact CB-CD2 3.8Å; V361-L425 HydrophobicContact CB-CG 4.06Å; V361-L425 HydrophobicContact CG2-CD1 3.88Å; V361-L425 HydrophobicContact CG2-CD2 3.92Å; V361-L425 HydrophobicContact CG2-CG 3.57Å; I414-L425 HydrophobicContact CG2-CD1 3.8Å; P416-L425 HydrophobicContact CG-CD1 4.36Å; L425-V427 HydrophobicContact CB-CG1 4.06Å; L425-V427 HydrophobicContact CD2-CG1 4.26Å
426	R	97.9	Very high	89.6	Confident	1 Å²	1	54.1 Å²	54.1	0%	0.004	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	134.3	154.8	-72.2	-179.3	-76.9	178.8	2.7	107.3	R313 K316 N321 A322 T349 Q350 G351 N395 D396	R313-R426 WeakPolarHBondContact O-CB 3.33Å; R313-R426 WeakPolarHBondContact O-CD 3.4Å; R313-R426 WeakPolarHBondContact O-CG 3.49Å; K316-R426 PolarHBondContact O-NH1 2.99Å; K316-R426 VanDerWaalsContact O-NH1 3.07Å; N321-R426 PolarHBondContact ND2-NH1 2.69Å; N321-R426 WeakPolarHBondContact O-CD 3.38Å; N321-R426 VanDerWaalsContact O-CG 3.26Å; N321-R426 WeakPolarHBondContact O-CG 3.05Å; A322-R426 HydrophobicContact CB-CG 3.67Å; T349-R426 CarbonylContact C-O 3.53Å; T349-R426 WeakPolarHBondContact CA-O 3.33Å; Q350-R426 HydrophobicContact CB-CB 4.05Å; Q350-R426 VanDerWaalsContact CD-NH2 3.25Å; Q350-R426 PolarHBondContact N-O 2.83Å; Q350-R426 PolarHBondContact O-N 3.17Å; Q350-R426 VanDerWaalsContact OE1-NE 3.08Å; G351-R426 PolarHBondContact O-NE 2.63Å; G351-R426 PolarHBondContact O-NH2 2.6Å; N395-R426 PolarHBondContact O-NH2 3.43Å; D396-R426 IonicContact OD1-NH2 3.86Å; D396-R426 PolarHBondContact OD1-NH2 3.29Å
427	V	97.4	Very high	89.2	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	154.5	-172.8	-53.5	0	0	0	0	112.6	M281 A312 L314 L334 I348 T349 I414 L425	M281-V427 WeakPolarHBondContact CB-O 3.37Å; M281-V427 HydrophobicContact CE-CG2 3.65Å; A312-V427 WeakPolarHBondContact O-CG2 3.37Å; A312-V427 PolarHBondContact O-N 2.76Å; L314-V427 PolarHBondContact N-O 3.3Å; L314-V427 VanDerWaalsContact N-O 3.11Å; L334-V427 HydrophobicContact CD2-CG1 4.22Å; L334-V427 HydrophobicContact CD2-CG2 3.95Å; I348-V427 CarbonylContact O-C 3.56Å; I348-V427 VanDerWaalsContact O-CA 3.25Å; I348-V427 WeakPolarHBondContact O-CA 3.21Å; T349-V427 HydrophobicContact CG2-CG1 4.38Å; I414-V427 HydrophobicContact CD1-CB 4.1Å; I414-V427 HydrophobicContact CD1-CG1 3.66Å; I414-V427 HydrophobicContact CD1-CG2 4.27Å; L425-V427 HydrophobicContact CB-CG1 4.06Å; L425-V427 HydrophobicContact CD2-CG1 4.26Å
428	E	96.5	Very high	88.8	Confident	6 Å²	6	54.3 Å²	54.3	3%	0.028	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	134.6	164	-178.7	64.9	-91	0	0	108.6	P278 G280 M281 K282 L314 I347 I348 L430	P278-E428 HydrophobicContact CB-CG 3.83Å; G280-E428 PolarHBondContact N-OE1 3.46Å; M281-E428 VanDerWaalsContact CB-OE1 3.32Å; M281-E428 WeakPolarHBondContact CB-OE1 3.37Å; M281-E428 PolarHBondContact N-OE1 2.99Å; M281-E428 PolarHBondContact N-OE2 2.98Å; K282-E428 WeakPolarHBondContact CB-OE2 3.34Å; K282-E428 PolarHBondContact N-OE2 3.1Å; L314-E428 HydrophobicContact CB-CB 3.9Å; L314-E428 HydrophobicContact CD2-CB 3.84Å; L314-E428 HydrophobicContact CG-CB 4.4Å; I347-E428 WeakPolarHBondContact CA-O 3.46Å; I348-E428 HydrophobicContact CB-CB 4.25Å; I348-E428 PolarHBondContact N-O 2.95Å; I348-E428 PolarHBondContact O-N 2.77Å; E428-L430 HydrophobicContact CG-CD2 4.2Å
