A0A077Z6A6_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z6A6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 980 aa.

						>A0A077Z6A6_TRITR|A0A077Z6A6
MHLLGIPLVALIYSACVYATSLPPLPANFSISFAVVDFLSNVTVVVEDLTSQSLQNSTGIHLWKGGIGSNLVIRRDEKDYLYHDGEVDISLITAHSIVLFNLGRGNCSRSNSPIEVVVINPLLLPPAFFNRTALTLFDLWNYFKQFSWNKTDLPSEHESRQLENYSTRIRLSRNNMIDVNVVLFQPWLSQPSFKARIPRSVEIVAYSNSKLDTTNPVMNVSFFLFNYKLILDDASIEHFLLPPEGVYCSGLKNDSFPEVKFQNFMVSVEVLQHKLKLPGEIKLFYSADKRLASFTNMNSSVLPFSQGLNLSSPEYVVTHDFDSGLQYVINGPAATCVNVTPIPLTAGTGKLSSEKGQPYLAFKNATEILLKVDRLNFGYVGKRLLDDMMLEVWVAKEAENNTCFVHEVWFNKAVLHDEVLRASDVVLPWALRIYNSCNPKLPQDRTTYTFYNFLPFNSTLIPWKRFDVSTCLKYDKNESYMTIHVNATVDKLYSTGIEVVENFLRTSIAAVAGVSPLRVSRFMFQPDGNRTMVFFQVSNTSGVIGTRTEFFQAEKDLAAARKALNETLQRQDVTVRVPRRLQEDLILVIMCHSLKDACLLCHGGEETVIVNYMGYTGGSMAGLGISMLLLGSFFGLIIGFYLWKRHRGIAYQIGLRPILGDSCNPNTGKVKYKLISTNTMFICQQREDSNGVRHGVWIILDCKGPCTKANYKRFSVVKKSPLIEILRLVLLEAPTTVFSSNVGLITAGLPCNYTERIGHAIPTNKTHFLTCDHLNEACGTWTIHSCLNGELFDPRKAACSSEAALLRQYYMDPMGGYMAPGYAYGGGYGYGYGMPGYGDPMLGMPMVQPYAYPAMEVPMVAQPNYAPAPAMAAPPAFGAPTSPYAFPGMLPNAGGFGGGPTHFPGYSIIPPPAPIPPGNVQQAPAPQVGPPPAAPPPAPPPAPPPAPAPAPPPPAAPAPAPAPAGPGGLPIPGGLPKLPG
					

Structure Viewer

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.1	Very low	34.1	Very low	222 Å²	222	140.8 Å²	140.8	100%	1.094	80%	0.802	S	S	*	*				0	129.7	0	-64.7	167.6	162.1	0	0	107.2
2	H	35.5	Very low	33.6	Very low	157 Å²	157	142.6 Å²	142.6	73%	0.727	81%	0.805	S	S	*	*			cis	-164.5	144.6	-16.4	-88.3	-62.7	0	0	0	104.3
3	L	37.1	Very low	33.2	Very low	131 Å²	131	146.8 Å²	146.8	69%	0.686	80%	0.802	S	S	*	*			cis	-152.1	164.5	-2.7	-94.4	151.8	0	0	0	107.8
4	L	36.5	Very low	32.7	Very low	159 Å²	159	143.4 Å²	143.4	83%	0.832	79%	0.794	S	S	*	*			trans	27.1	131.6	147.8	-54	168.7	0	0	0	118.9
5	G	34.2	Very low	32.3	Very low	71 Å²	71	139.2 Å²	139.2	73%	0.732	79%	0.786	S	S	*	*			cis	131.7	162.9	29.4	0	0	0	0	0	108
6	I	36.6	Very low	31.8	Very low	157 Å²	157	135.9 Å²	135.9	81%	0.805	77%	0.773	S	S	*	*			cis	-143.3	143.7	3.4	-75	166.7	0	0	0	107.5
7	P	37.4	Very low	31.4	Very low	116 Å²	116	135.4 Å²	135.4	75%	0.753	77%	0.773	S	S	*	*			trans	-96.9	136.3	178.2	35.7	-32.3	0	0	0	114.1
8	L	30.3	Very low	31.1	Very low	167 Å²	167	138.9 Å²	138.9	87%	0.874	77%	0.773	S	S	*	*			trans	-175.1	156.5	156.9	-126.3	63.8	0	0	0	107.2
9	V	32.3	Very low	30.8	Very low	130 Å²	130	135.8 Å²	135.8	79%	0.788	77%	0.768	S	S	*	*			cis	-131.4	158.5	0.3	-163.3	0	0	0	0	108.1
10	A	29.7	Very low	30.7	Very low	93 Å²	93	135.5 Å²	135.5	77%	0.769	77%	0.769	S	S	*	*			trans	-88.4	138.4	169.9	0	0	0	0	0	112.2
11	L	28.5	Very low	30.6	Very low	146 Å²	146	134 Å²	134	76%	0.764	77%	0.767	S	S	*	*			trans	-149.7	124.8	162.1	-123.9	172.6	0	0	0	110.9	Y13	L11-Y13 HydrophobicContact CD2-CD2 4.19Å; L11-Y13 HydrophobicContact CD2-CE2 4.1Å; L11-Y13 PolarHBondContact O-N 3.26Å
12	I	28.6	Very low	30.3	Very low	162 Å²	162	127.2 Å²	127.2	83%	0.831	74%	0.735	S	S	*	*			trans	-78.8	115	177.5	-62.4	165.6	0	0	0	108.1
13	Y	27.7	Very low	29.9	Very low	197 Å²	197	124.7 Å²	124.7	77%	0.773	73%	0.733	S	S	*	*			trans	-127.2	106.9	165.8	-101.9	-81.2	0	0	0	111.8	L11 A15	L11-Y13 HydrophobicContact CD2-CD2 4.19Å; L11-Y13 HydrophobicContact CD2-CE2 4.1Å; L11-Y13 PolarHBondContact O-N 3.26Å; Y13-A15 PolarHBondContact O-N 2.03Å
14	S	26.2	Very low	29.6	Very low	99 Å²	99	124.4 Å²	124.4	69%	0.692	74%	0.738	S	S	*	*			trans	-68.1	82.7	163.7	175.3	0	0	0	0	109.3	C16	S14-C16 VanDerWaalsContact C-N 3.28Å; S14-C16 PolarHBondContact O-N 3.35Å
15	A	26.9	Very low	29.4	Very low	81 Å²	81	121.4 Å²	121.4	67%	0.669	72%	0.723	S	S	*	*			trans	-76.1	77.8	176.4	0	0	0	0	0	110.9	Y13 V17	Y13-A15 PolarHBondContact O-N 2.03Å; A15-V17 VanDerWaalsContact C-N 3.33Å; A15-V17 PolarHBondContact O-N 3.27Å
16	C	24	Very low	29.2	Very low	86 Å²	86	121.9 Å²	121.9	58%	0.581	71%	0.713	S	S	*	*			trans	-66.8	91.2	167.7	-63.7	0	0	0	0	109.3	S14 Y18	S14-C16 VanDerWaalsContact C-N 3.28Å; S14-C16 PolarHBondContact O-N 3.35Å; C16-Y18 HydrophobicContact CB-CD2 3.97Å; C16-Y18 HydrophobicContact CB-CE2 4.01Å; C16-Y18 PolarHBondContact O-N 3.35Å
17	V	25.1	Very low	28.7	Very low	127 Å²	127	119.5 Å²	119.5	77%	0.77	72%	0.716	S	S	*	*			trans	-74.7	78.9	177.6	-174.1	0	0	0	0	109.9	A15 A19	A15-V17 VanDerWaalsContact C-N 3.33Å; A15-V17 PolarHBondContact O-N 3.27Å; V17-A19 VanDerWaalsContact C-N 3.26Å; V17-A19 HydrophobicContact CG1-CB 4.2Å; V17-A19 PolarHBondContact O-N 3.01Å
18	Y	25.7	Very low	28.5	Very low	199 Å²	199	121.2 Å²	121.2	78%	0.78	72%	0.719	S	S	*	*			trans	-68.1	83.6	164.2	-82.4	-89.8	0	0	0	109.7	C16 T20	C16-Y18 HydrophobicContact CB-CD2 3.97Å; C16-Y18 HydrophobicContact CB-CE2 4.01Å; C16-Y18 PolarHBondContact O-N 3.35Å; Y18-T20 HydrophobicContact CD1-CG2 4.32Å
19	A	26.1	Very low	28.3	Very low	81 Å²	81	117.3 Å²	117.3	67%	0.669	70%	0.696	S	S	*	*			trans	-102.2	83.2	168.6	0	0	0	0	0	109.1	V17 S21	V17-A19 VanDerWaalsContact C-N 3.26Å; V17-A19 HydrophobicContact CG1-CB 4.2Å; V17-A19 PolarHBondContact O-N 3.01Å; A19-S21 VanDerWaalsContact C-N 3.27Å; A19-S21 PolarHBondContact O-N 2.78Å
20	T	28.4	Very low	28.2	Very low	129 Å²	129	114.8 Å²	114.8	79%	0.791	68%	0.684	S	S	*	*			trans	-81.4	8.2	-168.2	45.7	0	0	0	0	115.3	Y18	Y18-T20 HydrophobicContact CD1-CG2 4.32Å
21	S	28.8	Very low	28.1	Very low	104 Å²	104	113.3 Å²	113.3	73%	0.727	66%	0.662	S	S	*	*			trans	-141	128.8	177.2	53.9	0	0	0	0	113.2	A19	A19-S21 VanDerWaalsContact C-N 3.27Å; A19-S21 PolarHBondContact O-N 2.78Å
22	L	29.9	Very low	28.1	Very low	79 Å²	79	108.6 Å²	108.6	41%	0.414	64%	0.641	S	S	.	*	P	Polyproline II helix	trans	-81.6	146.7	155.6	-75.5	161.6	0	0	0	108.2	L122	L22-L122 HydrophobicContact CD1-CD1 3.82Å
23	P	28.6	Very low	28.2	Very low	105 Å²	105	106 Å²	106	68%	0.682	62%	0.624	S	S	*	*	P	Polyproline II helix	trans	-60.8	137.3	166.4	27.6	-33.6	0	0	0	109
24	P	30.8	Very low	28.3	Very low	124 Å²	124	98.7 Å²	98.7	81%	0.805	60%	0.604	S	S	*	*	P	Polyproline II helix	trans	-64.5	143.6	-177.7	26.6	-34.3	0	0	0	111.1
25	L	31.7	Very low	28.4	Very low	97 Å²	97	95.4 Å²	95.4	51%	0.508	58%	0.58	S	S	.	*	P	Polyproline II helix	trans	-60.5	149.6	163.3	-74.6	166.6	0	0	0	109.3	A27 F29 I31	L25-A27 PolarHBondContact O-N 2.83Å; L25-F29 HydrophobicContact CB-CB 4.43Å; L25-I31 HydrophobicContact CD1-CD1 4.34Å; L25-I31 HydrophobicContact CD2-CD1 4.49Å
26	P	29.9	Very low	28.4	Very low	81 Å²	81	95.7 Å²	95.7	53%	0.526	57%	0.574	S	S	.	*	P	Polyproline II helix	trans	-53.7	138.3	167.1	-22.1	33.1	0	0	0	109.7	N28 F29	P26-N28 PolarHBondContact O-N 3.31Å; P26-F29 HydrophobicContact CB-CD2 4.46Å; P26-F29 HydrophobicContact CG-CD2 4.37Å; P26-F29 PolarHBondContact O-N 2.75Å
27	A	27.1	Very low	28.6	Very low	106 Å²	106	96 Å²	96	88%	0.876	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.2	-3.1	-169.3	0	0	0	0	0	116.3	L25	L25-A27 PolarHBondContact O-N 2.83Å
28	N	31.2	Very low	28.8	Very low	152 Å²	152	95 Å²	95	81%	0.813	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113	13.4	-179.6	-57.9	-34	0	0	0	113.1	P26	P26-N28 PolarHBondContact O-N 3.31Å
29	F	27.9	Very low	29.1	Very low	86 Å²	86	89.1 Å²	89.1	38%	0.377	54%	0.536	S	S	.	.			trans	-108.1	109.9	-177.5	-113.7	-85.3	0	0	0	112.4	L25 P26 I197	L25-F29 HydrophobicContact CB-CB 4.43Å; P26-F29 HydrophobicContact CB-CD2 4.46Å; P26-F29 HydrophobicContact CG-CD2 4.37Å; P26-F29 PolarHBondContact O-N 2.75Å; F29-I197 HydrophobicContact CE1-CG2 4.07Å; F29-I197 HydrophobicContact CE2-CD1 4.2Å; F29-I197 HydrophobicContact CZ-CD1 3.71Å; F29-I197 HydrophobicContact CZ-CG1 3.95Å; F29-I197 HydrophobicContact CZ-CG2 3.9Å
30	S	28.6	Very low	29.4	Very low	77 Å²	77	90.2 Å²	90.2	54%	0.538	54%	0.539	S	S	.	.			trans	-97.6	151.9	158.7	55.9	0	0	0	0	110.1
31	I	28.6	Very low	29.7	Very low	61 Å²	61	91.2 Å²	91.2	31%	0.313	54%	0.54	S	S	.	.			trans	-124.6	98.2	176.7	-59.4	-178.7	0	0	0	107.3	L25 F33 L224	L25-I31 HydrophobicContact CD1-CD1 4.34Å; L25-I31 HydrophobicContact CD2-CD1 4.49Å; I31-F33 HydrophobicContact CB-CE2 4.44Å; I31-F33 HydrophobicContact CG2-CD2 4.42Å; I31-F33 HydrophobicContact CG2-CE1 3.97Å; I31-F33 HydrophobicContact CG2-CE2 3.72Å; I31-F33 HydrophobicContact CG2-CZ 3.47Å; I31-F33 VanDerWaalsContact CG2-CZ 3.47Å; I31-L224 HydrophobicContact CG2-CD2 3.67Å
32	S	28.7	Very low	29.9	Very low	47 Å²	47	88.3 Å²	88.3	33%	0.329	52%	0.518	S	S	.	.			trans	-87.1	132.6	176.8	-57.2	0	0	0	0	110.1
33	F	29.4	Very low	30	Very low	108 Å²	108	88.7 Å²	88.7	47%	0.474	52%	0.523	S	S	.	.			trans	-112.1	114.6	176.5	-58.2	-88.8	0	0	0	110.2	I31 P121 F222	I31-F33 HydrophobicContact CB-CE2 4.44Å; I31-F33 HydrophobicContact CG2-CD2 4.42Å; I31-F33 HydrophobicContact CG2-CE1 3.97Å; I31-F33 HydrophobicContact CG2-CE2 3.72Å; I31-F33 HydrophobicContact CG2-CZ 3.47Å; I31-F33 VanDerWaalsContact CG2-CZ 3.47Å; F33-P121 HydrophobicContact CE2-CG 4.4Å; F33-F222 HydrophobicContact CB-CD1 4.45Å; F33-F222 AromaticContact CD1-CD1 3.87Å; F33-F222 HydrophobicContact CD1-CD1 3.87Å; F33-F222 AromaticContact CD1-CE1 3.97Å; F33-F222 HydrophobicContact CD1-CE1 3.97Å
34	A	29.8	Very low	30.1	Very low	43 Å²	43	87.9 Å²	87.9	36%	0.355	52%	0.516	S	S	.	.			trans	-112.2	105.4	165.6	0	0	0	0	0	108.2	F222	A34-F222 WeakPolarHBondContact O-CA 3Å
35	V	29.4	Very low	30.2	Very low	31 Å²	31	84.6 Å²	84.6	19%	0.188	49%	0.494	C	S	.	.	B	Isolated β-bridge	trans	-91.8	110.8	176.2	171.3	0	0	0	0	108.4	F38 L39 V220 S221 F222	V35-F38 HydrophobicContact CG1-CB 3.82Å; V35-L39 HydrophobicContact CB-CD1 4.03Å; V35-L39 HydrophobicContact CB-CD2 4.32Å; V35-L39 HydrophobicContact CB-CG 4.03Å; V35-L39 HydrophobicContact CG1-CD2 4.29Å; V35-L39 HydrophobicContact CG1-CG 4.09Å; V35-L39 WeakPolarHBondContact O-CD1 3.48Å; V35-L39 VanDerWaalsContact O-CG 3.31Å; V35-L39 WeakPolarHBondContact O-CG 3.42Å; V35-V220 HydrophobicContact CB-CG1 4.45Å; V35-V220 HydrophobicContact CG1-CG1 3.77Å; V35-V220 HydrophobicContact CG2-CG1 3.93Å; V35-S221 WeakPolarHBondContact CA-O 3.06Å; V35-F222 HydrophobicContact CG2-CD1 3.77Å; V35-F222 HydrophobicContact CG2-CE1 3.45Å; V35-F222 VanDerWaalsContact CG2-CE1 3.45Å; V35-F222 HydrophobicContact CG2-CZ 4.25Å
36	V	26.4	Very low	30.2	Very low	87 Å²	87	83.7 Å²	83.7	53%	0.527	49%	0.492	S	S	.	.	S	Bend	trans	-82.5	-37.3	-167.9	-174.2	0	0	0	0	113.2	S221 F223	V36-S221 WeakPolarHBondContact CB-OG 3.42Å; V36-S221 PolarHBondContact N-O 2.74Å; V36-F223 HydrophobicContact CG2-CD2 4.14Å; V36-F223 HydrophobicContact CG2-CE2 3.89Å
37	D	28.9	Very low	30.4	Very low	92 Å²	92	81.6 Å²	81.6	49%	0.492	48%	0.475	S	S	.	.	S	Bend	trans	-105.6	1.5	-165.9	-62.5	-51.8	0	0	0	115.9	N219 S221	D37-N219 HydrophobicContact CB-CB 4.25Å; D37-N219 PolarHBondContact OD2-ND2 2.93Å; D37-S221 PolarHBondContact OD2-OG 2.78Å
38	F	29.1	Very low	30.8	Very low	105 Å²	105	78 Å²	78	46%	0.461	44%	0.441	S	S	.	.	S	Bend	trans	-123.7	10.3	-173.2	-128.9	-89.7	0	0	0	115.2	V35 M218	V35-F38 HydrophobicContact CG1-CB 3.82Å; F38-M218 HydrophobicContact CD2-CG 4Å; F38-M218 HydrophobicContact CE1-CE 4.44Å; F38-M218 HydrophobicContact CE2-CB 3.89Å; F38-M218 HydrophobicContact CE2-CE 4.06Å; F38-M218 HydrophobicContact CE2-CG 3.66Å; F38-M218 HydrophobicContact CZ-CE 3.87Å; F38-M218 HydrophobicContact CZ-CG 4.43Å
39	L	32.7	Very low	31	Very low	76 Å²	76	74.9 Å²	74.9	40%	0.398	42%	0.424	S	S	.	.			trans	-111.4	27.7	-169.2	-59.1	-169.9	0	0	0	115.2	V35 N41 V42	V35-L39 HydrophobicContact CB-CD1 4.03Å; V35-L39 HydrophobicContact CB-CD2 4.32Å; V35-L39 HydrophobicContact CB-CG 4.03Å; V35-L39 HydrophobicContact CG1-CD2 4.29Å; V35-L39 HydrophobicContact CG1-CG 4.09Å; V35-L39 WeakPolarHBondContact O-CD1 3.48Å; V35-L39 VanDerWaalsContact O-CG 3.31Å; V35-L39 WeakPolarHBondContact O-CG 3.42Å; L39-N41 PolarHBondContact O-N 2.96Å; L39-N41 VanDerWaalsContact O-N 3.13Å; L39-V42 HydrophobicContact CB-CB 4.25Å; L39-V42 HydrophobicContact CD2-CB 3.92Å; L39-V42 HydrophobicContact CD2-CG1 4.2Å; L39-V42 HydrophobicContact CD2-CG2 3.79Å; L39-V42 PolarHBondContact O-N 2.81Å
40	S	30.4	Very low	31.2	Very low	104 Å²	104	73 Å²	73	73%	0.727	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	116.7	157.8	52.8	0	0	0	0	108.6
41	N	35.8	Very low	31.4	Very low	150 Å²	150	72.1 Å²	72.1	80%	0.802	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	76	39.9	-175.3	-35.9	-72.4	0	0	0	116.8	L39	L39-N41 PolarHBondContact O-N 2.96Å; L39-N41 VanDerWaalsContact O-N 3.13Å
42	V	33	Very low	31.7	Very low	44 Å²	44	78.6 Å²	78.6	27%	0.267	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	130.9	164	173.1	0	0	0	0	110.8	L39 W63 K64	L39-V42 HydrophobicContact CB-CB 4.25Å; L39-V42 HydrophobicContact CD2-CB 3.92Å; L39-V42 HydrophobicContact CD2-CG1 4.2Å; L39-V42 HydrophobicContact CD2-CG2 3.79Å; L39-V42 PolarHBondContact O-N 2.81Å; V42-W63 WeakPolarHBondContact CA-O 3.25Å; V42-K64 HydrophobicContact CG2-CB 4.28Å; V42-K64 HydrophobicContact CG2-CG 4.17Å