429	I	96.1	Very high	88.3	Confident	1 Å²	1	54.6 Å²	54.6	1%	0.005	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	133.2	178.1	-54.7	-178.4	0	0	0	107.5	L279 M281 V336 L338 V344 V412	L279-I429 HydrophobicContact CD1-CB 4.23Å; L279-I429 HydrophobicContact CD1-CG2 3.7Å; L279-I429 HydrophobicContact CG-CG2 4.5Å; L279-I429 PolarHBondContact N-O 2.55Å; M281-I429 HydrophobicContact CG-CG1 4.39Å; V336-I429 HydrophobicContact CB-CD1 3.69Å; V336-I429 HydrophobicContact CG1-CD1 3.88Å; V336-I429 HydrophobicContact CG2-CD1 3.81Å; L338-I429 HydrophobicContact CD2-CD1 4.37Å; V344-I429 HydrophobicContact CG1-CG2 3.71Å; V344-I429 HydrophobicContact CG2-CG2 4.41Å; V412-I429 HydrophobicContact CB-CD1 4.21Å; V412-I429 HydrophobicContact CG1-CD1 4.4Å
430	L	93.4	Very high	87.8	Confident	9 Å²	9	53.4 Å²	53.4	5%	0.047	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	139.4	178.5	-53.1	179.3	0	0	0	109.9	E277 P278 T345 G346 I348 K400 E428	E277-L430 VanDerWaalsContact O-CA 3.31Å; E277-L430 WeakPolarHBondContact O-CA 3.16Å; P278-L430 HydrophobicContact CB-CD2 4.37Å; T345-L430 PolarHBondContact N-O 2.87Å; T345-L430 PolarHBondContact OG1-O 2.89Å; G346-L430 PolarHBondContact N-O 3.09Å; G346-L430 PolarHBondContact O-N 2.84Å; I348-L430 HydrophobicContact CD1-CD1 4.05Å; I348-L430 HydrophobicContact CD1-CD2 4Å; I348-L430 HydrophobicContact CD1-CG 4.3Å; I348-L430 HydrophobicContact CG1-CD1 3.99Å; I348-L430 HydrophobicContact CG1-CD2 4.47Å; I348-L430 HydrophobicContact CG1-CG 4.27Å; K400-L430 HydrophobicContact CD-CD1 3.97Å; K400-L430 HydrophobicContact CG-CD1 4.27Å; E428-L430 HydrophobicContact CG-CD2 4.2Å
431	G	92	Very high	87.2	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.01	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	170.9	-161.7	-179.5	0	0	0	0	0	113.3	C275 E277 K343	C275-G431 VanDerWaalsContact SG-C 3.59Å; E277-G431 PolarHBondContact O-N 2.93Å; K343-G431 CarbonylContact O-C 3.59Å; K343-G431 WeakPolarHBondContact O-CA 3.33Å
432	C	88.5	Confident	86.7	Confident	10 Å²	10	47.7 Å²	47.7	7%	0.068	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	151.3	174.1	62.1	0	0	0	0	109.8	Y112 C275 T342 K343	Y112-C432 HydrophobicContact CD1-CB 4.18Å; Y112-C432 HydrophobicContact CE1-CB 3.53Å; C275-C432 HydrophobicContact CB-CB 4Å; C275-C432 WeakPolarHBondContact CB-SG 3.27Å; C275-C432 WeakPolarHBondContact SG-CB 3.31Å; C275-C432 PolarHBondContact SG-N 3.06Å; C275-C432 CovalentContact SG-SG 2.03Å; C275-C432 PolarHBondContact SG-SG 3.1Å; T342-C432 VanDerWaalsContact CG2-O 3.26Å; T342-C432 WeakPolarHBondContact CG2-O 3.5Å; K343-C432 WeakPolarHBondContact CB-O 3.22Å; K343-C432 PolarHBondContact N-O 3.02Å; K343-C432 PolarHBondContact O-N 3.3Å
433	T	85.1	Confident	86.1	Confident	65 Å²	65	44.9 Å²	44.9	40%	0.399	22%	0.219	S	C	.	.	P	Polyproline II helix	trans	-78.7	130.3	166.6	49.5	0	0	0	0	108.1	V340 T342 Q435	V340-T433 HydrophobicContact CG2-CG2 3.97Å; T342-T433 HydrophobicContact CG2-CG2 4.18Å; T433-Q435 PolarHBondContact O-N 3.29Å
434	E	69.3	Low	85.2	Confident	116 Å²	116	48.4 Å²	48.4	54%	0.542	24%	0.236	S	C	.	.	P	Polyproline II helix	trans	-72.7	117	162.9	-99	173.1	-168.1	0	0	106.7	K343 Y408	K343-E434 IonicContact NZ-OE1 2.7Å; Y408-E434 WeakPolarHBondContact CE1-OE2 3.46Å; Y408-E434 PolarHBondContact OH-OE1 3.01Å
435	Q	56.8	Low	84.2	Confident	151 Å²	151	52.4 Å²	52.4	71%	0.706	26%	0.255	S	S	*	.	P	Polyproline II helix	trans	-87.1	127.7	157.8	-73	177.8	-16.7	0	0	106.1	T433	T433-Q435 PolarHBondContact O-N 3.29Å
436	E	40	Very low	83	Confident	269 Å²	269	57.2 Å²	57.2	100%	1.257	28%	0.279	S	S	*	.			trans	-50.8	0	176.8	-68	179.8	155.1	0	0	113.1

Retrieved 436 of 436 residues in 2747.2 ms (Link to these results)

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