43	T	31.4	Very low	32	Very low	87 Å²	87	81.5 Å²	81.5	53%	0.534	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	142.9	179.6	-25.5	0	0	0	0	110.8	W63	T43-W63 PolarHBondContact N-O 3.1Å; T43-W63 VanDerWaalsContact N-O 3.12Å; T43-W63 PolarHBondContact O-N 3.36Å
44	V	30.3	Very low	32.4	Very low	88 Å²	88	79.7 Å²	79.7	53%	0.533	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	132.9	178.7	-173.8	0	0	0	0	108.8	I60 L62	V44-I60 HydrophobicContact CG1-CG2 3.56Å; V44-L62 HydrophobicContact CB-CD2 4.23Å; V44-L62 HydrophobicContact CG1-CD2 3.92Å; V44-L62 HydrophobicContact CG2-CD2 3.8Å
45	V	32.9	Very low	32.4	Very low	54 Å²	54	84.7 Å²	84.7	33%	0.327	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	153.5	-174.4	177.5	0	0	0	0	109.1	E47 I60 H61	V45-E47 HydrophobicContact CG1-CG 4.46Å; V45-I60 CarbonylContact O-C 3.51Å; V45-I60 VanDerWaalsContact O-C 3.26Å; V45-I60 WeakPolarHBondContact O-CA 3.37Å; V45-I60 WeakPolarHBondContact O-CG2 3.34Å; V45-H61 HydrophobicContact CB-CB 4.22Å; V45-H61 PolarHBondContact N-O 3.12Å; V45-H61 PolarHBondContact O-N 3Å
46	V	32.3	Very low	32.8	Very low	79 Å²	79	86.9 Å²	86.9	48%	0.479	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	136.6	-176.1	-169.4	0	0	0	0	110.9	T58 G59 I60	V46-T58 HydrophobicContact CG1-CG2 3.83Å; V46-G59 CarbonylContact C-O 3.55Å; V46-G59 WeakPolarHBondContact CA-O 3.31Å; V46-G59 VanDerWaalsContact CG1-O 3.27Å; V46-G59 WeakPolarHBondContact CG1-O 3.21Å; V46-I60 HydrophobicContact CG1-CG1 4.3Å; V46-I60 HydrophobicContact CG2-CG1 4.2Å
47	E	35.4	Very low	33.2	Very low	36 Å²	36	85.2 Å²	85.2	17%	0.168	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-178.9	-179.3	-142.3	-117.1	-88.5	150.6	0	0	116	V45 G59 H61 L81	V45-E47 HydrophobicContact CG1-CG 4.46Å; E47-G59 PolarHBondContact N-O 3.41Å; E47-G59 CarbonylContact O-C 3.56Å; E47-G59 WeakPolarHBondContact O-CA 3.46Å; E47-G59 PolarHBondContact O-N 2.98Å; E47-G59 VanDerWaalsContact O-N 3.1Å; E47-G59 VanDerWaalsContact O-O 3.06Å; E47-H61 WeakPolarHBondContact CB-CD2 3.09Å; E47-H61 WeakPolarHBondContact CB-NE2 3.34Å; E47-H61 IonicContact OE2-CD2 2.78Å; E47-H61 IonicContact OE2-CE1 2.66Å; E47-H61 IonicContact OE2-NE2 2.64Å; E47-H61 PolarHBondContact OE2-NE2 3.4Å; E47-L81 HydrophobicContact CB-CD1 4.33Å; E47-L81 HydrophobicContact CG-CD1 3.91Å; E47-L81 WeakPolarHBondContact OE1-CD1 2.8Å
48	D	35.5	Very low	33.6	Very low	31 Å²	31	83.8 Å²	83.8	17%	0.166	47%	0.472	C	S	.	.			trans	-150.6	151.9	-155.2	-62.2	-33.5	0	0	0	120.4	L81 I114 E115 V116	D48-L81 HydrophobicContact CB-CD1 3.9Å; D48-L81 WeakPolarHBondContact OD2-CD1 3.39Å; D48-L81 WeakPolarHBondContact OD2-CG 3.24Å; D48-I114 HydrophobicContact CB-CB 3.59Å; D48-I114 HydrophobicContact CB-CD1 3.9Å; D48-I114 HydrophobicContact CB-CG1 3.74Å; D48-I114 WeakPolarHBondContact CB-O 3.37Å; D48-I114 VanDerWaalsContact CG-O 3.32Å; D48-E115 CarbonylContact C-O 3.54Å; D48-V116 HydrophobicContact CB-CB 4.36Å; D48-V116 HydrophobicContact CB-CG1 4.39Å; D48-V116 HydrophobicContact CB-CG2 3.6Å; D48-V116 VanDerWaalsContact CG-CG2 3.48Å; D48-V116 WeakPolarHBondContact OD1-CG2 3.41Å
49	L	34.9	Very low	34	Very low	86 Å²	86	78.8 Å²	78.8	45%	0.45	45%	0.45	S	S	.	.			trans	-178.7	115.1	160.9	42	60.1	0	0	0	119.1	V72 I114 E115 V116 V117	L49-V72 HydrophobicContact CD1-CB 4.16Å; L49-V72 HydrophobicContact CD1-CG1 3.49Å; L49-V72 VanDerWaalsContact CD1-CG1 3.49Å; L49-V72 HydrophobicContact CD1-CG2 3.51Å; L49-V72 HydrophobicContact CG-CG2 4.28Å; L49-I114 HydrophobicContact CB-CG2 4.36Å; L49-E115 CarbonylContact C-O 3.56Å; L49-E115 WeakPolarHBondContact CA-O 3.46Å; L49-E115 PolarHBondContact N-O 3Å; L49-V116 VanDerWaalsContact N-CG1 3.33Å; L49-V116 CarbonylContact O-C 3.51Å; L49-V116 WeakPolarHBondContact O-CA 3.45Å; L49-V117 PolarHBondContact O-N 2.86Å
50	T	32.2	Very low	34.1	Very low	48 Å²	48	78.1 Å²	78.1	29%	0.294	45%	0.446	S	S	.	.			trans	-88.5	-167.5	-169.8	92.4	0	0	0	0	120.8	R74 E115 V116	T50-R74 HydrophobicContact CG2-CG 3.86Å; T50-E115 WeakPolarHBondContact CB-OE1 3.17Å; T50-E115 VanDerWaalsContact CG2-C 3.47Å; T50-E115 VanDerWaalsContact CG2-CA 3.43Å; T50-E115 HydrophobicContact CG2-CB 3.35Å; T50-E115 HydrophobicContact CG2-CG 3.8Å; T50-E115 VanDerWaalsContact N-C 3.33Å; T50-E115 PolarHBondContact N-O 3.38Å; T50-E115 PolarHBondContact OG1-OE1 3.48Å; T50-V116 WeakPolarHBondContact CG2-O 3.36Å
51	S	31.8	Very low	34.4	Very low	58 Å²	58	74.4 Å²	74.4	41%	0.406	42%	0.417	S	S	.	.			trans	-166.4	-156.5	173.4	77.1	0	0	0	0	109.4	R74 V117	S51-R74 VanDerWaalsContact O-CZ 3.23Å; S51-R74 PolarHBondContact O-NH1 3.16Å; S51-R74 PolarHBondContact O-NH2 3.4Å; S51-R74 PolarHBondContact OG-NH2 2.74Å; S51-R74 VanDerWaalsContact OG-NH2 3.16Å; S51-V117 VanDerWaalsContact OG-CG1 3.32Å; S51-V117 WeakPolarHBondContact OG-CG1 3.37Å
52	Q	34.6	Very low	34.3	Very low	197 Å²	197	70.4 Å²	70.4	92%	0.921	40%	0.395	S	S	*	.	S	Bend	trans	-112.9	-9.7	-167.4	-74	177.8	-16.1	0	0	120.3
53	S	35.5	Very low	34.4	Very low	108 Å²	108	73.6 Å²	73.6	76%	0.755	40%	0.402	S	S	*	.	S	Bend	trans	-105.7	14.6	-170.8	60.8	0	0	0	0	116.5
54	L	37.3	Very low	34.7	Very low	70 Å²	70	74.6 Å²	74.6	37%	0.366	40%	0.399	S	S	.	.			trans	-145.3	165.3	-175.6	-54.6	92.2	0	0	0	110.6	R74 V117 V118	L54-R74 VanDerWaalsContact C-CD 3.43Å; L54-R74 WeakPolarHBondContact O-CD 3.42Å; L54-R74 PolarHBondContact O-NE 2.86Å; L54-R74 PolarHBondContact O-NH1 2.87Å; L54-V117 HydrophobicContact CB-CG2 3.7Å; L54-V117 HydrophobicContact CD1-CB 4.48Å; L54-V117 HydrophobicContact CD1-CG1 4.07Å; L54-V117 HydrophobicContact CD1-CG2 3.62Å; L54-V117 HydrophobicContact CD2-CG2 3.65Å; L54-V117 HydrophobicContact CG-CG2 3.82Å; L54-V118 HydrophobicContact CD2-CG2 3.93Å
55	Q	30.4	Very low	34.9	Very low	147 Å²	147	74.5 Å²	74.5	69%	0.687	42%	0.416	S	S	*	.			trans	-148.9	133.1	173.7	-89.4	-164.6	-57.4	0	0	108.9	D76	Q55-D76 WeakPolarHBondContact CA-OD1 3.49Å; Q55-D76 WeakPolarHBondContact CB-OD2 3.34Å; Q55-D76 VanDerWaalsContact CD-OD2 3.29Å; Q55-D76 WeakPolarHBondContact CG-OD2 3.13Å; Q55-D76 PolarHBondContact NE2-OD2 3.36Å
56	N	38.8	Very low	35.1	Very low	78 Å²	78	75.4 Å²	75.4	42%	0.417	44%	0.436	S	S	.	.			trans	62.8	142.5	180	-50.3	-64.8	0	0	0	123.2	R74 R75 D76	N56-R74 CarbonylContact C-O 3.59Å; N56-R75 HydrophobicContact CB-CG 4.16Å; N56-R75 WeakPolarHBondContact OD1-CG 3.16Å; N56-D76 VanDerWaalsContact CG-OD2 3.27Å; N56-D76 PolarHBondContact N-OD1 2.71Å; N56-D76 VanDerWaalsContact N-OD1 3.08Å; N56-D76 PolarHBondContact ND2-OD2 2.95Å; N56-D76 PolarHBondContact OD1-OD2 2.97Å
57	S	35	Very low	35	Very low	52 Å²	52	75.4 Å²	75.4	36%	0.364	43%	0.433	S	S	.	.			trans	163.1	-128.4	171.4	-70.4	0	0	0	0	113.3	I73 R74 R75	S57-I73 VanDerWaalsContact CB-CB 3.45Å; S57-R74 CarbonylContact C-O 3.57Å; S57-R74 VanDerWaalsContact CA-O 3.23Å; S57-R74 WeakPolarHBondContact CA-O 3.26Å; S57-R74 VanDerWaalsContact N-C 3.33Å; S57-R74 PolarHBondContact N-O 3.3Å; S57-R75 PolarHBondContact O-NE 2.84Å; S57-R75 PolarHBondContact O-NH2 3.45Å
58	T	36.3	Very low	34.8	Very low	62 Å²	62	75.1 Å²	75.1	38%	0.38	44%	0.439	S	S	.	.			trans	-169.8	154.4	164.9	-14.1	0	0	0	0	112.8	V46 I73	V46-T58 HydrophobicContact CG1-CG2 3.83Å; T58-I73 CarbonylContact C-O 3.26Å; T58-I73 WeakPolarHBondContact CA-O 3.48Å; T58-I73 PolarHBondContact N-O 2.76Å; T58-I73 WeakPolarHBondContact O-CB 3.47Å; T58-I73 WeakPolarHBondContact O-CD1 3.46Å; T58-I73 WeakPolarHBondContact O-CG1 3.27Å; T58-I73 PolarHBondContact O-N 3.39Å
59	G	37.1	Very low	34.6	Very low	0 Å²	0	74.2 Å²	74.2	0%	0	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	148.6	-177.2	0	0	0	0	0	117.8	V46 E47 L71 I73	V46-G59 CarbonylContact C-O 3.55Å; V46-G59 WeakPolarHBondContact CA-O 3.31Å; V46-G59 VanDerWaalsContact CG1-O 3.27Å; V46-G59 WeakPolarHBondContact CG1-O 3.21Å; E47-G59 PolarHBondContact N-O 3.41Å; E47-G59 CarbonylContact O-C 3.56Å; E47-G59 WeakPolarHBondContact O-CA 3.46Å; E47-G59 PolarHBondContact O-N 2.98Å; E47-G59 VanDerWaalsContact O-N 3.1Å; E47-G59 VanDerWaalsContact O-O 3.06Å; G59-L71 CarbonylContact C-O 3.53Å; G59-L71 WeakPolarHBondContact CA-O 3.48Å; G59-I73 PolarHBondContact N-O 2.77Å
60	I	36.2	Very low	34.5	Very low	62 Å²	62	73.9 Å²	73.9	32%	0.318	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	109.5	-167.3	-51.8	-178.4	0	0	0	116.2	V44 V45 V46 L62 L71	V44-I60 HydrophobicContact CG1-CG2 3.56Å; V45-I60 CarbonylContact O-C 3.51Å; V45-I60 VanDerWaalsContact O-C 3.26Å; V45-I60 WeakPolarHBondContact O-CA 3.37Å; V45-I60 WeakPolarHBondContact O-CG2 3.34Å; V46-I60 HydrophobicContact CG1-CG1 4.3Å; V46-I60 HydrophobicContact CG2-CG1 4.2Å; I60-L62 HydrophobicContact CG2-CD2 4.37Å; I60-L71 HydrophobicContact CB-CB 4.16Å; I60-L71 HydrophobicContact CB-CD2 4.1Å; I60-L71 HydrophobicContact CG1-CD2 4.2Å; I60-L71 PolarHBondContact N-O 3.16Å; I60-L71 WeakPolarHBondContact O-CA 2.99Å; I60-L71 WeakPolarHBondContact O-CB 3.33Å; I60-L71 PolarHBondContact O-N 2.79Å
61	H	35.8	Very low	34.5	Very low	25 Å²	25	73.8 Å²	73.8	12%	0.116	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	141.5	172.8	-60.5	-130.4	0	0	0	112.7	V45 E47 S69 N70	V45-H61 HydrophobicContact CB-CB 4.22Å; V45-H61 PolarHBondContact N-O 3.12Å; V45-H61 PolarHBondContact O-N 3Å; E47-H61 WeakPolarHBondContact CB-CD2 3.09Å; E47-H61 WeakPolarHBondContact CB-NE2 3.34Å; E47-H61 IonicContact OE2-CD2 2.78Å; E47-H61 IonicContact OE2-CE1 2.66Å; E47-H61 IonicContact OE2-NE2 2.64Å; E47-H61 PolarHBondContact OE2-NE2 3.4Å; H61-S69 WeakPolarHBondContact CA-O 3.37Å; H61-N70 PolarHBondContact CE1-ND2 3.45Å; H61-N70 PolarHBondContact ND1-OD1 3.32Å
62	L	34.1	Very low	34.5	Very low	66 Å²	66	71.2 Å²	71.2	35%	0.346	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	134.3	-179.4	-62.7	173	0	0	0	110.7	V44 I60 G68 S69	V44-L62 HydrophobicContact CB-CD2 4.23Å; V44-L62 HydrophobicContact CG1-CD2 3.92Å; V44-L62 HydrophobicContact CG2-CD2 3.8Å; I60-L62 HydrophobicContact CG2-CD2 4.37Å; L62-G68 CarbonylContact O-C 3.54Å; L62-G68 WeakPolarHBondContact O-CA 3.26Å; L62-S69 PolarHBondContact N-O 2.99Å; L62-S69 PolarHBondContact O-N 2.82Å
63	W	35.3	Very low	34.5	Very low	112 Å²	112	64.8 Å²	64.8	42%	0.424	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	129.7	-176.9	-68	88.2	0	0	0	112.7	V42 T43	V42-W63 WeakPolarHBondContact CA-O 3.25Å; T43-W63 PolarHBondContact N-O 3.1Å; T43-W63 VanDerWaalsContact N-O 3.12Å; T43-W63 PolarHBondContact O-N 3.36Å
64	K	36.3	Very low	34.4	Very low	108 Å²	108	60.2 Å²	60.2	47%	0.47	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	109.9	-179.6	-178	-178.4	179.3	-176.6	0	111	V42 G66 I67 F128	V42-K64 HydrophobicContact CG2-CB 4.28Å; V42-K64 HydrophobicContact CG2-CG 4.17Å; K64-G66 VanDerWaalsContact C-N 3.29Å; K64-G66 PolarHBondContact O-N 3.49Å; K64-I67 PolarHBondContact N-O 2.8Å; K64-I67 PolarHBondContact O-N 2.92Å; K64-F128 HydrophobicContact CB-CZ 4.32Å; K64-F128 HydrophobicContact CD-CE1 4.48Å
65	G	35.4	Very low	34.5	Very low	85 Å²	85	60.7 Å²	60.7	88%	0.876	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.3	34.1	169.4	0	0	0	0	0	115.6
66	G	36.4	Very low	34.8	Very low	74 Å²	74	56.7 Å²	56.7	76%	0.763	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.9	1.8	-176.7	0	0	0	0	0	115.2	K64	K64-G66 VanDerWaalsContact C-N 3.29Å; K64-G66 PolarHBondContact O-N 3.49Å
67	I	30.5	Very low	34.7	Very low	78 Å²	78	60.7 Å²	60.7	40%	0.4	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	120.3	171.3	-49.6	178.6	0	0	0	108.6	K64 F128	K64-I67 PolarHBondContact N-O 2.8Å; K64-I67 PolarHBondContact O-N 2.92Å; I67-F128 HydrophobicContact CB-CD2 4.39Å; I67-F128 HydrophobicContact CB-CE2 4.45Å; I67-F128 HydrophobicContact CG2-CD2 3.62Å; I67-F128 HydrophobicContact CG2-CE2 3.97Å
68	G	32.4	Very low	34.9	Very low	30 Å²	30	67.2 Å²	67.2	31%	0.309	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	156.2	175	0	0	0	0	0	112.6	L62	L62-G68 CarbonylContact O-C 3.54Å; L62-G68 WeakPolarHBondContact O-CA 3.26Å
69	S	30.3	Very low	35.3	Very low	13 Å²	13	69.7 Å²	69.7	9%	0.091	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	128.1	170.2	61.4	0	0	0	0	111.6	H61 L62	H61-S69 WeakPolarHBondContact CA-O 3.37Å; L62-S69 PolarHBondContact N-O 2.99Å; L62-S69 PolarHBondContact O-N 2.82Å
70	N	32.3	Very low	35.6	Very low	78 Å²	78	73.8 Å²	73.8	42%	0.417	40%	0.396	S	S	.	.			trans	-80.9	148.8	-176.4	-46.4	23.5	0	0	0	110.8	H61 V72 I119	H61-N70 PolarHBondContact CE1-ND2 3.45Å; H61-N70 PolarHBondContact ND1-OD1 3.32Å; N70-V72 HydrophobicContact CB-CG2 4.37Å; N70-I119 WeakPolarHBondContact O-CD1 3.47Å
71	L	32.1	Very low	35.7	Very low	46 Å²	46	72.1 Å²	72.1	24%	0.241	39%	0.388	C	S	.	.			trans	-131	161.8	159.7	-169.4	134.2	0	0	0	108.1	G59 I60 I73 I119	G59-L71 CarbonylContact C-O 3.53Å; G59-L71 WeakPolarHBondContact CA-O 3.48Å; I60-L71 HydrophobicContact CB-CB 4.16Å; I60-L71 HydrophobicContact CB-CD2 4.1Å; I60-L71 HydrophobicContact CG1-CD2 4.2Å; I60-L71 PolarHBondContact N-O 3.16Å; I60-L71 WeakPolarHBondContact O-CA 2.99Å; I60-L71 WeakPolarHBondContact O-CB 3.33Å; I60-L71 PolarHBondContact O-N 2.79Å; L71-I73 HydrophobicContact CD2-CD1 4.45Å; L71-I73 HydrophobicContact CD2-CG1 4.27Å; L71-I119 HydrophobicContact CB-CG2 4.44Å; L71-I119 HydrophobicContact CD1-CG2 4.04Å; L71-I119 HydrophobicContact CG-CB 4.23Å; L71-I119 HydrophobicContact CG-CG2 4.18Å
72	V	32.6	Very low	35.8	Very low	5 Å²	5	73.3 Å²	73.3	3%	0.03	39%	0.392	C	S	.	.			trans	-166.3	110.4	-139	153.4	0	0	0	0	107.9	L49 N70 V116 V117 V118 I119	L49-V72 HydrophobicContact CD1-CB 4.16Å; L49-V72 HydrophobicContact CD1-CG1 3.49Å; L49-V72 VanDerWaalsContact CD1-CG1 3.49Å; L49-V72 HydrophobicContact CD1-CG2 3.51Å; L49-V72 HydrophobicContact CG-CG2 4.28Å; N70-V72 HydrophobicContact CB-CG2 4.37Å; V72-V116 HydrophobicContact CB-CG1 4.29Å; V72-V116 HydrophobicContact CG1-CG1 4.06Å; V72-V117 WeakPolarHBondContact CG1-O 3.4Å; V72-V117 CarbonylContact O-C 3.54Å; V72-V118 CarbonylContact O-C 3.56Å; V72-V118 VanDerWaalsContact O-C 3.26Å; V72-V118 WeakPolarHBondContact O-CA 3.46Å; V72-V118 PolarHBondContact O-N 3.41Å; V72-I119 HydrophobicContact CB-CB 4.3Å; V72-I119 HydrophobicContact CB-CD1 3.98Å; V72-I119 HydrophobicContact CB-CG1 3.98Å; V72-I119 HydrophobicContact CG1-CG1 4.34Å; V72-I119 HydrophobicContact CG2-CD1 3.83Å; V72-I119 HydrophobicContact CG2-CG1 4.38Å; V72-I119 PolarHBondContact O-N 3.5Å
73	I	34.8	Very low	36	Very low	61 Å²	61	73.3 Å²	73.3	31%	0.313	39%	0.39	S	S	.	.			trans	-159.1	148.3	169	-18.7	163.5	0	0	0	111.8	S57 T58 G59 L71 V116 V118	S57-I73 VanDerWaalsContact CB-CB 3.45Å; T58-I73 CarbonylContact C-O 3.26Å; T58-I73 WeakPolarHBondContact CA-O 3.48Å; T58-I73 PolarHBondContact N-O 2.76Å; T58-I73 WeakPolarHBondContact O-CB 3.47Å; T58-I73 WeakPolarHBondContact O-CD1 3.46Å; T58-I73 WeakPolarHBondContact O-CG1 3.27Å; T58-I73 PolarHBondContact O-N 3.39Å; G59-I73 PolarHBondContact N-O 2.77Å; L71-I73 HydrophobicContact CD2-CD1 4.45Å; L71-I73 HydrophobicContact CD2-CG1 4.27Å; I73-V116 WeakPolarHBondContact O-CB 3.2Å; I73-V116 VanDerWaalsContact O-CG1 3.29Å; I73-V116 WeakPolarHBondContact O-CG1 3.35Å; I73-V116 WeakPolarHBondContact O-CG2 3.46Å; I73-V118 HydrophobicContact CG2-CG2 4.49Å
74	R	32.4	Very low	35.9	Very low	13 Å²	13	73.5 Å²	73.5	5%	0.049	40%	0.399	C	S	.	.			trans	-67.9	171.5	-147.4	-162.2	157.1	-73.7	-143.6	5.8	123.6	T50 S51 L54 N56 S57 D76 V116 V117	T50-R74 HydrophobicContact CG2-CG 3.86Å; S51-R74 VanDerWaalsContact O-CZ 3.23Å; S51-R74 PolarHBondContact O-NH1 3.16Å; S51-R74 PolarHBondContact O-NH2 3.4Å; S51-R74 PolarHBondContact OG-NH2 2.74Å; S51-R74 VanDerWaalsContact OG-NH2 3.16Å; L54-R74 VanDerWaalsContact C-CD 3.43Å; L54-R74 WeakPolarHBondContact O-CD 3.42Å; L54-R74 PolarHBondContact O-NE 2.86Å; L54-R74 PolarHBondContact O-NH1 2.87Å; N56-R74 CarbonylContact C-O 3.59Å; S57-R74 CarbonylContact C-O 3.57Å; S57-R74 VanDerWaalsContact CA-O 3.23Å; S57-R74 WeakPolarHBondContact CA-O 3.26Å; S57-R74 VanDerWaalsContact N-C 3.33Å; S57-R74 PolarHBondContact N-O 3.3Å; R74-D76 WeakPolarHBondContact CG-OD1 3.42Å; R74-V116 VanDerWaalsContact CA-CB 3.49Å; R74-V116 WeakPolarHBondContact CA-O 3.37Å; R74-V116 WeakPolarHBondContact CB-O 3.11Å; R74-V116 WeakPolarHBondContact CG-O 3.3Å; R74-V116 PolarHBondContact NE-O 3.03Å; R74-V117 HydrophobicContact CB-CG2 4.32Å
75	R	39.7	Very low	35.8	Very low	80 Å²	80	69.7 Å²	69.7	30%	0.302	39%	0.391	S	S	.	.			trans	-165.3	166.6	142.9	-107	164.5	-135.3	-106.4	2.2	111.6	N56 S57	N56-R75 HydrophobicContact CB-CG 4.16Å; N56-R75 WeakPolarHBondContact OD1-CG 3.16Å; S57-R75 PolarHBondContact O-NE 2.84Å; S57-R75 PolarHBondContact O-NH2 3.45Å
76	D	37	Very low	35.5	Very low	63 Å²	63	74.6 Å²	74.6	34%	0.337	39%	0.391	S	S	.	.			trans	-123.1	23.1	-154.6	-47.3	-23.5	0	0	0	116.3	Q55 N56 R74	Q55-D76 WeakPolarHBondContact CA-OD1 3.49Å; Q55-D76 WeakPolarHBondContact CB-OD2 3.34Å; Q55-D76 VanDerWaalsContact CD-OD2 3.29Å; Q55-D76 WeakPolarHBondContact CG-OD2 3.13Å; Q55-D76 PolarHBondContact NE2-OD2 3.36Å; N56-D76 VanDerWaalsContact CG-OD2 3.27Å; N56-D76 PolarHBondContact N-OD1 2.71Å; N56-D76 VanDerWaalsContact N-OD1 3.08Å; N56-D76 PolarHBondContact ND2-OD2 2.95Å; N56-D76 PolarHBondContact OD1-OD2 2.97Å; R74-D76 WeakPolarHBondContact CG-OD1 3.42Å
77	E	37.1	Very low	35.1	Very low	161 Å²	161	76.6 Å²	76.6	75%	0.752	39%	0.388	S	S	*	.	S	Bend	trans	-128.9	165.4	176.5	-101.4	161.4	-172.2	0	0	112.1	D79	E77-D79 VanDerWaalsContact C-N 3.33Å; E77-D79 PolarHBondContact O-N 2.85Å; E77-D79 VanDerWaalsContact O-N 3.11Å
78	K	38.9	Very low	34.8	Very low	189 Å²	189	79.8 Å²	79.8	82%	0.822	41%	0.406	S	S	*	.			trans	-90.1	51.7	-162.6	-75.4	-168.9	175.2	-178.9	0	114.6
79	D	44.1	Very low	34.4	Very low	114 Å²	114	86 Å²	86	61%	0.61	43%	0.43	S	S	*	.			trans	-95.9	171.7	-176.9	-63.3	-52.6	0	0	0	113.8	E77 P113	E77-D79 VanDerWaalsContact C-N 3.33Å; E77-D79 PolarHBondContact O-N 2.85Å; E77-D79 VanDerWaalsContact O-N 3.11Å; D79-P113 WeakPolarHBondContact O-CA 3.46Å; D79-P113 WeakPolarHBondContact O-CB 3.15Å
80	Y	43.6	Very low	34	Very low	86 Å²	86	90.3 Å²	90.3	34%	0.337	46%	0.46	S	S	.	.			trans	-126.3	136.5	-178	-66.5	-104.5	0	0	0	109.4	Y82 R109	Y80-Y82 WeakPolarHBondContact O-CD2 3.35Å; Y80-Y82 WeakPolarHBondContact O-CE2 3.26Å; Y80-R109 HydrophobicContact CD1-CG 4.35Å; Y80-R109 VanDerWaalsContact CD1-NE 3.3Å; Y80-R109 VanDerWaalsContact CD2-NH2 3.29Å; Y80-R109 VanDerWaalsContact CE1-NH2 3.27Å; Y80-R109 HydrophobicContact CG-CG 4.49Å; Y80-R109 VanDerWaalsContact CG-NE 3.34Å
81	L	37.8	Very low	33.4	Very low	28 Å²	28	94.7 Å²	94.7	15%	0.147	48%	0.483	C	S	.	.			trans	-75.3	148.8	173.4	-79.5	162	0	0	0	111.7	E47 D48 R109 S110 I114	E47-L81 HydrophobicContact CB-CD1 4.33Å; E47-L81 HydrophobicContact CG-CD1 3.91Å; E47-L81 WeakPolarHBondContact OE1-CD1 2.8Å; D48-L81 HydrophobicContact CB-CD1 3.9Å; D48-L81 WeakPolarHBondContact OD2-CD1 3.39Å; D48-L81 WeakPolarHBondContact OD2-CG 3.24Å; L81-R109 WeakPolarHBondContact O-CA 3.18Å; L81-S110 PolarHBondContact N-OG 3.5Å; L81-S110 PolarHBondContact O-N 3.2Å; L81-I114 HydrophobicContact CD1-CD1 3.96Å; L81-I114 HydrophobicContact CD1-CG1 4.37Å
82	Y	39.4	Very low	33	Very low	50 Å²	50	99.9 Å²	99.9	20%	0.196	51%	0.509	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	112.2	175.3	-66.8	-77.9	0	0	0	109.7	Y80 S108 R109 P242 C248 L251	Y80-Y82 WeakPolarHBondContact O-CD2 3.35Å; Y80-Y82 WeakPolarHBondContact O-CE2 3.26Å; Y82-S108 CarbonylContact C-O 3.51Å; Y82-S108 VanDerWaalsContact CA-O 3.26Å; Y82-S108 WeakPolarHBondContact CA-O 3.33Å; Y82-R109 HydrophobicContact CD1-CB 3.79Å; Y82-R109 HydrophobicContact CD1-CG 3.93Å; Y82-R109 HydrophobicContact CE1-CB 3.67Å; Y82-R109 HydrophobicContact CE1-CG 3.5Å; Y82-P242 HydrophobicContact CD2-CG 4.2Å; Y82-P242 HydrophobicContact CG-CG 4.09Å; Y82-C248 HydrophobicContact CD1-CB 3.62Å; Y82-C248 HydrophobicContact CE1-CB 4.13Å; Y82-C248 HydrophobicContact CG-CB 4.5Å; Y82-L251 HydrophobicContact CE1-CD1 3.96Å; Y82-L251 WeakPolarHBondContact OH-CD1 3.42Å
83	H	37.5	Very low	32.5	Very low	66 Å²	66	105.9 Å²	105.9	31%	0.306	55%	0.546	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	147.1	-176.1	62.5	73.6	0	0	0	112.4	G85 C107 S108	H83-G85 PolarHBondContact CE1-O 3.5Å; H83-G85 PolarHBondContact ND1-O 3.25Å; H83-G85 PolarHBondContact O-N 2.77Å; H83-C107 CarbonylContact O-C 2.91Å; H83-S108 PolarHBondContact CE1-OG 2.82Å; H83-S108 PolarHBondContact N-O 2.77Å; H83-S108 PolarHBondContact ND1-OG 2.88Å; H83-S108 VanDerWaalsContact ND1-OG 3.14Å; H83-S108 WeakPolarHBondContact O-CA 3.49Å; H83-S108 PolarHBondContact O-N 2.81Å; H83-S108 PolarHBondContact O-OG 3.32Å
84	D	32.4	Very low	31.9	Very low	116 Å²	116	106.7 Å²	106.7	62%	0.62	56%	0.562	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-83.5	112.5	179.3	-159.9	31.1	0	0	0	110.6	N106 C107	D84-N106 PolarHBondContact OD1-N 3.06Å; D84-C107 PolarHBondContact OD1-N 2.82Å
85	G	34.6	Very low	31.5	Very low	28 Å²	28	114.6 Å²	114.6	29%	0.289	60%	0.599	S	S	.	*	S	Bend	trans	131.4	132.3	175.2	0	0	0	0	0	116.2	H83 N106 S108	H83-G85 PolarHBondContact CE1-O 3.5Å; H83-G85 PolarHBondContact ND1-O 3.25Å; H83-G85 PolarHBondContact O-N 2.77Å; G85-N106 PolarHBondContact N-O 3.02Å; G85-S108 PolarHBondContact O-OG 2.98Å
86	E	29.1	Very low	30.6	Very low	188 Å²	188	115.3 Å²	115.3	88%	0.879	62%	0.616	S	S	*	*			trans	-83.5	119.2	173.9	-178.5	172.2	-126.9	0	0	109.9
87	V	28.3	Very low	29.8	Very low	115 Å²	115	119.7 Å²	119.7	70%	0.697	64%	0.638	S	S	*	*			trans	-118	85.1	-177.8	-175.1	0	0	0	0	110.2	I89	V87-I89 HydrophobicContact CG1-CG1 4.38Å
88	D	24.7	Very low	29.1	Very low	146 Å²	146	116.9 Å²	116.9	78%	0.781	63%	0.632	S	S	*	*			trans	-90.6	121.9	173.8	-158.2	1.7	0	0	0	110.1	S90	D88-S90 PolarHBondContact O-N 3.47Å
89	I	23.3	Very low	28.2	Very low	159 Å²	159	115.3 Å²	115.3	82%	0.815	63%	0.631	S	S	*	*			trans	-92.8	89.1	-166.4	-55.8	179.5	0	0	0	110.5	V87	V87-I89 HydrophobicContact CG1-CG1 4.38Å
90	S	21.5	Very low	27.3	Very low	104 Å²	104	118 Å²	118	73%	0.727	64%	0.638	S	S	*	*			trans	-142.3	176	170.2	68.6	0	0	0	0	113.6	D88	D88-S90 PolarHBondContact O-N 3.47Å
91	L	21.5	Very low	26.3	Very low	171 Å²	171	120.5 Å²	120.5	90%	0.895	66%	0.657	S	S	*	*			trans	-63.9	145.9	-149	-95	65.5	0	0	0	118.1
92	I	21.8	Very low	25.7	Very low	155 Å²	155	127.1 Å²	127.1	80%	0.795	69%	0.692	S	S	*	*			trans	-41.2	126.1	163.6	-55.6	162.6	0	0	0	113.2
93	T	23.8	Very low	25	Very low	131 Å²	131	126.5 Å²	126.5	80%	0.804	70%	0.701	S	S	*	*				-170.3	133.1	122.6	14.6	0	0	0	0	115.4
94	A	22.2	Very low	24.8	Very low	78 Å²	78	130.9 Å²	130.9	65%	0.645	72%	0.715	S	S	*	*			trans	40.8	135.4	141	0	0	0	0	0	123.5
95	H	22.7	Very low	24.8	Very low	179 Å²	179	127.5 Å²	127.5	83%	0.829	71%	0.707	S	S	*	*			trans	78.4	114.1	155.8	-66.3	-67.3	0	0	0	121.3
96	S	21.4	Very low	24.9	Very low	95 Å²	95	130.7 Å²	130.7	66%	0.664	72%	0.717	S	S	*	*			trans	89.6	107.8	132.8	-61.2	0	0	0	0	121.7
97	I	20.9	Very low	25.5	Very low	154 Å²	154	122.3 Å²	122.3	79%	0.79	68%	0.68	S	S	*	*			trans	70.5	129.6	139.1	-48.9	162.3	0	0	0	117.7
98	V	21.6	Very low	25.8	Very low	102 Å²	102	117.8 Å²	117.8	62%	0.618	65%	0.653	S	S	*	*				167.3	146.5	127.6	155.7	0	0	0	0	109.3
99	L	19.9	Very low	26.6	Very low	156 Å²	156	112.8 Å²	112.8	82%	0.817	62%	0.623	S	S	*	*			trans	-73.3	141.2	179.1	-58.7	80.9	0	0	0	111.6
100	F	24.4	Very low	27.5	Very low	171 Å²	171	105.9 Å²	105.9	75%	0.75	59%	0.589	S	S	*	*			trans	-103.3	106.8	160.7	-78.2	-89	0	0	0	110.1
101	N	22.8	Very low	28.2	Very low	138 Å²	138	109.3 Å²	109.3	74%	0.738	60%	0.599	S	S	*	*			trans	-80.5	164	171.2	-167.9	12.4	0	0	0	109.7	G103	N101-G103 PolarHBondContact O-N 3.29Å
102	L	25.6	Very low	28.8	Very low	168 Å²	168	104.1 Å²	104.1	88%	0.88	58%	0.577	S	S	*	*	S	Bend	trans	-67.7	80.7	167	-73.9	166.6	0	0	0	109.6
103	G	26	Very low	29.3	Very low	37 Å²	37	99.6 Å²	99.6	38%	0.381	56%	0.558	S	S	.	*			trans	162.1	87	-179.6	0	0	0	0	0	115.6	N101 P439	N101-G103 PolarHBondContact O-N 3.29Å; G103-P439 WeakPolarHBondContact O-CB 3.31Å
104	R	32.3	Very low	29.7	Very low	158 Å²	158	95.1 Å²	95.1	60%	0.596	53%	0.529	S	S	*	.			trans	-161.1	83.5	156.8	-99.3	169.7	-162.6	-154.7	5	108	N106 P439	R104-N106 PolarHBondContact O-N 3.02Å; R104-P439 HydrophobicContact CG-CB 4.35Å
105	G	32.8	Very low	30	Very low	45 Å²	45	96.8 Å²	96.8	46%	0.464	52%	0.523	S	S	.	.			trans	-71	81.9	-172.2	0	0	0	0	0	114.2
106	N	37.3	Very low	30.3	Very low	94 Å²	94	88.3 Å²	88.3	50%	0.503	48%	0.484	S	S	.	.			trans	-129.1	51.4	176.6	-96	18.9	0	0	0	110.2	D84 G85 R104	D84-N106 PolarHBondContact OD1-N 3.06Å; G85-N106 PolarHBondContact N-O 3.02Å; R104-N106 PolarHBondContact O-N 3.02Å
107	C	39.8	Very low	30.6	Very low	13 Å²	13	85 Å²	85	9%	0.088	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-48.7	147.8	162.7	176.5	0	0	0	0	110	H83 D84 V246 C248 S249	H83-C107 CarbonylContact O-C 2.91Å; D84-C107 PolarHBondContact OD1-N 2.82Å; C107-V246 HydrophobicContact CB-CG1 4.26Å; C107-C248 HydrophobicContact CB-CB 3.74Å; C107-C248 WeakPolarHBondContact CB-SG 3.49Å; C107-C248 CarbonylContact O-C 3.15Å; C107-C248 WeakPolarHBondContact SG-CB 3.42Å; C107-C248 CovalentContact SG-SG 2.03Å; C107-C248 PolarHBondContact SG-SG 2.73Å; C107-S249 WeakPolarHBondContact O-CA 3.46Å; C107-S249 WeakPolarHBondContact O-CB 3.29Å; C107-S249 PolarHBondContact O-N 3.08Å; C107-S249 PolarHBondContact O-OG 2.88Å
108	S	36.4	Very low	30.9	Very low	20 Å²	20	81.8 Å²	81.8	14%	0.14	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	156.6	-173.7	64.2	0	0	0	0	110.3	Y82 H83 G85 S249	Y82-S108 CarbonylContact C-O 3.51Å; Y82-S108 VanDerWaalsContact CA-O 3.26Å; Y82-S108 WeakPolarHBondContact CA-O 3.33Å; H83-S108 PolarHBondContact CE1-OG 2.82Å; H83-S108 PolarHBondContact N-O 2.77Å; H83-S108 PolarHBondContact ND1-OG 2.88Å; H83-S108 VanDerWaalsContact ND1-OG 3.14Å; H83-S108 WeakPolarHBondContact O-CA 3.49Å; H83-S108 PolarHBondContact O-N 2.81Å; H83-S108 PolarHBondContact O-OG 3.32Å; G85-S108 PolarHBondContact O-OG 2.98Å; S108-S249 CarbonylContact C-O 3.53Å; S108-S249 VanDerWaalsContact CA-O 3.3Å; S108-S249 WeakPolarHBondContact CA-O 3.38Å
109	R	41	Very low	31.2	Very low	41 Å²	41	80.4 Å²	80.4	16%	0.155	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	146	-171.3	-174.5	-166.6	177	-156.7	2.3	112.1	Y80 L81 Y82 S249 G250	Y80-R109 HydrophobicContact CD1-CG 4.35Å; Y80-R109 VanDerWaalsContact CD1-NE 3.3Å; Y80-R109 VanDerWaalsContact CD2-NH2 3.29Å; Y80-R109 VanDerWaalsContact CE1-NH2 3.27Å; Y80-R109 HydrophobicContact CG-CG 4.49Å; Y80-R109 VanDerWaalsContact CG-NE 3.34Å; L81-R109 WeakPolarHBondContact O-CA 3.18Å; Y82-R109 HydrophobicContact CD1-CB 3.79Å; Y82-R109 HydrophobicContact CD1-CG 3.93Å; Y82-R109 HydrophobicContact CE1-CB 3.67Å; Y82-R109 HydrophobicContact CE1-CG 3.5Å; R109-S249 PolarHBondContact N-O 3.14Å; R109-S249 VanDerWaalsContact N-O 3.09Å; R109-G250 WeakPolarHBondContact CD-O 3.22Å; R109-G250 PolarHBondContact NH1-O 3.26Å
110	S	41.1	Very low	31.7	Very low	13 Å²	13	75.8 Å²	75.8	9%	0.091	41%	0.411	C	S	.	.			trans	-57.8	138.8	172.4	69.1	0	0	0	0	112.5	L81 S112	L81-S110 PolarHBondContact N-OG 3.5Å; L81-S110 PolarHBondContact O-N 3.2Å; S110-S112 WeakPolarHBondContact CB-O 3.24Å; S110-S112 PolarHBondContact O-N 3.29Å; S110-S112 PolarHBondContact OG-O 2.95Å
111	N	37.9	Very low	32.1	Very low	177 Å²	177	70.2 Å²	70.2	95%	0.947	39%	0.393	S	S	*	.	S	Bend	trans	-71.8	-10.5	179.5	-76.2	-39.8	0	0	0	113.9
112	S	33.1	Very low	32.4	Very low	62 Å²	62	66.5 Å²	66.5	43%	0.434	37%	0.372	S	S	.	.	S	Bend	trans	-145.5	151	177.9	51.7	0	0	0	0	110	S110	S110-S112 WeakPolarHBondContact CB-O 3.24Å; S110-S112 PolarHBondContact O-N 3.29Å; S110-S112 PolarHBondContact OG-O 2.95Å
113	P	33.2	Very low	32.6	Very low	59 Å²	59	65.3 Å²	65.3	38%	0.383	37%	0.366	S	S	.	.			trans	-65.7	145.3	165.4	30.8	-34.8	0	0	0	109.7	D79	D79-P113 WeakPolarHBondContact O-CA 3.46Å; D79-P113 WeakPolarHBondContact O-CB 3.15Å
114	I	31.8	Very low	33	Very low	37 Å²	37	65.6 Å²	65.6	19%	0.19	36%	0.359	C	S	.	.			trans	-144	93.8	-177.5	26.1	-179.5	0	0	0	110	D48 L49 L81	D48-I114 HydrophobicContact CB-CB 3.59Å; D48-I114 HydrophobicContact CB-CD1 3.9Å; D48-I114 HydrophobicContact CB-CG1 3.74Å; D48-I114 WeakPolarHBondContact CB-O 3.37Å; D48-I114 VanDerWaalsContact CG-O 3.32Å; L49-I114 HydrophobicContact CB-CG2 4.36Å; L81-I114 HydrophobicContact CD1-CD1 3.96Å; L81-I114 HydrophobicContact CD1-CG1 4.37Å
115	E	27	Very low	33	Very low	113 Å²	113	62 Å²	62	53%	0.528	36%	0.356	S	S	.	.				15.6	140.9	97.8	-72.1	-171.6	29.9	0	0	118.9	D48 L49 T50	D48-E115 CarbonylContact C-O 3.54Å; L49-E115 CarbonylContact C-O 3.56Å; L49-E115 WeakPolarHBondContact CA-O 3.46Å; L49-E115 PolarHBondContact N-O 3Å; T50-E115 WeakPolarHBondContact CB-OE1 3.17Å; T50-E115 VanDerWaalsContact CG2-C 3.47Å; T50-E115 VanDerWaalsContact CG2-CA 3.43Å; T50-E115 HydrophobicContact CG2-CB 3.35Å; T50-E115 HydrophobicContact CG2-CG 3.8Å; T50-E115 VanDerWaalsContact N-C 3.33Å; T50-E115 PolarHBondContact N-O 3.38Å; T50-E115 PolarHBondContact OG1-OE1 3.48Å
116	V	29.5	Very low	33.1	Very low	1 Å²	1	65.3 Å²	65.3	1%	0.006	37%	0.369	C	S	.	.			trans	-145.1	154.3	172	-146.9	0	0	0	0	118.5	D48 L49 T50 V72 I73 R74	D48-V116 HydrophobicContact CB-CB 4.36Å; D48-V116 HydrophobicContact CB-CG1 4.39Å; D48-V116 HydrophobicContact CB-CG2 3.6Å; D48-V116 VanDerWaalsContact CG-CG2 3.48Å; D48-V116 WeakPolarHBondContact OD1-CG2 3.41Å; L49-V116 VanDerWaalsContact N-CG1 3.33Å; L49-V116 CarbonylContact O-C 3.51Å; L49-V116 WeakPolarHBondContact O-CA 3.45Å; T50-V116 WeakPolarHBondContact CG2-O 3.36Å; V72-V116 HydrophobicContact CB-CG1 4.29Å; V72-V116 HydrophobicContact CG1-CG1 4.06Å; I73-V116 WeakPolarHBondContact O-CB 3.2Å; I73-V116 VanDerWaalsContact O-CG1 3.29Å; I73-V116 WeakPolarHBondContact O-CG1 3.35Å; I73-V116 WeakPolarHBondContact O-CG2 3.46Å; R74-V116 VanDerWaalsContact CA-CB 3.49Å; R74-V116 WeakPolarHBondContact CA-O 3.37Å; R74-V116 WeakPolarHBondContact CB-O 3.11Å; R74-V116 WeakPolarHBondContact CG-O 3.3Å; R74-V116 PolarHBondContact NE-O 3.03Å
117	V	27.8	Very low	33.2	Very low	25 Å²	25	63.6 Å²	63.6	15%	0.152	37%	0.368	C	S	.	.			trans	-166.4	127.5	156	107.2	0	0	0	0	123.6	L49 S51 L54 V72 R74	L49-V117 PolarHBondContact O-N 2.86Å; S51-V117 VanDerWaalsContact OG-CG1 3.32Å; S51-V117 WeakPolarHBondContact OG-CG1 3.37Å; L54-V117 HydrophobicContact CB-CG2 3.7Å; L54-V117 HydrophobicContact CD1-CB 4.48Å; L54-V117 HydrophobicContact CD1-CG1 4.07Å; L54-V117 HydrophobicContact CD1-CG2 3.62Å; L54-V117 HydrophobicContact CD2-CG2 3.65Å; L54-V117 HydrophobicContact CG-CG2 3.82Å; V72-V117 WeakPolarHBondContact CG1-O 3.4Å; V72-V117 CarbonylContact O-C 3.54Å; R74-V117 HydrophobicContact CB-CG2 4.32Å
118	V	27	Very low	33	Very low	87 Å²	87	64.6 Å²	64.6	53%	0.527	37%	0.371	S	S	.	.			trans	46.8	123.2	168	178.9	0	0	0	0	120.8	L54 V72 I73	L54-V118 HydrophobicContact CD2-CG2 3.93Å; V72-V118 CarbonylContact O-C 3.56Å; V72-V118 VanDerWaalsContact O-C 3.26Å; V72-V118 WeakPolarHBondContact O-CA 3.46Å; V72-V118 PolarHBondContact O-N 3.41Å; I73-V118 HydrophobicContact CG2-CG2 4.49Å
119	I	28.9	Very low	33.3	Very low	73 Å²	73	65.9 Å²	65.9	37%	0.374	37%	0.374	S	S	.	.			trans	-131.4	144.4	160.1	-88.8	-179.5	0	0	0	114	N70 L71 V72	N70-I119 WeakPolarHBondContact O-CD1 3.47Å; L71-I119 HydrophobicContact CB-CG2 4.44Å; L71-I119 HydrophobicContact CD1-CG2 4.04Å; L71-I119 HydrophobicContact CG-CB 4.23Å; L71-I119 HydrophobicContact CG-CG2 4.18Å; V72-I119 HydrophobicContact CB-CB 4.3Å; V72-I119 HydrophobicContact CB-CD1 3.98Å; V72-I119 HydrophobicContact CB-CG1 3.98Å; V72-I119 HydrophobicContact CG1-CG1 4.34Å; V72-I119 HydrophobicContact CG2-CD1 3.83Å; V72-I119 HydrophobicContact CG2-CG1 4.38Å; V72-I119 PolarHBondContact O-N 3.5Å
120	N	30.8	Very low	33	Very low	59 Å²	59	70.3 Å²	70.3	32%	0.316	40%	0.401	S	S	.	.			trans	-107	120.8	172.1	172.9	3.3	0	0	0	109.9	L122 L123	N120-L122 PolarHBondContact O-N 2.83Å; N120-L122 VanDerWaalsContact O-N 3.08Å; N120-L122 WeakPolarHBondContact OD1-CB 3.3Å; N120-L122 PolarHBondContact OD1-N 3.47Å; N120-L123 HydrophobicContact CB-CD1 4.34Å; N120-L123 PolarHBondContact O-N 3.32Å; N120-L123 VanDerWaalsContact O-N 3.12Å
121	P	31.7	Very low	32.7	Very low	55 Å²	55	81.6 Å²	81.6	36%	0.357	44%	0.442	S	S	.	.	G	3₁₀ helix	trans	-67.1	-9.3	-176.4	27.4	-35.4	0	0	0	114.8	F33 L123 L124	F33-P121 HydrophobicContact CE2-CG 4.4Å; P121-L123 PolarHBondContact O-N 2.94Å; P121-L124 WeakPolarHBondContact O-CG 3.02Å
122	L	30.4	Very low	32.6	Very low	59 Å²	59	76.1 Å²	76.1	31%	0.309	42%	0.415	S	S	.	.	G	3₁₀ helix	trans	-74.1	-2.5	171.7	-62.3	174.2	0	0	0	113.7	L22 N120 F137	L22-L122 HydrophobicContact CD1-CD1 3.82Å; N120-L122 PolarHBondContact O-N 2.83Å; N120-L122 VanDerWaalsContact O-N 3.08Å; N120-L122 WeakPolarHBondContact OD1-CB 3.3Å; N120-L122 PolarHBondContact OD1-N 3.47Å; L122-F137 HydrophobicContact CD2-CB 4.26Å; L122-F137 HydrophobicContact CD2-CD2 4.43Å
123	L	29	Very low	32.7	Very low	143 Å²	143	78.1 Å²	78.1	75%	0.749	44%	0.435	S	S	*	.	G	3₁₀ helix	trans	-98	3.1	176.5	-62.5	174.6	0	0	0	113.8	N120 P121	N120-L123 HydrophobicContact CB-CD1 4.34Å; N120-L123 PolarHBondContact O-N 3.32Å; N120-L123 VanDerWaalsContact O-N 3.12Å; P121-L123 PolarHBondContact O-N 2.94Å
124	L	35.2	Very low	33.1	Very low	43 Å²	43	77.9 Å²	77.9	23%	0.225	43%	0.43	C	S	.	.	S	Bend	trans	-64.6	134.5	175.9	-67.7	174.9	0	0	0	111	P121 F128 F129	P121-L124 WeakPolarHBondContact O-CG 3.02Å; L124-F128 HydrophobicContact CD1-CD1 4.31Å; L124-F129 HydrophobicContact CB-CE2 3.94Å; L124-F129 HydrophobicContact CB-CZ 4.41Å; L124-F129 HydrophobicContact CD1-CE2 4.41Å; L124-F129 HydrophobicContact CD1-CZ 4.04Å
125	P	31.7	Very low	33.6	Very low	84 Å²	84	78.7 Å²	78.7	55%	0.545	44%	0.437	S	S	.	.			trans	-57.1	144.1	179.5	-26.4	34.6	0	0	0	112.5	A127 F128	P125-A127 PolarHBondContact O-N 3.13Å; P125-F128 WeakPolarHBondContact O-CB 3.42Å; P125-F128 PolarHBondContact O-N 2.79Å
126	P	34.3	Very low	34.3	Very low	113 Å²	113	76.7 Å²	76.7	73%	0.734	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-53.2	-26.3	178.7	-29.1	35.8	0	0	0	114.5	F128 F129 N130	P126-F128 PolarHBondContact O-N 3.42Å; P126-F129 PolarHBondContact O-N 3.2Å; P126-F129 VanDerWaalsContact O-N 3.1Å; P126-N130 PolarHBondContact O-N 2.77Å
127	A	39.3	Very low	34.9	Very low	59 Å²	59	81.9 Å²	81.9	49%	0.488	45%	0.452	S	S	.	.	G	3₁₀ helix	trans	-52.9	-32	172.4	0	0	0	0	0	114	P125 F129 N130	P125-A127 PolarHBondContact O-N 3.13Å; A127-F129 VanDerWaalsContact C-N 3.27Å; A127-F129 PolarHBondContact O-N 2.84Å; A127-N130 VanDerWaalsContact O-CB 3.31Å; A127-N130 WeakPolarHBondContact O-CB 3.38Å; A127-N130 PolarHBondContact O-N 3.31Å
128	F	36.9	Very low	35.8	Very low	33 Å²	33	84.5 Å²	84.5	15%	0.145	47%	0.465	C	S	.	.	G	3₁₀ helix	trans	-68.5	-24.9	-179.8	-150.8	-88.7	0	0	0	113.1	K64 I67 L124 P125 P126	K64-F128 HydrophobicContact CB-CZ 4.32Å; K64-F128 HydrophobicContact CD-CE1 4.48Å; I67-F128 HydrophobicContact CB-CD2 4.39Å; I67-F128 HydrophobicContact CB-CE2 4.45Å; I67-F128 HydrophobicContact CG2-CD2 3.62Å; I67-F128 HydrophobicContact CG2-CE2 3.97Å; L124-F128 HydrophobicContact CD1-CD1 4.31Å; P125-F128 WeakPolarHBondContact O-CB 3.42Å; P125-F128 PolarHBondContact O-N 2.79Å; P126-F128 PolarHBondContact O-N 3.42Å
129	F	41.5	Very low	36.8	Very low	48 Å²	48	81.9 Å²	81.9	21%	0.211	45%	0.448	C	S	.	.	G	3₁₀ helix	trans	-107.3	7.6	-177.8	-58.8	-72.7	0	0	0	113.5	L124 P126 A127 R131 T132 L136	L124-F129 HydrophobicContact CB-CE2 3.94Å; L124-F129 HydrophobicContact CB-CZ 4.41Å; L124-F129 HydrophobicContact CD1-CE2 4.41Å; L124-F129 HydrophobicContact CD1-CZ 4.04Å; P126-F129 PolarHBondContact O-N 3.2Å; P126-F129 VanDerWaalsContact O-N 3.1Å; A127-F129 VanDerWaalsContact C-N 3.27Å; A127-F129 PolarHBondContact O-N 2.84Å; F129-R131 PolarHBondContact O-N 2.91Å; F129-T132 PolarHBondContact O-N 2.6Å; F129-T132 VanDerWaalsContact O-N 3.09Å; F129-T132 PolarHBondContact O-OG1 3.41Å; F129-L136 HydrophobicContact CE1-CD1 3.92Å
130	N	34.6	Very low	37.7	Very low	133 Å²	133	83.4 Å²	83.4	71%	0.711	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	26.3	-162.2	-157.5	16.8	0	0	0	116.2	P126 A127	P126-N130 PolarHBondContact O-N 2.77Å; A127-N130 VanDerWaalsContact O-CB 3.31Å; A127-N130 WeakPolarHBondContact O-CB 3.38Å; A127-N130 PolarHBondContact O-N 3.31Å
131	R	36.2	Very low	38.5	Very low	250 Å²	250	82.8 Å²	82.8	94%	0.943	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-142.7	5.4	170.1	-69.4	-164.1	177.7	-160.8	-0.2	114.5	F129	F129-R131 PolarHBondContact O-N 2.91Å
132	T	35.7	Very low	39.3	Very low	62 Å²	62	83.1 Å²	83.1	38%	0.38	44%	0.44	S	S	.	.			trans	-119.1	123.1	179.2	40.9	0	0	0	0	110.8	F129 L134 M218	F129-T132 PolarHBondContact O-N 2.6Å; F129-T132 VanDerWaalsContact O-N 3.09Å; F129-T132 PolarHBondContact O-OG1 3.41Å; T132-L134 PolarHBondContact O-N 2.72Å; T132-M218 HydrophobicContact CG2-CE 4.48Å
133	A	34.1	Very low	40.1	Very low	104 Å²	104	83.3 Å²	83.3	86%	0.86	44%	0.439	S	S	*	.	S	Bend	trans	-77.1	36.4	-176	0	0	0	0	0	114
134	L	41.6	Very low	40.9	Very low	55 Å²	55	81.6 Å²	81.6	29%	0.288	43%	0.425	S	S	.	.	S	Bend	trans	-160.6	114.8	-176	-127.9	175.4	0	0	0	105.8	T132 D138 L139 L171 I177	T132-L134 PolarHBondContact O-N 2.72Å; L134-D138 HydrophobicContact CD2-CB 4.03Å; L134-L139 HydrophobicContact CD2-CB 4.28Å; L134-L171 HydrophobicContact CD1-CD1 4.21Å; L134-L171 HydrophobicContact CD1-CD2 3.86Å; L134-L171 HydrophobicContact CG-CD2 4.14Å; L134-I177 HydrophobicContact CD1-CD1 3.65Å
135	T	42.3	Very low	41.4	Very low	53 Å²	53	86.6 Å²	86.6	33%	0.325	45%	0.448	S	S	.	.			trans	-83.3	154.1	170.7	72.2	0	0	0	0	109.7	F137 D138 L139	T135-F137 PolarHBondContact O-N 3.18Å; T135-F137 WeakPolarHBondContact OG1-CB 3.47Å; T135-F137 PolarHBondContact OG1-N 3.1Å; T135-D138 WeakPolarHBondContact CB-OD2 3.49Å; T135-D138 WeakPolarHBondContact CG2-OD2 3.31Å; T135-D138 PolarHBondContact N-OD2 2.94Å; T135-D138 PolarHBondContact O-N 3.34Å; T135-D138 VanDerWaalsContact O-N 3.16Å; T135-D138 PolarHBondContact OG1-N 2.99Å; T135-D138 PolarHBondContact OG1-OD2 2.94Å; T135-L139 PolarHBondContact O-N 2.9Å; T135-L139 VanDerWaalsContact O-N 3.17Å
136	L	42.1	Very low	42	Very low	71 Å²	71	86.7 Å²	86.7	37%	0.372	44%	0.44	S	S	.	.	H	α-helix	trans	-59.8	-25.3	170.1	-108	94.5	0	0	0	111.9	F129 W140	F129-L136 HydrophobicContact CE1-CD1 3.92Å; L136-W140 VanDerWaalsContact O-CB 3.27Å; L136-W140 WeakPolarHBondContact O-CB 3.09Å; L136-W140 PolarHBondContact O-N 2.97Å
137	F	41.1	Very low	42.3	Very low	110 Å²	110	86.2 Å²	86.2	48%	0.482	44%	0.439	S	S	.	.	H	α-helix	trans	-69	-41.6	175.5	179.3	-100	0	0	0	112.1	L122 T135 W140 N141	L122-F137 HydrophobicContact CD2-CB 4.26Å; L122-F137 HydrophobicContact CD2-CD2 4.43Å; T135-F137 PolarHBondContact O-N 3.18Å; T135-F137 WeakPolarHBondContact OG1-CB 3.47Å; T135-F137 PolarHBondContact OG1-N 3.1Å; F137-W140 PolarHBondContact O-N 3.44Å; F137-N141 VanDerWaalsContact CD1-ND2 3.34Å; F137-N141 WeakPolarHBondContact CD1-ND2 3.29Å; F137-N141 WeakPolarHBondContact CE1-ND2 3.38Å; F137-N141 VanDerWaalsContact CZ-ND2 3.32Å; F137-N141 WeakPolarHBondContact CZ-ND2 3.28Å; F137-N141 WeakPolarHBondContact O-CB 3.16Å; F137-N141 VanDerWaalsContact O-CG 3.27Å; F137-N141 PolarHBondContact O-N 3.45Å; F137-N141 PolarHBondContact O-ND2 3.12Å; F137-N141 VanDerWaalsContact O-ND2 3.07Å
138	D	46.9	Very low	42.5	Very low	81 Å²	81	89.8 Å²	89.8	43%	0.433	44%	0.44	S	S	.	.	H	α-helix	trans	-63.2	-45.4	173.5	-56.9	-50.4	0	0	0	111	L134 T135 W140 N141 Y142	L134-D138 HydrophobicContact CD2-CB 4.03Å; T135-D138 WeakPolarHBondContact CB-OD2 3.49Å; T135-D138 WeakPolarHBondContact CG2-OD2 3.31Å; T135-D138 PolarHBondContact N-OD2 2.94Å; T135-D138 PolarHBondContact O-N 3.34Å; T135-D138 VanDerWaalsContact O-N 3.16Å; T135-D138 PolarHBondContact OG1-N 2.99Å; T135-D138 PolarHBondContact OG1-OD2 2.94Å; D138-W140 VanDerWaalsContact C-N 3.34Å; D138-W140 PolarHBondContact O-N 3.26Å; D138-N141 PolarHBondContact O-N 2.03Å; D138-Y142 WeakPolarHBondContact O-CB 3.46Å; D138-Y142 PolarHBondContact O-N 2.79Å
139	L	48.4	Very low	42.4	Very low	31 Å²	31	94.6 Å²	94.6	16%	0.162	47%	0.467	C	S	.	.	H	α-helix	trans	-61.4	-41.1	176.5	-173.5	69	0	0	0	111.7	L134 T135 Y142 F143 I203	L134-L139 HydrophobicContact CD2-CB 4.28Å; T135-L139 PolarHBondContact O-N 2.9Å; T135-L139 VanDerWaalsContact O-N 3.17Å; L139-Y142 WeakPolarHBondContact O-CB 3.24Å; L139-Y142 PolarHBondContact O-N 2.88Å; L139-F143 HydrophobicContact CD1-CE2 3.99Å; L139-F143 HydrophobicContact CD1-CZ 4.43Å; L139-F143 HydrophobicContact CD2-CE2 4.14Å; L139-F143 HydrophobicContact CG-CD2 4.11Å; L139-F143 HydrophobicContact CG-CE2 3.71Å; L139-F143 WeakPolarHBondContact O-CD2 3.37Å; L139-F143 PolarHBondContact O-N 3.02Å; L139-I203 HydrophobicContact CD1-CD1 4.25Å; L139-I203 HydrophobicContact CD2-CD1 3.84Å
140	W	46.8	Very low	42.1	Very low	106 Å²	106	102 Å²	102	40%	0.402	50%	0.499	S	S	.	.	H	α-helix	trans	-68.5	-38.4	176.3	-172.7	-118.9	0	0	0	112.7	L136 F137 D138 Y142 F143 K144	L136-W140 VanDerWaalsContact O-CB 3.27Å; L136-W140 WeakPolarHBondContact O-CB 3.09Å; L136-W140 PolarHBondContact O-N 2.97Å; F137-W140 PolarHBondContact O-N 3.44Å; D138-W140 VanDerWaalsContact C-N 3.34Å; D138-W140 PolarHBondContact O-N 3.26Å; W140-Y142 VanDerWaalsContact C-N 3.34Å; W140-F143 PolarHBondContact O-N 2.89Å; W140-K144 WeakPolarHBondContact O-CG 3.31Å; W140-K144 PolarHBondContact O-N 2.89Å
141	N	48.4	Very low	42	Very low	45 Å²	45	99.9 Å²	99.9	24%	0.241	49%	0.492	C	S	.	.	H	α-helix	trans	-70.3	-30.9	174.4	-70.5	-36	0	0	0	112.2	F137 D138 K144 Q145	F137-N141 VanDerWaalsContact CD1-ND2 3.34Å; F137-N141 WeakPolarHBondContact CD1-ND2 3.29Å; F137-N141 WeakPolarHBondContact CE1-ND2 3.38Å; F137-N141 VanDerWaalsContact CZ-ND2 3.32Å; F137-N141 WeakPolarHBondContact CZ-ND2 3.28Å; F137-N141 WeakPolarHBondContact O-CB 3.16Å; F137-N141 VanDerWaalsContact O-CG 3.27Å; F137-N141 PolarHBondContact O-N 3.45Å; F137-N141 PolarHBondContact O-ND2 3.12Å; F137-N141 VanDerWaalsContact O-ND2 3.07Å; D138-N141 PolarHBondContact O-N 2.03Å; N141-K144 PolarHBondContact O-N 3.03Å; N141-Q145 WeakPolarHBondContact O-CG 3.17Å; N141-Q145 PolarHBondContact O-N 3.16Å
142	Y	49.3	Very low	42	Very low	62 Å²	62	95.4 Å²	95.4	24%	0.243	49%	0.486	C	S	.	.	H	α-helix	trans	-64.2	-48.6	168.2	179	-104	0	0	0	111.2	D138 L139 W140 K144 Q145 F146 I169	D138-Y142 WeakPolarHBondContact O-CB 3.46Å; D138-Y142 PolarHBondContact O-N 2.79Å; L139-Y142 WeakPolarHBondContact O-CB 3.24Å; L139-Y142 PolarHBondContact O-N 2.88Å; W140-Y142 VanDerWaalsContact C-N 3.34Å; Y142-K144 VanDerWaalsContact C-N 3.28Å; Y142-K144 PolarHBondContact O-N 2.9Å; Y142-Q145 WeakPolarHBondContact O-CB 3.46Å; Y142-Q145 PolarHBondContact O-N 3Å; Y142-F146 HydrophobicContact CD1-CE2 4.12Å; Y142-F146 AromaticContact CE1-CE2 3.58Å; Y142-F146 HydrophobicContact CE1-CE2 3.58Å; Y142-F146 HydrophobicContact CE1-CZ 4.24Å; Y142-F146 HydrophobicContact CE2-CE2 4.05Å; Y142-F146 AromaticContact CZ-CE2 3.54Å; Y142-F146 AromaticContact CZ-CZ 3.94Å; Y142-F146 WeakPolarHBondContact O-CD2 3.47Å; Y142-I169 HydrophobicContact CD1-CD1 4.12Å; Y142-I169 HydrophobicContact CE1-CD1 3.41Å; Y142-I169 VanDerWaalsContact CE1-CD1 3.41Å; Y142-I169 HydrophobicContact CE1-CG1 4.31Å; Y142-I169 HydrophobicContact CE2-CD1 4.33Å
143	F	47.4	Very low	42.1	Very low	63 Å²	63	97.3 Å²	97.3	28%	0.276	49%	0.493	S	S	.	.	H	α-helix	trans	-60.3	-34.8	174.7	-74.9	-54.5	0	0	0	113.1	L139 W140 Q145 F146 V179 V181 V201	L139-F143 HydrophobicContact CD1-CE2 3.99Å; L139-F143 HydrophobicContact CD1-CZ 4.43Å; L139-F143 HydrophobicContact CD2-CE2 4.14Å; L139-F143 HydrophobicContact CG-CD2 4.11Å; L139-F143 HydrophobicContact CG-CE2 3.71Å; L139-F143 WeakPolarHBondContact O-CD2 3.37Å; L139-F143 PolarHBondContact O-N 3.02Å; W140-F143 PolarHBondContact O-N 2.89Å; F143-Q145 VanDerWaalsContact C-N 3.26Å; F143-Q145 PolarHBondContact O-N 2.86Å; F143-F146 PolarHBondContact O-N 3.49Å; F143-V179 HydrophobicContact CZ-CG1 4.3Å; F143-V181 HydrophobicContact CE1-CG2 4.37Å; F143-V201 HydrophobicContact CZ-CG1 4.29Å
144	K	44.7	Very low	42.1	Very low	107 Å²	107	96.4 Å²	96.4	47%	0.465	48%	0.479	S	S	.	.	H	α-helix	trans	-63.4	-25	172.2	-79.1	179.5	179.3	173.1	0	114.4	W140 N141 Y142 F146	W140-K144 WeakPolarHBondContact O-CG 3.31Å; W140-K144 PolarHBondContact O-N 2.89Å; N141-K144 PolarHBondContact O-N 3.03Å; Y142-K144 VanDerWaalsContact C-N 3.28Å; Y142-K144 PolarHBondContact O-N 2.9Å; K144-F146 VanDerWaalsContact C-N 3.26Å; K144-F146 PolarHBondContact O-N 2.93Å
145	Q	46	Very low	42.1	Very low	149 Å²	149	97.9 Å²	97.9	70%	0.696	49%	0.494	S	S	*	.	H	α-helix	trans	-75.5	-16.2	177.8	-70.3	170.2	21	0	0	112.5	N141 Y142 F143 S147	N141-Q145 WeakPolarHBondContact O-CG 3.17Å; N141-Q145 PolarHBondContact O-N 3.16Å; Y142-Q145 WeakPolarHBondContact O-CB 3.46Å; Y142-Q145 PolarHBondContact O-N 3Å; F143-Q145 VanDerWaalsContact C-N 3.26Å; F143-Q145 PolarHBondContact O-N 2.86Å; Q145-S147 VanDerWaalsContact C-N 3.28Å; Q145-S147 PolarHBondContact O-N 2.81Å
146	F	45	Very low	42.1	Very low	85 Å²	85	103.8 Å²	103.8	37%	0.373	52%	0.518	S	S	.	.			trans	-77.9	79.2	169.3	-72.4	-94.1	0	0	0	110.5	Y142 F143 K144 W148	Y142-F146 HydrophobicContact CD1-CE2 4.12Å; Y142-F146 AromaticContact CE1-CE2 3.58Å; Y142-F146 HydrophobicContact CE1-CE2 3.58Å; Y142-F146 HydrophobicContact CE1-CZ 4.24Å; Y142-F146 HydrophobicContact CE2-CE2 4.05Å; Y142-F146 AromaticContact CZ-CE2 3.54Å; Y142-F146 AromaticContact CZ-CZ 3.94Å; Y142-F146 WeakPolarHBondContact O-CD2 3.47Å; F143-F146 PolarHBondContact O-N 3.49Å; K144-F146 VanDerWaalsContact C-N 3.26Å; K144-F146 PolarHBondContact O-N 2.93Å; F146-W148 VanDerWaalsContact C-N 3.29Å; F146-W148 PolarHBondContact O-N 3.39Å; F146-W148 PolarHBondContact O-NE1 3.49Å
147	S	39.2	Very low	42	Very low	103 Å²	103	109 Å²	109	72%	0.72	54%	0.54	S	S	*	.			trans	-65.3	94.3	156.6	59.9	0	0	0	0	108.3	Q145 N149	Q145-S147 VanDerWaalsContact C-N 3.28Å; Q145-S147 PolarHBondContact O-N 2.81Å; S147-N149 PolarHBondContact O-N 2.81Å
148	W	43.2	Very low	42	Very low	134 Å²	134	108.8 Å²	108.8	51%	0.508	54%	0.54	S	S	.	.			trans	-54.6	100.7	173.3	-60.9	90	0	0	0	109.2	F146 Y165 L183	F146-W148 VanDerWaalsContact C-N 3.29Å; F146-W148 PolarHBondContact O-N 3.39Å; F146-W148 PolarHBondContact O-NE1 3.49Å; W148-Y165 HydrophobicContact CH2-CD1 4.41Å; W148-Y165 HydrophobicContact CH2-CD2 4.23Å; W148-Y165 HydrophobicContact CH2-CE2 4.42Å; W148-Y165 HydrophobicContact CH2-CG 4.22Å; W148-Y165 HydrophobicContact CZ3-CD1 4.06Å; W148-Y165 HydrophobicContact CZ3-CD2 4.09Å; W148-Y165 AromaticContact CZ3-CE1 3.82Å; W148-Y165 HydrophobicContact CZ3-CE1 3.82Å; W148-Y165 AromaticContact CZ3-CE2 3.85Å; W148-Y165 HydrophobicContact CZ3-CE2 3.85Å; W148-Y165 HydrophobicContact CZ3-CG 4.19Å; W148-Y165 AromaticContact CZ3-CZ 3.71Å; W148-L183 HydrophobicContact CH2-CD1 4.01Å; W148-L183 HydrophobicContact CZ3-CD1 4.02Å
149	N	36	Very low	41.7	Very low	135 Å²	135	108.4 Å²	108.4	72%	0.722	54%	0.544	S	S	*	.			trans	-69.3	137.7	-163.1	-160.4	7.5	0	0	0	110.5	S147 T151	S147-N149 PolarHBondContact O-N 2.81Å; N149-T151 PolarHBondContact O-N 3.08Å
150	K	35.5	Very low	41.3	Very low	202 Å²	202	118.4 Å²	118.4	88%	0.878	58%	0.579	S	S	*	*			trans	-89.1	27.5	-153.1	-153.2	177.5	-179.4	-179.6	0	113.8
151	T	31.9	Very low	41.2	Very low	90 Å²	90	120.4 Å²	120.4	55%	0.552	59%	0.593	S	S	*	*			trans	-119.5	146.5	-169.8	50.1	0	0	0	0	110.7	N149	N149-T151 PolarHBondContact O-N 3.08Å
152	D	36.8	Very low	41.3	Very low	155 Å²	155	122.3 Å²	122.3	83%	0.829	60%	0.603	S	S	*	*			trans	64.4	63.9	172.8	-46.4	-31.8	0	0	0	115.6
153	L	37	Very low	41.6	Very low	102 Å²	102	122.3 Å²	122.3	53%	0.534	61%	0.605	S	S	.	*			trans	-91	125.2	164	-82.9	169.9	0	0	0	110.8	K194	L153-K194 HydrophobicContact CD1-CD 4.11Å
154	P	34.8	Very low	42	Very low	86 Å²	86	125.2 Å²	125.2	56%	0.558	62%	0.624	S	S	*	*			trans	-74.7	179.1	176.6	32.3	-36.3	0	0	0	112.8	E158	P154-E158 WeakPolarHBondContact CB-OE2 3.44Å
155	S	40.5	Very low	42.7	Very low	85 Å²	85	124.6 Å²	124.6	59%	0.594	62%	0.619	S	S	*	*			trans	-65.7	157.1	-170.4	79.1	0	0	0	0	114.5	H157 E158	S155-H157 PolarHBondContact O-N 2.83Å; S155-E158 PolarHBondContact O-N 3.36Å
156	E	42.2	Very low	43.6	Very low	178 Å²	178	121.5 Å²	121.5	83%	0.832	61%	0.614	S	S	*	*	G	3₁₀ helix	trans	-58.5	-19.4	-170	-159	158.6	-133.9	0	0	115.1	S159	E156-S159 PolarHBondContact O-OG 3.08Å
157	H	41.3	Very low	44.6	Very low	181 Å²	181	119.8 Å²	119.8	84%	0.838	61%	0.611	S	S	*	*	G	3₁₀ helix	trans	-77	-16.2	179.8	-98.1	-22.6	0	0	0	115.8	S155 S159	S155-H157 PolarHBondContact O-N 2.83Å; H157-S159 VanDerWaalsContact C-N 3.32Å; H157-S159 PolarHBondContact O-N 3.16Å
158	E	40.5	Very low	45.8	Very low	105 Å²	105	122 Å²	122	49%	0.491	60%	0.603	S	S	.	*	G	3₁₀ helix	trans	-88.6	3	-176.9	-62.3	-165.3	116.5	0	0	114.4	P154 S155 R160 Q161	P154-E158 WeakPolarHBondContact CB-OE2 3.44Å; S155-E158 PolarHBondContact O-N 3.36Å; E158-R160 PolarHBondContact O-N 3.4Å; E158-Q161 PolarHBondContact O-N 2.79Å
159	S	40.2	Very low	46.8	Very low	72 Å²	72	117.5 Å²	117.5	50%	0.503	59%	0.588	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65	21.5	-173.2	51.5	0	0	0	0	117	E156 H157	E156-S159 PolarHBondContact O-OG 3.08Å; H157-S159 VanDerWaalsContact C-N 3.32Å; H157-S159 PolarHBondContact O-N 3.16Å
160	R	40.5	Very low	48.1	Very low	241 Å²	241	118.8 Å²	118.8	91%	0.909	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.4	-6.3	177.2	-72.1	-172.3	172.6	-163.2	-2.8	114.9	E158	E158-R160 PolarHBondContact O-N 3.4Å
161	Q	44.6	Very low	49	Very low	148 Å²	148	112.8 Å²	112.8	69%	0.692	56%	0.56	S	S	*	*			trans	-82.1	138	-177.4	-57	-161.5	37.3	0	0	111.8	E158	E158-Q161 PolarHBondContact O-N 2.79Å
162	L	50.5	Low	50.2	Low	86 Å²	86	111 Å²	111	45%	0.45	55%	0.551	S	S	.	*			trans	-82	114.5	167.5	-70.1	163.7	0	0	0	107.6	N164 V182	L162-N164 PolarHBondContact O-N 2.86Å; L162-V182 HydrophobicContact CB-CG1 4.31Å; L162-V182 HydrophobicContact CD2-CG1 4.03Å
163	E	56.1	Low	51.5	Low	62 Å²	62	113.8 Å²	113.8	29%	0.29	55%	0.55	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-81.5	114.9	173.1	-66.2	175.8	142.8	0	0	109.6	Y165 L183 R196	E163-Y165 HydrophobicContact CB-CD2 4.2Å; E163-Y165 HydrophobicContact CB-CE2 3.75Å; E163-Y165 HydrophobicContact CG-CE2 4.49Å; E163-L183 HydrophobicContact CB-CB 4.38Å; E163-L183 PolarHBondContact O-N 3.41Å; E163-R196 VanDerWaalsContact CD-NH1 3.27Å; E163-R196 IonicContact OE1-CZ 3.08Å; E163-R196 IonicContact OE1-NH1 3.03Å; E163-R196 PolarHBondContact OE1-NH1 3.26Å; E163-R196 IonicContact OE1-NH2 2.69Å; E163-R196 PolarHBondContact OE1-NH2 3.33Å; E163-R196 IonicContact OE2-CZ 2.88Å; E163-R196 IonicContact OE2-NE 3.3Å; E163-R196 PolarHBondContact OE2-NE 3.2Å; E163-R196 IonicContact OE2-NH1 2.75Å; E163-R196 PolarHBondContact OE2-NH1 3.33Å; E163-R196 IonicContact OE2-NH2 3.34Å; E163-R196 PolarHBondContact OE2-NH2 2.8Å
164	N	56.1	Low	52.7	Low	124 Å²	124	113.8 Å²	113.8	66%	0.663	55%	0.551	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-91.6	113.2	169.4	-71.7	-0.6	0	0	0	109.1	L162	L162-N164 PolarHBondContact O-N 2.86Å
165	Y	58.6	Low	53.7	Low	94 Å²	94	112.9 Å²	112.9	37%	0.369	54%	0.541	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	140.9	167.3	-74.9	-92.6	0	0	0	109.6	W148 E163 N180 V181 L183 R196	W148-Y165 HydrophobicContact CH2-CD1 4.41Å; W148-Y165 HydrophobicContact CH2-CD2 4.23Å; W148-Y165 HydrophobicContact CH2-CE2 4.42Å; W148-Y165 HydrophobicContact CH2-CG 4.22Å; W148-Y165 HydrophobicContact CZ3-CD1 4.06Å; W148-Y165 HydrophobicContact CZ3-CD2 4.09Å; W148-Y165 AromaticContact CZ3-CE1 3.82Å; W148-Y165 HydrophobicContact CZ3-CE1 3.82Å; W148-Y165 AromaticContact CZ3-CE2 3.85Å; W148-Y165 HydrophobicContact CZ3-CE2 3.85Å; W148-Y165 HydrophobicContact CZ3-CG 4.19Å; W148-Y165 AromaticContact CZ3-CZ 3.71Å; E163-Y165 HydrophobicContact CB-CD2 4.2Å; E163-Y165 HydrophobicContact CB-CE2 3.75Å; E163-Y165 HydrophobicContact CG-CE2 4.49Å; Y165-N180 CarbonylContact O-C 3.51Å; Y165-N180 WeakPolarHBondContact O-CA 3.49Å; Y165-V181 PolarHBondContact N-O 3.04Å; Y165-V181 PolarHBondContact O-N 3.14Å; Y165-L183 HydrophobicContact CD2-CD1 3.73Å; Y165-L183 HydrophobicContact CD2-CG 4.07Å; Y165-L183 HydrophobicContact CE2-CD1 3.53Å; Y165-L183 HydrophobicContact CE2-CG 4.31Å; Y165-R196 PolarHBondContact OH-NH1 2.7Å
166	S	64.3	Low	54.6	Low	84 Å²	84	111.1 Å²	111.1	59%	0.587	52%	0.524	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.4	136.3	173.9	-171.4	0	0	0	0	109.4	V179 N180	S166-V179 CarbonylContact C-O 3.55Å; S166-V179 WeakPolarHBondContact CA-O 3.4Å; S166-N180 VanDerWaalsContact CB-OD1 3.25Å; S166-N180 WeakPolarHBondContact CB-OD1 3.14Å; S166-N180 PolarHBondContact OG-OD1 2.83Å
167	T	67.5	Low	55.5	Low	49 Å²	49	103.1 Å²	103.1	30%	0.301	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	144.7	178.1	-177.1	0	0	0	0	111.3	D178 V179	T167-D178 CarbonylContact O-C 3.6Å; T167-D178 WeakPolarHBondContact O-CA 3.37Å; T167-V179 HydrophobicContact CG2-CB 3.89Å; T167-V179 PolarHBondContact N-O 3.03Å; T167-V179 PolarHBondContact O-N 2.85Å
168	R	64.8	Low	56.6	Low	149 Å²	149	95.2 Å²	95.2	56%	0.562	45%	0.451	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.6	116.4	-177.8	178.9	167.9	-74.1	167.5	-0.2	110.6	M176 I177 D178	R168-M176 HydrophobicContact CG-SD 4.43Å; R168-I177 CarbonylContact C-O 3.59Å; R168-I177 WeakPolarHBondContact CA-O 3.28Å; R168-D178 VanDerWaalsContact CB-OD1 3.31Å; R168-D178 WeakPolarHBondContact CB-OD1 3.33Å; R168-D178 VanDerWaalsContact CG-OD1 3.23Å; R168-D178 WeakPolarHBondContact CG-OD1 3.39Å; R168-D178 IonicContact CZ-OD1 2.74Å; R168-D178 IonicContact CZ-OD2 3.26Å; R168-D178 IonicContact NE-OD1 3.33Å; R168-D178 PolarHBondContact NE-OD1 2.88Å; R168-D178 IonicContact NE-OD2 2.74Å; R168-D178 IonicContact NH2-OD1 3.14Å; R168-D178 PolarHBondContact NH2-OD1 3.11Å; R168-D178 IonicContact NH2-OD2 2.71Å; R168-D178 PolarHBondContact NH2-OD2 2.94Å
169	I	64.2	Low	57.4	Low	39 Å²	39	90.3 Å²	90.3	20%	0.2	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	131.1	-174.5	-50.2	174	0	0	0	109.2	Y142 M176 I177 V179	Y142-I169 HydrophobicContact CD1-CD1 4.12Å; Y142-I169 HydrophobicContact CE1-CD1 3.41Å; Y142-I169 VanDerWaalsContact CE1-CD1 3.41Å; Y142-I169 HydrophobicContact CE1-CG1 4.31Å; Y142-I169 HydrophobicContact CE2-CD1 4.33Å; I169-M176 CarbonylContact O-C 3.58Å; I169-M176 WeakPolarHBondContact O-CA 3.31Å; I169-I177 PolarHBondContact N-O 3.46Å; I169-I177 PolarHBondContact O-N 3.48Å; I169-V179 HydrophobicContact CD1-CG2 3.79Å
170	R	61.6	Low	58.5	Low	163 Å²	163	89.4 Å²	89.4	62%	0.615	42%	0.417	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.1	109.2	175.1	-172.4	173.2	-168.7	158.2	7.2	110.6	S172 R173 M176	R170-S172 WeakPolarHBondContact CG-O 3.38Å; R170-S172 PolarHBondContact NE-O 3.46Å; R170-R173 PolarHBondContact NH2-O 2.89Å; R170-M176 HydrophobicContact CG-CG 4.4Å
171	L	54.2	Low	59.2	Low	76 Å²	76	78.7 Å²	78.7	40%	0.398	38%	0.379	S	S	.	.			trans	-76.8	-33.6	179.9	-73.5	-179	0	0	0	113.5	L134 N175 I177	L134-L171 HydrophobicContact CD1-CD1 4.21Å; L134-L171 HydrophobicContact CD1-CD2 3.86Å; L134-L171 HydrophobicContact CG-CD2 4.14Å; L171-N175 HydrophobicContact CB-CB 4.03Å; L171-N175 PolarHBondContact N-O 2.86Å; L171-I177 HydrophobicContact CD1-CD1 3.56Å; L171-I177 HydrophobicContact CD1-CG1 3.96Å; L171-I177 HydrophobicContact CG-CD1 4.09Å; L171-I177 HydrophobicContact CG-CG1 4.31Å
172	S	58.9	Low	59.9	Low	51 Å²	51	72.9 Å²	72.9	36%	0.357	35%	0.354	S	S	.	.	S	Bend	trans	-154.7	-175.6	-176.6	80.9	0	0	0	0	111.4	R170 N174 N175	R170-S172 WeakPolarHBondContact CG-O 3.38Å; R170-S172 PolarHBondContact NE-O 3.46Å; S172-N174 PolarHBondContact O-N 2.86Å; S172-N174 PolarHBondContact OG-N 3.29Å; S172-N175 PolarHBondContact N-O 2.61Å; S172-N175 PolarHBondContact OG-N 3.3Å
173	R	62.5	Low	59.9	Low	215 Å²	215	69.2 Å²	69.2	81%	0.811	33%	0.334	S	S	*	.	S	Bend	trans	-54.6	-34.2	168.2	-71.8	-172.9	177.1	-173.8	-0.3	111.7	R170 N208	R170-R173 PolarHBondContact NH2-O 2.89Å; R173-N208 PolarHBondContact O-ND2 3.44Å
174	N	62.4	Low	59.5	Low	101 Å²	101	70.7 Å²	70.7	54%	0.54	34%	0.34	S	S	.	.	S	Bend	trans	-115.2	-3.9	-169.3	-67.9	14.1	0	0	0	115.1	S172 N208	S172-N174 PolarHBondContact O-N 2.86Å; S172-N174 PolarHBondContact OG-N 3.29Å; N174-N208 WeakPolarHBondContact CA-ND2 3.35Å; N174-N208 VanDerWaalsContact O-CB 3.28Å; N174-N208 WeakPolarHBondContact O-CB 3.35Å; N174-N208 VanDerWaalsContact O-CG 3.29Å; N174-N208 PolarHBondContact O-N 3.4Å
175	N	55.9	Low	59.2	Low	68 Å²	68	69.1 Å²	69.1	36%	0.364	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	136	-176.1	-61.6	-1.5	0	0	0	111.5	L171 S172 Y206	L171-N175 HydrophobicContact CB-CB 4.03Å; L171-N175 PolarHBondContact N-O 2.86Å; S172-N175 PolarHBondContact N-O 2.61Å; S172-N175 PolarHBondContact OG-N 3.3Å; N175-Y206 WeakPolarHBondContact CA-O 3.35Å
176	M	60.1	Low	58.6	Low	48 Å²	48	65.9 Å²	65.9	24%	0.236	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	158.9	169.2	-59.6	-157.9	-56.2	0	0	110.9	R168 I169 R170 A205 Y206	R168-M176 HydrophobicContact CG-SD 4.43Å; I169-M176 CarbonylContact O-C 3.58Å; I169-M176 WeakPolarHBondContact O-CA 3.31Å; R170-M176 HydrophobicContact CG-CG 4.4Å; M176-A205 CarbonylContact O-C 3.57Å; M176-A205 WeakPolarHBondContact O-CA 3.43Å; M176-Y206 PolarHBondContact N-O 3.31Å; M176-Y206 PolarHBondContact O-N 2.74Å
177	I	60.2	Low	57.4	Low	9 Å²	9	72.4 Å²	72.4	5%	0.046	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	134.1	172.3	-72.1	-175.3	0	0	0	108.4	L134 R168 I169 L171 V179 I203 V204 A205	L134-I177 HydrophobicContact CD1-CD1 3.65Å; R168-I177 CarbonylContact C-O 3.59Å; R168-I177 WeakPolarHBondContact CA-O 3.28Å; I169-I177 PolarHBondContact N-O 3.46Å; I169-I177 PolarHBondContact O-N 3.48Å; L171-I177 HydrophobicContact CD1-CD1 3.56Å; L171-I177 HydrophobicContact CD1-CG1 3.96Å; L171-I177 HydrophobicContact CG-CD1 4.09Å; L171-I177 HydrophobicContact CG-CG1 4.31Å; I177-V179 HydrophobicContact CG2-CG2 3.63Å; I177-I203 HydrophobicContact CD1-CG2 4.39Å; I177-I203 HydrophobicContact CG2-CG2 3.5Å; I177-I203 VanDerWaalsContact CG2-CG2 3.5Å; I177-V204 CarbonylContact C-O 3.58Å; I177-V204 VanDerWaalsContact CA-O 3.31Å; I177-V204 WeakPolarHBondContact CA-O 3.4Å; I177-A205 HydrophobicContact CD1-CB 4.37Å; I177-A205 HydrophobicContact CG1-CB 3.77Å
178	D	64	Low	56.1	Low	16 Å²	16	76.6 Å²	76.6	9%	0.086	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	136.4	159.7	-69.3	-15.2	0	0	0	109.4	T167 R168 I203 V204 Y206	T167-D178 CarbonylContact O-C 3.6Å; T167-D178 WeakPolarHBondContact O-CA 3.37Å; R168-D178 VanDerWaalsContact CB-OD1 3.31Å; R168-D178 WeakPolarHBondContact CB-OD1 3.33Å; R168-D178 VanDerWaalsContact CG-OD1 3.23Å; R168-D178 WeakPolarHBondContact CG-OD1 3.39Å; R168-D178 IonicContact CZ-OD1 2.74Å; R168-D178 IonicContact CZ-OD2 3.26Å; R168-D178 IonicContact NE-OD1 3.33Å; R168-D178 PolarHBondContact NE-OD1 2.88Å; R168-D178 IonicContact NE-OD2 2.74Å; R168-D178 IonicContact NH2-OD1 3.14Å; R168-D178 PolarHBondContact NH2-OD1 3.11Å; R168-D178 IonicContact NH2-OD2 2.71Å; R168-D178 PolarHBondContact NH2-OD2 2.94Å; D178-I203 CarbonylContact O-C 3.52Å; D178-I203 WeakPolarHBondContact O-CA 3.46Å; D178-V204 PolarHBondContact N-O 3.47Å; D178-V204 PolarHBondContact O-N 2.95Å; D178-Y206 HydrophobicContact CB-CE2 4.15Å; D178-Y206 WeakPolarHBondContact OD2-CE2 3.49Å
179	V	58.4	Low	54.6	Low	2 Å²	2	72 Å²	72	1%	0.012	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	110.8	176.2	-176.8	0	0	0	0	108.6	F143 S166 T167 I169 I177 V181 V201 E202 I203	F143-V179 HydrophobicContact CZ-CG1 4.3Å; S166-V179 CarbonylContact C-O 3.55Å; S166-V179 WeakPolarHBondContact CA-O 3.4Å; T167-V179 HydrophobicContact CG2-CB 3.89Å; T167-V179 PolarHBondContact N-O 3.03Å; T167-V179 PolarHBondContact O-N 2.85Å; I169-V179 HydrophobicContact CD1-CG2 3.79Å; I177-V179 HydrophobicContact CG2-CG2 3.63Å; V179-V181 HydrophobicContact CG1-CG2 4.04Å; V179-V201 HydrophobicContact CG1-CG1 4.19Å; V179-E202 CarbonylContact C-O 3.55Å; V179-E202 WeakPolarHBondContact CA-O 3.46Å; V179-I203 HydrophobicContact CG1-CG1 4.25Å; V179-I203 HydrophobicContact CG2-CG1 4.38Å; V179-I203 HydrophobicContact CG2-CG2 4.36Å
180	N	63.8	Low	53.1	Low	52 Å²	52	77.2 Å²	77.2	28%	0.278	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	135.4	171.8	-65.2	-30.6	0	0	0	109.2	Y165 S166 V201 E202	Y165-N180 CarbonylContact O-C 3.51Å; Y165-N180 WeakPolarHBondContact O-CA 3.49Å; S166-N180 VanDerWaalsContact CB-OD1 3.25Å; S166-N180 WeakPolarHBondContact CB-OD1 3.14Å; S166-N180 PolarHBondContact OG-OD1 2.83Å; N180-V201 CarbonylContact O-C 3.52Å; N180-V201 WeakPolarHBondContact O-CA 3.18Å; N180-E202 HydrophobicContact CB-CB 4.19Å; N180-E202 PolarHBondContact N-O 3.04Å; N180-E202 PolarHBondContact ND2-OE2 3.5Å; N180-E202 PolarHBondContact O-N 3.09Å
181	V	55.1	Low	52	Low	16 Å²	16	75.9 Å²	75.9	10%	0.097	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	118.6	178.7	-178.9	0	0	0	0	108.8	F143 Y165 V179 L183 P198 V201	F143-V181 HydrophobicContact CE1-CG2 4.37Å; Y165-V181 PolarHBondContact N-O 3.04Å; Y165-V181 PolarHBondContact O-N 3.14Å; V179-V181 HydrophobicContact CG1-CG2 4.04Å; V181-L183 HydrophobicContact CG1-CD2 3.71Å; V181-L183 HydrophobicContact CG1-CG 4.41Å; V181-P198 HydrophobicContact CG1-CB 3.96Å; V181-V201 HydrophobicContact CG1-CG2 4.3Å; V181-V201 HydrophobicContact CG2-CG1 4.27Å; V181-V201 HydrophobicContact CG2-CG2 4.28Å
182	V	58.9	Low	51.2	Low	27 Å²	27	76.7 Å²	76.7	16%	0.164	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	114.5	174.4	-174.9	0	0	0	0	108	L162 R199 S200	L162-V182 HydrophobicContact CB-CG1 4.31Å; L162-V182 HydrophobicContact CD2-CG1 4.03Å; V182-R199 PolarHBondContact O-N 2.83Å; V182-S200 WeakPolarHBondContact CB-OG 3.36Å; V182-S200 WeakPolarHBondContact CG2-OG 3.16Å; V182-S200 PolarHBondContact N-O 2.89Å
183	L	50.3	Low	50.1	Low	8 Å²	8	81 Å²	81	4%	0.042	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	145.7	176.4	-59.3	-176.3	0	0	0	111.8	W148 E163 Y165 V181 R196 P198	W148-L183 HydrophobicContact CH2-CD1 4.01Å; W148-L183 HydrophobicContact CZ3-CD1 4.02Å; E163-L183 HydrophobicContact CB-CB 4.38Å; E163-L183 PolarHBondContact O-N 3.41Å; Y165-L183 HydrophobicContact CD2-CD1 3.73Å; Y165-L183 HydrophobicContact CD2-CG 4.07Å; Y165-L183 HydrophobicContact CE2-CD1 3.53Å; Y165-L183 HydrophobicContact CE2-CG 4.31Å; V181-L183 HydrophobicContact CG1-CD2 3.71Å; V181-L183 HydrophobicContact CG1-CG 4.41Å; L183-R196 HydrophobicContact CD1-CB 4.13Å; L183-P198 HydrophobicContact CD2-CB 4.1Å
184	F	48	Very low	49.1	Very low	93 Å²	93	78.3 Å²	78.3	41%	0.408	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	140.2	172.2	172.3	-108	0	0	0	109.9	P186 I197 R199	F184-P186 HydrophobicContact CE1-CB 3.96Å; F184-I197 PolarHBondContact N-O 2.62Å; F184-I197 PolarHBondContact O-N 3.26Å; F184-R199 HydrophobicContact CB-CB 3.88Å
185	Q	48.9	Very low	48.1	Very low	91 Å²	91	75.5 Å²	75.5	43%	0.425	39%	0.387	S	S	.	.			trans	-109.6	111.1	176.3	-172.8	170.7	-24.7	0	0	108.7	W187	Q185-W187 PolarHBondContact O-N 2.93Å
186	P	46	Very low	47.7	Very low	26 Å²	26	76.4 Å²	76.4	17%	0.169	39%	0.385	C	S	.	.			trans	-73	120.4	-174.8	29.4	-35.7	0	0	0	111.8	F184 L188 S189 I197	F184-P186 HydrophobicContact CE1-CB 3.96Å; P186-L188 PolarHBondContact O-N 3.35Å; P186-S189 PolarHBondContact O-N 3.49Å; P186-S189 PolarHBondContact O-OG 3.02Å; P186-I197 HydrophobicContact CG-CD1 3.8Å; P186-I197 HydrophobicContact CG-CG1 4.41Å
187	W	39.7	Very low	47.1	Very low	221 Å²	221	75.8 Å²	75.8	84%	0.837	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-7.1	175.1	73	-65.2	0	0	0	115.5	Q185	Q185-W187 PolarHBondContact O-N 2.93Å
188	L	39.5	Very low	46.5	Very low	137 Å²	137	77.5 Å²	77.5	72%	0.717	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.1	0.3	-174.3	-78.3	160.8	0	0	0	114.3	P186	P186-L188 PolarHBondContact O-N 3.35Å
189	S	34.2	Very low	46	Very low	52 Å²	52	82.8 Å²	82.8	36%	0.364	41%	0.413	S	S	.	.	S	Bend	trans	-75.1	134.4	171	55.5	0	0	0	0	111	P186 F193	P186-S189 PolarHBondContact O-N 3.49Å; P186-S189 PolarHBondContact O-OG 3.02Å; S189-F193 PolarHBondContact OG-O 3.02Å
190	Q	33	Very low	45.9	Very low	149 Å²	149	83.8 Å²	83.8	70%	0.696	42%	0.42	S	S	*	.			trans	-52.2	150.4	167.7	-71.7	-179.2	-12.7	0	0	111.2	S192 F193	Q190-S192 PolarHBondContact O-N 2.97Å; Q190-F193 PolarHBondContact O-N 2.86Å
191	P	36.9	Very low	45.4	Very low	135 Å²	135	82.1 Å²	82.1	88%	0.877	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-10.8	-171	22.5	-34.5	0	0	0	115.4
192	S	39	Very low	45.5	Very low	93 Å²	93	84.8 Å²	84.8	65%	0.65	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-16.9	174.2	48.8	0	0	0	0	115	Q190	Q190-S192 PolarHBondContact O-N 2.97Å
193	F	36.3	Very low	45.4	Very low	142 Å²	142	84 Å²	84	62%	0.623	42%	0.418	S	S	*	.			trans	-120.1	77.2	-169.1	-113.5	-89.7	0	0	0	114	S189 Q190 A195	S189-F193 PolarHBondContact OG-O 3.02Å; Q190-F193 PolarHBondContact O-N 2.86Å; F193-A195 VanDerWaalsContact C-N 3.26Å; F193-A195 PolarHBondContact O-N 3.07Å
194	K	41	Very low	45.8	Very low	159 Å²	159	84.4 Å²	84.4	69%	0.691	42%	0.421	S	S	*	.			trans	-75.6	70.6	171.6	-66.2	-169.5	179.3	-173.9	0	112.1	L153	L153-K194 HydrophobicContact CD1-CD 4.11Å
195	A	41.2	Very low	46	Very low	41 Å²	41	80.7 Å²	80.7	34%	0.339	41%	0.407	S	S	.	.			trans	-96.3	117.7	173	0	0	0	0	0	111.1	F193	F193-A195 VanDerWaalsContact C-N 3.26Å; F193-A195 PolarHBondContact O-N 3.07Å
196	R	46.7	Very low	46.6	Very low	87 Å²	87	78.4 Å²	78.4	33%	0.328	40%	0.395	S	S	.	.			trans	-77.9	129.3	165.7	-66.2	-179.4	177	-172.5	-11.7	108.4	E163 Y165 L183	E163-R196 VanDerWaalsContact CD-NH1 3.27Å; E163-R196 IonicContact OE1-CZ 3.08Å; E163-R196 IonicContact OE1-NH1 3.03Å; E163-R196 PolarHBondContact OE1-NH1 3.26Å; E163-R196 IonicContact OE1-NH2 2.69Å; E163-R196 PolarHBondContact OE1-NH2 3.33Å; E163-R196 IonicContact OE2-CZ 2.88Å; E163-R196 IonicContact OE2-NE 3.3Å; E163-R196 PolarHBondContact OE2-NE 3.2Å; E163-R196 IonicContact OE2-NH1 2.75Å; E163-R196 PolarHBondContact OE2-NH1 3.33Å; E163-R196 IonicContact OE2-NH2 3.34Å; E163-R196 PolarHBondContact OE2-NH2 2.8Å; Y165-R196 PolarHBondContact OH-NH1 2.7Å; L183-R196 HydrophobicContact CD1-CB 4.13Å
197	I	48.9	Very low	47.1	Very low	35 Å²	35	79 Å²	79	18%	0.179	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	126	-177.7	-50.9	-179.2	0	0	0	108.1	F29 F184 P186 R199	F29-I197 HydrophobicContact CE1-CG2 4.07Å; F29-I197 HydrophobicContact CE2-CD1 4.2Å; F29-I197 HydrophobicContact CZ-CD1 3.71Å; F29-I197 HydrophobicContact CZ-CG1 3.95Å; F29-I197 HydrophobicContact CZ-CG2 3.9Å; F184-I197 PolarHBondContact N-O 2.62Å; F184-I197 PolarHBondContact O-N 3.26Å; P186-I197 HydrophobicContact CG-CD1 3.8Å; P186-I197 HydrophobicContact CG-CG1 4.41Å; I197-R199 PolarHBondContact O-N 3.45Å
198	P	47.1	Very low	47.9	Very low	45 Å²	45	70.9 Å²	70.9	29%	0.292	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.9	127.7	170.2	23.8	-29.6	0	0	0	109.9	V181 L183 V201 L224	V181-P198 HydrophobicContact CG1-CB 3.96Å; L183-P198 HydrophobicContact CD2-CB 4.1Å; P198-V201 HydrophobicContact CB-CG2 4.25Å; P198-L224 HydrophobicContact CB-CD1 3.85Å; P198-L224 HydrophobicContact CG-CD1 3.72Å; P198-L224 VanDerWaalsContact O-CB 3.3Å; P198-L224 WeakPolarHBondContact O-CB 3.31Å; P198-L224 WeakPolarHBondContact O-CD1 3.48Å
199	R	52.8	Low	48.4	Very low	128 Å²	128	69 Å²	69	48%	0.483	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	-39	177	176	-175.9	174.6	-160.3	-3.2	111.2	V182 F184 I197 L224	V182-R199 PolarHBondContact O-N 2.83Å; F184-R199 HydrophobicContact CB-CB 3.88Å; I197-R199 PolarHBondContact O-N 3.45Å; R199-L224 PolarHBondContact O-N 2.84Å
200	S	56.7	Low	49	Very low	23 Å²	23	74.3 Å²	74.3	16%	0.161	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	149	171.8	51.6	0	0	0	0	110.3	V182 F222	V182-S200 WeakPolarHBondContact CB-OG 3.36Å; V182-S200 WeakPolarHBondContact CG2-OG 3.16Å; V182-S200 PolarHBondContact N-O 2.89Å; S200-F222 CarbonylContact C-O 3.58Å; S200-F222 WeakPolarHBondContact CA-O 3.5Å; S200-F222 WeakPolarHBondContact CB-O 3.21Å
201	V	52.9	Low	49.9	Very low	16 Å²	16	75.5 Å²	75.5	10%	0.097	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	132.4	174.7	178.9	0	0	0	0	106.8	F143 V179 N180 V181 P198 I203 S221 F222	F143-V201 HydrophobicContact CZ-CG1 4.29Å; V179-V201 HydrophobicContact CG1-CG1 4.19Å; N180-V201 CarbonylContact O-C 3.52Å; N180-V201 WeakPolarHBondContact O-CA 3.18Å; V181-V201 HydrophobicContact CG1-CG2 4.3Å; V181-V201 HydrophobicContact CG2-CG1 4.27Å; V181-V201 HydrophobicContact CG2-CG2 4.28Å; P198-V201 HydrophobicContact CB-CG2 4.25Å; V201-I203 HydrophobicContact CG1-CD1 4.28Å; V201-I203 HydrophobicContact CG1-CG1 4Å; V201-S221 CarbonylContact O-C 3.58Å; V201-F222 HydrophobicContact CB-CB 4.43Å; V201-F222 HydrophobicContact CB-CD2 4.23Å; V201-F222 HydrophobicContact CG1-CD2 4.4Å; V201-F222 PolarHBondContact N-O 2.94Å; V201-F222 PolarHBondContact O-N 2.63Å
202	E	57.2	Low	50.6	Low	72 Å²	72	72.2 Å²	72.2	34%	0.336	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	130	177.2	168.7	-171.4	-119	0	0	108.2	V179 N180 V204 V220	V179-E202 CarbonylContact C-O 3.55Å; V179-E202 WeakPolarHBondContact CA-O 3.46Å; N180-E202 HydrophobicContact CB-CB 4.19Å; N180-E202 PolarHBondContact N-O 3.04Å; N180-E202 PolarHBondContact ND2-OE2 3.5Å; N180-E202 PolarHBondContact O-N 3.09Å; E202-V204 HydrophobicContact CG-CG2 3.97Å; E202-V220 WeakPolarHBondContact CA-O 3.46Å
203	I	57	Low	51.3	Low	12 Å²	12	72.7 Å²	72.7	6%	0.062	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	109.8	-175.2	-55.5	-171.8	0	0	0	108.7	L139 I177 D178 V179 V201 N219 V220 F222	L139-I203 HydrophobicContact CD1-CD1 4.25Å; L139-I203 HydrophobicContact CD2-CD1 3.84Å; I177-I203 HydrophobicContact CD1-CG2 4.39Å; I177-I203 HydrophobicContact CG2-CG2 3.5Å; I177-I203 VanDerWaalsContact CG2-CG2 3.5Å; D178-I203 CarbonylContact O-C 3.52Å; D178-I203 WeakPolarHBondContact O-CA 3.46Å; V179-I203 HydrophobicContact CG1-CG1 4.25Å; V179-I203 HydrophobicContact CG2-CG1 4.38Å; V179-I203 HydrophobicContact CG2-CG2 4.36Å; V201-I203 HydrophobicContact CG1-CD1 4.28Å; V201-I203 HydrophobicContact CG1-CG1 4Å; I203-N219 CarbonylContact O-C 3.52Å; I203-N219 WeakPolarHBondContact O-CA 3.43Å; I203-N219 PolarHBondContact O-OD1 3.01Å; I203-V220 HydrophobicContact CB-CB 4.24Å; I203-V220 PolarHBondContact N-O 2.64Å; I203-V220 PolarHBondContact O-N 3.16Å; I203-F222 HydrophobicContact CD1-CE2 3.97Å; I203-F222 HydrophobicContact CG1-CE2 4.34Å
204	V	58	Low	52.2	Low	16 Å²	16	70.8 Å²	70.8	10%	0.097	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	113	-176.5	-167.9	0	0	0	0	109.7	I177 D178 E202 Y206 P216 M218	I177-V204 CarbonylContact C-O 3.58Å; I177-V204 VanDerWaalsContact CA-O 3.31Å; I177-V204 WeakPolarHBondContact CA-O 3.4Å; D178-V204 PolarHBondContact N-O 3.47Å; D178-V204 PolarHBondContact O-N 2.95Å; E202-V204 HydrophobicContact CG-CG2 3.97Å; V204-Y206 HydrophobicContact CB-CE2 4.15Å; V204-Y206 HydrophobicContact CG1-CE1 4.05Å; V204-Y206 HydrophobicContact CG1-CE2 3.89Å; V204-Y206 WeakPolarHBondContact CG1-OH 3.4Å; V204-Y206 WeakPolarHBondContact O-CE2 3.42Å; V204-P216 HydrophobicContact CG1-CB 3.56Å; V204-P216 HydrophobicContact CG1-CG 4.49Å; V204-M218 CarbonylContact C-O 3.53Å; V204-M218 WeakPolarHBondContact CA-O 3.47Å
205	A	53.2	Low	52.7	Low	14 Å²	14	68.4 Å²	68.4	12%	0.116	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	142.3	178	0	0	0	0	0	112.3	M176 I177 P216 V217 M218	M176-A205 CarbonylContact O-C 3.57Å; M176-A205 WeakPolarHBondContact O-CA 3.43Å; I177-A205 HydrophobicContact CD1-CB 4.37Å; I177-A205 HydrophobicContact CG1-CB 3.77Å; A205-P216 CarbonylContact O-C 3.59Å; A205-P216 WeakPolarHBondContact O-CA 3.39Å; A205-V217 PolarHBondContact O-N 2.83Å; A205-M218 HydrophobicContact CB-CB 3.9Å; A205-M218 PolarHBondContact N-O 2.82Å
206	Y	61.3	Low	53.5	Low	44 Å²	44	69.6 Å²	69.6	17%	0.173	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	141.9	179.8	-54.3	-88.2	0	0	0	111	N175 M176 D178 V204 P216	N175-Y206 WeakPolarHBondContact CA-O 3.35Å; M176-Y206 PolarHBondContact N-O 3.31Å; M176-Y206 PolarHBondContact O-N 2.74Å; D178-Y206 HydrophobicContact CB-CE2 4.15Å; D178-Y206 WeakPolarHBondContact OD2-CE2 3.49Å; V204-Y206 HydrophobicContact CB-CE2 4.15Å; V204-Y206 HydrophobicContact CG1-CE1 4.05Å; V204-Y206 HydrophobicContact CG1-CE2 3.89Å; V204-Y206 WeakPolarHBondContact CG1-OH 3.4Å; V204-Y206 WeakPolarHBondContact O-CE2 3.42Å; Y206-P216 HydrophobicContact CE1-CB 4.49Å
207	S	55.6	Low	53.9	Low	38 Å²	38	69.9 Å²	69.9	27%	0.266	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	129	167.2	173.5	0	0	0	0	109.3	S209	S207-S209 PolarHBondContact O-N 2.84Å; S207-S209 WeakPolarHBondContact OG-CB 3.42Å; S207-S209 PolarHBondContact OG-N 2.9Å; S207-S209 PolarHBondContact OG-OG 3.29Å
208	N	56.4	Low	53.8	Low	50 Å²	50	70.7 Å²	70.7	27%	0.267	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	9.1	174.3	-63.2	-16.8	0	0	0	113	R173 N174 K210	R173-N208 PolarHBondContact O-ND2 3.44Å; N174-N208 WeakPolarHBondContact CA-ND2 3.35Å; N174-N208 VanDerWaalsContact O-CB 3.28Å; N174-N208 WeakPolarHBondContact O-CB 3.35Å; N174-N208 VanDerWaalsContact O-CG 3.29Å; N174-N208 PolarHBondContact O-N 3.4Å; N208-K210 PolarHBondContact O-N 3.38Å
209	S	51.5	Low	54	Low	98 Å²	98	70.3 Å²	70.3	69%	0.685	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-12.8	176.2	52.5	0	0	0	0	113.6	S207	S207-S209 PolarHBondContact O-N 2.84Å; S207-S209 WeakPolarHBondContact OG-CB 3.42Å; S207-S209 PolarHBondContact OG-N 2.9Å; S207-S209 PolarHBondContact OG-OG 3.29Å
210	K	46.4	Very low	53.6	Low	164 Å²	164	65 Å²	65	71%	0.713	36%	0.363	S	S	*	.	S	Bend	trans	-151.5	160.2	150.8	-96.3	139.5	-176.9	-177.6	0	108.1	N208 D212	N208-K210 PolarHBondContact O-N 3.38Å; K210-D212 HydrophobicContact CB-CB 4.04Å; K210-D212 PolarHBondContact O-N 3.22Å
211	L	51.1	Low	52.9	Low	174 Å²	174	64.6 Å²	64.6	91%	0.911	36%	0.36	S	S	*	.	S	Bend	trans	-80	39.6	177.3	-145.4	82.5	0	0	0	112
212	D	51.7	Low	52.5	Low	66 Å²	66	65.2 Å²	65.2	35%	0.353	36%	0.362	S	S	.	.			trans	-106	93.3	-163.8	-178.8	12.8	0	0	0	110.7	K210 T214 N215	K210-D212 HydrophobicContact CB-CB 4.04Å; K210-D212 PolarHBondContact O-N 3.22Å; D212-T214 VanDerWaalsContact CG-OG1 3.26Å; D212-T214 PolarHBondContact O-N 3.07Å; D212-T214 VanDerWaalsContact O-N 3.12Å; D212-T214 WeakPolarHBondContact OD1-CB 3.19Å; D212-T214 WeakPolarHBondContact OD1-CG2 3.34Å; D212-T214 PolarHBondContact OD1-N 3.45Å; D212-T214 PolarHBondContact OD1-OG1 2.76Å; D212-T214 PolarHBondContact OD2-OG1 3.17Å; D212-N215 PolarHBondContact O-N 2.98Å; D212-N215 PolarHBondContact OD2-ND2 2.86Å
213	T	54.5	Low	51.6	Low	103 Å²	103	65.7 Å²	65.7	63%	0.632	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-3.4	179.7	49	0	0	0	0	113.9
214	T	55.2	Low	50.8	Low	102 Å²	102	67.4 Å²	67.4	63%	0.626	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-19.4	176.5	71.2	0	0	0	0	113.5	D212 P216	D212-T214 VanDerWaalsContact CG-OG1 3.26Å; D212-T214 PolarHBondContact O-N 3.07Å; D212-T214 VanDerWaalsContact O-N 3.12Å; D212-T214 WeakPolarHBondContact OD1-CB 3.19Å; D212-T214 WeakPolarHBondContact OD1-CG2 3.34Å; D212-T214 PolarHBondContact OD1-N 3.45Å; D212-T214 PolarHBondContact OD1-OG1 2.76Å; D212-T214 PolarHBondContact OD2-OG1 3.17Å; T214-P216 VanDerWaalsContact O-CD 3.27Å; T214-P216 WeakPolarHBondContact O-CD 3.43Å
215	N	51.9	Low	49.8	Very low	108 Å²	108	71.3 Å²	71.3	58%	0.578	39%	0.388	S	S	*	.			trans	-118.9	81	-171.8	-75.7	-65.3	0	0	0	112	D212	D212-N215 PolarHBondContact O-N 2.98Å; D212-N215 PolarHBondContact OD2-ND2 2.86Å
216	P	57.1	Low	48.7	Very low	67 Å²	67	77 Å²	77	44%	0.435	42%	0.416	S	S	.	.			trans	-66.9	137	173.3	29.6	-34.9	0	0	0	111.2	V204 A205 Y206 T214 M218	V204-P216 HydrophobicContact CG1-CB 3.56Å; V204-P216 HydrophobicContact CG1-CG 4.49Å; A205-P216 CarbonylContact O-C 3.59Å; A205-P216 WeakPolarHBondContact O-CA 3.39Å; Y206-P216 HydrophobicContact CE1-CB 4.49Å; T214-P216 VanDerWaalsContact O-CD 3.27Å; T214-P216 WeakPolarHBondContact O-CD 3.43Å; P216-M218 VanDerWaalsContact C-N 3.29Å
217	V	55.6	Low	47.1	Very low	92 Å²	92	81.7 Å²	81.7	56%	0.558	43%	0.434	S	S	*	.	S	Bend	trans	-75.5	-23.8	174.9	179.2	0	0	0	0	111.2	A205	A205-V217 PolarHBondContact O-N 2.83Å
218	M	47.5	Very low	45.7	Very low	52 Å²	52	88.3 Å²	88.3	26%	0.256	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.1	135.6	179.9	171.5	-177.6	-69.3	0	0	108.6	F38 T132 V204 A205 P216 V220	F38-M218 HydrophobicContact CD2-CG 4Å; F38-M218 HydrophobicContact CE1-CE 4.44Å; F38-M218 HydrophobicContact CE2-CB 3.89Å; F38-M218 HydrophobicContact CE2-CE 4.06Å; F38-M218 HydrophobicContact CE2-CG 3.66Å; F38-M218 HydrophobicContact CZ-CE 3.87Å; F38-M218 HydrophobicContact CZ-CG 4.43Å; T132-M218 HydrophobicContact CG2-CE 4.48Å; V204-M218 CarbonylContact C-O 3.53Å; V204-M218 WeakPolarHBondContact CA-O 3.47Å; A205-M218 HydrophobicContact CB-CB 3.9Å; A205-M218 PolarHBondContact N-O 2.82Å; P216-M218 VanDerWaalsContact C-N 3.29Å; M218-V220 HydrophobicContact CG-CG2 3.46Å; M218-V220 VanDerWaalsContact CG-CG2 3.46Å; M218-V220 HydrophobicContact SD-CG2 3.62Å
219	N	50.4	Low	44.4	Very low	38 Å²	38	91.5 Å²	91.5	20%	0.203	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	137.3	157.2	-167.7	15.5	0	0	0	108.4	D37 I203	D37-N219 HydrophobicContact CB-CB 4.25Å; D37-N219 PolarHBondContact OD2-ND2 2.93Å; I203-N219 CarbonylContact O-C 3.52Å; I203-N219 WeakPolarHBondContact O-CA 3.43Å; I203-N219 PolarHBondContact O-OD1 3.01Å
220	V	44.7	Very low	43.4	Very low	17 Å²	17	93.3 Å²	93.3	10%	0.103	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	86.5	173.9	-158.1	0	0	0	0	108.5	V35 E202 I203 M218 F222	V35-V220 HydrophobicContact CB-CG1 4.45Å; V35-V220 HydrophobicContact CG1-CG1 3.77Å; V35-V220 HydrophobicContact CG2-CG1 3.93Å; E202-V220 WeakPolarHBondContact CA-O 3.46Å; I203-V220 HydrophobicContact CB-CB 4.24Å; I203-V220 PolarHBondContact N-O 2.64Å; I203-V220 PolarHBondContact O-N 3.16Å; M218-V220 HydrophobicContact CG-CG2 3.46Å; M218-V220 VanDerWaalsContact CG-CG2 3.46Å; M218-V220 HydrophobicContact SD-CG2 3.62Å; V220-F222 HydrophobicContact CB-CE2 3.98Å; V220-F222 HydrophobicContact CB-CZ 4.32Å; V220-F222 HydrophobicContact CG1-CD2 4.15Å; V220-F222 HydrophobicContact CG1-CE1 3.96Å; V220-F222 HydrophobicContact CG1-CE2 3.44Å; V220-F222 VanDerWaalsContact CG1-CE2 3.44Å; V220-F222 HydrophobicContact CG1-CZ 3.35Å; V220-F222 WeakPolarHBondContact O-CD2 3.4Å
221	S	41.9	Very low	42.9	Very low	14 Å²	14	87.9 Å²	87.9	10%	0.098	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	131.5	168.3	50	0	0	0	0	109.9	V35 V36 D37 V201	V35-S221 WeakPolarHBondContact CA-O 3.06Å; V36-S221 WeakPolarHBondContact CB-OG 3.42Å; V36-S221 PolarHBondContact N-O 2.74Å; D37-S221 PolarHBondContact OD2-OG 2.78Å; V201-S221 CarbonylContact O-C 3.58Å
222	F	43.8	Very low	42.2	Very low	29 Å²	29	84 Å²	84	13%	0.127	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	136	178.7	-60	-88.1	0	0	0	109.8	F33 A34 V35 S200 V201 I203 V220	F33-F222 HydrophobicContact CB-CD1 4.45Å; F33-F222 AromaticContact CD1-CD1 3.87Å; F33-F222 HydrophobicContact CD1-CD1 3.87Å; F33-F222 AromaticContact CD1-CE1 3.97Å; F33-F222 HydrophobicContact CD1-CE1 3.97Å; A34-F222 WeakPolarHBondContact O-CA 3Å; V35-F222 HydrophobicContact CG2-CD1 3.77Å; V35-F222 HydrophobicContact CG2-CE1 3.45Å; V35-F222 VanDerWaalsContact CG2-CE1 3.45Å; V35-F222 HydrophobicContact CG2-CZ 4.25Å; S200-F222 CarbonylContact C-O 3.58Å; S200-F222 WeakPolarHBondContact CA-O 3.5Å; S200-F222 WeakPolarHBondContact CB-O 3.21Å; V201-F222 HydrophobicContact CB-CB 4.43Å; V201-F222 HydrophobicContact CB-CD2 4.23Å; V201-F222 HydrophobicContact CG1-CD2 4.4Å; V201-F222 PolarHBondContact N-O 2.94Å; V201-F222 PolarHBondContact O-N 2.63Å; I203-F222 HydrophobicContact CD1-CE2 3.97Å; I203-F222 HydrophobicContact CG1-CE2 4.34Å; V220-F222 HydrophobicContact CB-CE2 3.98Å; V220-F222 HydrophobicContact CB-CZ 4.32Å; V220-F222 HydrophobicContact CG1-CD2 4.15Å; V220-F222 HydrophobicContact CG1-CE1 3.96Å; V220-F222 HydrophobicContact CG1-CE2 3.44Å; V220-F222 VanDerWaalsContact CG1-CE2 3.44Å; V220-F222 HydrophobicContact CG1-CZ 3.35Å; V220-F222 WeakPolarHBondContact O-CD2 3.4Å
223	F	38.6	Very low	41.8	Very low	82 Å²	82	87 Å²	87	36%	0.36	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	119.5	173.9	-66.5	-89.1	0	0	0	111.5	V36 F225	V36-F223 HydrophobicContact CG2-CD2 4.14Å; V36-F223 HydrophobicContact CG2-CE2 3.89Å; F223-F225 HydrophobicContact CB-CD2 3.79Å; F223-F225 HydrophobicContact CB-CE2 3.32Å; F223-F225 HydrophobicContact CB-CZ 3.81Å; F223-F225 HydrophobicContact CD1-CZ 4.35Å; F223-F225 HydrophobicContact CG-CE2 4.09Å; F223-F225 HydrophobicContact CG-CZ 4.21Å; F223-F225 PolarHBondContact O-N 3.39Å
224	L	41.1	Very low	41.1	Very low	47 Å²	47	84.3 Å²	84.3	25%	0.246	44%	0.438	C	S	.	.			trans	-94.5	78.4	-179.6	-70.7	165.9	0	0	0	109.2	I31 P198 R199	I31-L224 HydrophobicContact CG2-CD2 3.67Å; P198-L224 HydrophobicContact CB-CD1 3.85Å; P198-L224 HydrophobicContact CG-CD1 3.72Å; P198-L224 VanDerWaalsContact O-CB 3.3Å; P198-L224 WeakPolarHBondContact O-CB 3.31Å; P198-L224 WeakPolarHBondContact O-CD1 3.48Å; R199-L224 PolarHBondContact O-N 2.84Å
225	F	36	Very low	40.5	Very low	99 Å²	99	81.1 Å²	81.1	43%	0.434	42%	0.42	S	S	.	.			trans	-78.8	139.9	175.4	-63.7	-74.7	0	0	0	111.9	F223 Y227	F223-F225 HydrophobicContact CB-CD2 3.79Å; F223-F225 HydrophobicContact CB-CE2 3.32Å; F223-F225 HydrophobicContact CB-CZ 3.81Å; F223-F225 HydrophobicContact CD1-CZ 4.35Å; F223-F225 HydrophobicContact CG-CE2 4.09Å; F223-F225 HydrophobicContact CG-CZ 4.21Å; F223-F225 PolarHBondContact O-N 3.39Å; F225-Y227 HydrophobicContact CB-CD1 4.02Å; F225-Y227 HydrophobicContact CB-CD2 4.48Å; F225-Y227 HydrophobicContact CB-CE1 3.38Å; F225-Y227 HydrophobicContact CB-CE2 3.89Å; F225-Y227 WeakPolarHBondContact CB-OH 3.39Å; F225-Y227 AromaticContact CD1-CE1 3.97Å; F225-Y227 HydrophobicContact CD1-CE1 3.97Å; F225-Y227 HydrophobicContact CD2-CE1 4.31Å; F225-Y227 AromaticContact CD2-CZ 4Å; F225-Y227 VanDerWaalsContact CD2-OH 3.23Å; F225-Y227 WeakPolarHBondContact CD2-OH 3.4Å; F225-Y227 AromaticContact CG-CE1 3.66Å; F225-Y227 HydrophobicContact CG-CE1 3.66Å; F225-Y227 AromaticContact CG-CZ 3.71Å; F225-Y227 WeakPolarHBondContact CG-OH 3.49Å
226	N	29.8	Very low	40.1	Very low	132 Å²	132	78 Å²	78	71%	0.706	40%	0.403	S	S	*	.			trans	-117.4	93.1	173.3	-173.2	-5.6	0	0	0	108.9
227	Y	28	Very low	39.6	Very low	144 Å²	144	76.9 Å²	76.9	57%	0.565	39%	0.392	S	S	*	.			trans	-115	107.6	171.7	5.8	-109	0	0	0	110.7	F225 L229	F225-Y227 HydrophobicContact CB-CD1 4.02Å; F225-Y227 HydrophobicContact CB-CD2 4.48Å; F225-Y227 HydrophobicContact CB-CE1 3.38Å; F225-Y227 HydrophobicContact CB-CE2 3.89Å; F225-Y227 WeakPolarHBondContact CB-OH 3.39Å; F225-Y227 AromaticContact CD1-CE1 3.97Å; F225-Y227 HydrophobicContact CD1-CE1 3.97Å; F225-Y227 HydrophobicContact CD2-CE1 4.31Å; F225-Y227 AromaticContact CD2-CZ 4Å; F225-Y227 VanDerWaalsContact CD2-OH 3.23Å; F225-Y227 WeakPolarHBondContact CD2-OH 3.4Å; F225-Y227 AromaticContact CG-CE1 3.66Å; F225-Y227 HydrophobicContact CG-CE1 3.66Å; F225-Y227 AromaticContact CG-CZ 3.71Å; F225-Y227 WeakPolarHBondContact CG-OH 3.49Å; Y227-L229 VanDerWaalsContact C-N 3.29Å; Y227-L229 PolarHBondContact O-N 2.93Å; Y227-L229 VanDerWaalsContact O-N 3.11Å
228	K	27.4	Very low	39.1	Very low	177 Å²	177	78.3 Å²	78.3	77%	0.77	39%	0.392	S	S	*	.			trans	-79.3	80.6	163.2	-172.6	-173	178.7	-176	0	108.6	I230	K228-I230 HydrophobicContact CD-CD1 4.39Å; K228-I230 HydrophobicContact CD-CG1 4.37Å; K228-I230 HydrophobicContact CG-CG1 4.2Å; K228-I230 PolarHBondContact O-N 3.16Å
229	L	28	Very low	38.8	Very low	117 Å²	117	82.6 Å²	82.6	61%	0.613	41%	0.41	S	S	*	.			trans	-71	91.9	174.2	-104.4	154	0	0	0	109.6	Y227 L231	Y227-L229 VanDerWaalsContact C-N 3.29Å; Y227-L229 PolarHBondContact O-N 2.93Å; Y227-L229 VanDerWaalsContact O-N 3.11Å; L229-L231 HydrophobicContact CD2-CD2 3.87Å; L229-L231 HydrophobicContact CD2-CG 4.16Å; L229-L231 PolarHBondContact O-N 3.01Å
230	I	31.3	Very low	38.9	Very low	135 Å²	135	85.8 Å²	85.8	69%	0.692	43%	0.426	S	S	*	.			trans	-75.6	82.1	162.7	-53.2	177.9	0	0	0	106	K228	K228-I230 HydrophobicContact CD-CD1 4.39Å; K228-I230 HydrophobicContact CD-CG1 4.37Å; K228-I230 HydrophobicContact CG-CG1 4.2Å; K228-I230 PolarHBondContact O-N 3.16Å
231	L	35.3	Very low	39.7	Very low	51 Å²	51	86.6 Å²	86.6	27%	0.267	43%	0.43	S	S	.	.			trans	-69.4	123.2	161.2	-64.3	167.3	0	0	0	106.5	L229 I236 F239	L229-L231 HydrophobicContact CD2-CD2 3.87Å; L229-L231 HydrophobicContact CD2-CG 4.16Å; L229-L231 PolarHBondContact O-N 3.01Å; L231-I236 HydrophobicContact CB-CG1 3.87Å; L231-F239 HydrophobicContact CD2-CD2 3.91Å; L231-F239 HydrophobicContact CD2-CE2 4Å
232	D	36.8	Very low	40.7	Very low	93 Å²	93	86.4 Å²	86.4	50%	0.497	43%	0.428	S	S	.	.			trans	-73.6	168.5	164.7	54.5	21.2	0	0	0	110.3	A234 S235 I236	D232-A234 PolarHBondContact O-N 2.78Å; D232-S235 WeakPolarHBondContact O-CA 3.47Å; D232-S235 WeakPolarHBondContact O-CB 3.3Å; D232-S235 PolarHBondContact O-N 3.07Å; D232-S235 WeakPolarHBondContact OD1-CB 3.28Å; D232-S235 PolarHBondContact OD1-N 2.83Å; D232-S235 PolarHBondContact OD1-OG 3.29Å; D232-I236 WeakPolarHBondContact O-CG1 3.27Å; D232-I236 PolarHBondContact O-N 2.92Å
233	D	43.3	Very low	41.8	Very low	129 Å²	129	89.2 Å²	89.2	69%	0.69	45%	0.449	S	S	*	.	H	α-helix	trans	-55.2	-39.4	-175.9	-42.9	-23.6	0	0	0	111.1	S235 I236 E237	D233-S235 PolarHBondContact O-N 3.49Å; D233-I236 PolarHBondContact O-N 3.29Å; D233-E237 WeakPolarHBondContact O-CB 3.35Å; D233-E237 WeakPolarHBondContact O-CG 3.31Å; D233-E237 PolarHBondContact O-N 2.9Å
234	A	40	Very low	43.5	Very low	46 Å²	46	89.6 Å²	89.6	38%	0.38	45%	0.452	S	S	.	.	H	α-helix	trans	-63.4	-37.8	175.6	0	0	0	0	0	113	D232 H238 M389	D232-A234 PolarHBondContact O-N 2.78Å; A234-H238 WeakPolarHBondContact O-CB 3.34Å; A234-H238 PolarHBondContact O-N 3.43Å; A234-M389 HydrophobicContact CB-CE 4.42Å
235	S	42.2	Very low	45	Very low	35 Å²	35	87.5 Å²	87.5	25%	0.245	44%	0.442	C	S	.	.	H	α-helix	trans	-73.9	-31.9	174.6	-56.1	0	0	0	0	112.5	D232 D233 H238 F239	D232-S235 WeakPolarHBondContact O-CA 3.47Å; D232-S235 WeakPolarHBondContact O-CB 3.3Å; D232-S235 PolarHBondContact O-N 3.07Å; D232-S235 WeakPolarHBondContact OD1-CB 3.28Å; D232-S235 PolarHBondContact OD1-N 2.83Å; D232-S235 PolarHBondContact OD1-OG 3.29Å; D233-S235 PolarHBondContact O-N 3.49Å; S235-H238 PolarHBondContact O-N 2.9Å; S235-F239 WeakPolarHBondContact O-CD2 3.48Å; S235-F239 PolarHBondContact O-N 3.22Å
236	I	43.1	Very low	46.7	Very low	42 Å²	42	85.1 Å²	85.1	22%	0.215	44%	0.435	C	S	.	.	H	α-helix	trans	-65.1	-48	172	-63.1	171.3	0	0	0	109.5	L231 D232 D233 H238 F239 L240	L231-I236 HydrophobicContact CB-CG1 3.87Å; D232-I236 WeakPolarHBondContact O-CG1 3.27Å; D232-I236 PolarHBondContact O-N 2.92Å; D233-I236 PolarHBondContact O-N 3.29Å; I236-H238 PolarHBondContact O-N 3.11Å; I236-F239 PolarHBondContact O-N 2.89Å; I236-L240 HydrophobicContact CG2-CD1 3.77Å; I236-L240 HydrophobicContact CG2-CG 4.43Å; I236-L240 PolarHBondContact O-N 3.16Å; I236-L240 VanDerWaalsContact O-N 3.15Å
237	E	47	Very low	48.7	Very low	44 Å²	44	81 Å²	81	21%	0.206	41%	0.41	C	S	.	.	H	α-helix	trans	-60.6	-26.9	172	-69	-165.9	121.3	0	0	112.6	D233 L241 K382 M389	D233-E237 WeakPolarHBondContact O-CB 3.35Å; D233-E237 WeakPolarHBondContact O-CG 3.31Å; D233-E237 PolarHBondContact O-N 2.9Å; E237-L241 WeakPolarHBondContact O-CD1 3.48Å; E237-L241 WeakPolarHBondContact O-CG 3.46Å; E237-K382 WeakPolarHBondContact OE1-CB 3.35Å; E237-K382 WeakPolarHBondContact OE1-CG 3.18Å; E237-K382 IonicContact OE1-NZ 3.54Å; E237-K382 PolarHBondContact OE1-NZ 2.92Å; E237-K382 IonicContact OE2-NZ 2.64Å; E237-K382 PolarHBondContact OE2-NZ 3.22Å; E237-M389 HydrophobicContact CB-CE 4.33Å; E237-M389 WeakPolarHBondContact OE2-CE 3.39Å
238	H	44	Very low	50.6	Low	122 Å²	122	74.3 Å²	74.3	57%	0.565	38%	0.384	S	S	*	.	H	α-helix	trans	-79.1	-40.8	177.1	-167.1	68.4	0	0	0	113.9	A234 S235 I236	A234-H238 WeakPolarHBondContact O-CB 3.34Å; A234-H238 PolarHBondContact O-N 3.43Å; S235-H238 PolarHBondContact O-N 2.9Å; I236-H238 PolarHBondContact O-N 3.11Å
239	F	41.8	Very low	52.5	Low	141 Å²	141	68 Å²	68	62%	0.618	36%	0.363	S	S	*	.	H	α-helix	trans	-96.1	-20.8	-170.4	-69.7	-62.4	0	0	0	115.8	L231 S235 I236	L231-F239 HydrophobicContact CD2-CD2 3.91Å; L231-F239 HydrophobicContact CD2-CE2 4Å; S235-F239 WeakPolarHBondContact O-CD2 3.48Å; S235-F239 PolarHBondContact O-N 3.22Å; I236-F239 PolarHBondContact O-N 2.89Å
240	L	52.3	Low	54.3	Low	105 Å²	105	64.9 Å²	64.9	55%	0.55	36%	0.359	S	S	.	.	S	Bend	trans	-94.9	-11.7	180	-63	-176	0	0	0	114.1	I236	I236-L240 HydrophobicContact CG2-CD1 3.77Å; I236-L240 HydrophobicContact CG2-CG 4.43Å; I236-L240 PolarHBondContact O-N 3.16Å; I236-L240 VanDerWaalsContact O-N 3.15Å
241	L	61.4	Low	56.2	Low	34 Å²	34	59 Å²	59	18%	0.178	33%	0.328	C	S	.	.	S	Bend	trans	-79	151.1	176.7	-64.4	-174.5	0	0	0	111.6	E237 V380 K382 R383	E237-L241 WeakPolarHBondContact O-CD1 3.48Å; E237-L241 WeakPolarHBondContact O-CG 3.46Å; L241-V380 HydrophobicContact CB-CG1 4.23Å; L241-V380 HydrophobicContact CD1-CG1 4.23Å; L241-V380 HydrophobicContact CD2-CG1 4Å; L241-V380 WeakPolarHBondContact CD2-O 3.44Å; L241-V380 HydrophobicContact CG-CG1 4.38Å; L241-K382 WeakPolarHBondContact CD1-O 3.5Å; L241-R383 HydrophobicContact CD1-CG 3.9Å
242	P	64	Low	57.8	Low	10 Å²	10	61.3 Å²	61.3	7%	0.065	34%	0.336	C	S	.	.	P	Polyproline II helix	trans	-51.3	148.2	167.8	-25	34.1	0	0	0	111.2	Y82 C248 V380 R383	Y82-P242 HydrophobicContact CD2-CG 4.2Å; Y82-P242 HydrophobicContact CG-CG 4.09Å; P242-C248 WeakPolarHBondContact CG-SG 3.38Å; P242-V380 HydrophobicContact CG-CG1 4.34Å; P242-R383 PolarHBondContact O-NH2 3.26Å
243	P	66.8	Low	59.3	Low	89 Å²	89	61.4 Å²	61.4	58%	0.578	34%	0.337	S	S	*	.	P	Polyproline II helix	trans	-60.5	161.8	173.5	-22.7	33.4	0	0	0	113	G245 V246 R383	P243-G245 PolarHBondContact O-N 3.16Å; P243-V246 HydrophobicContact CB-CG2 3.89Å; P243-V246 HydrophobicContact CG-CG2 4.21Å; P243-V246 PolarHBondContact O-N 2.9Å; P243-R383 PolarHBondContact O-NH2 3.42Å
244	E	73.9	Confident	60.5	Low	90 Å²	90	57.9 Å²	57.9	42%	0.421	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	135	172.6	-77	-165.5	-169.6	0	0	112	V246 W409 R432 Y434	E244-V246 PolarHBondContact O-N 2.9Å; E244-W409 HydrophobicContact CG-CZ2 4.35Å; E244-R432 IonicContact OE1-NH1 2.78Å; E244-R432 PolarHBondContact OE1-NH1 3.27Å; E244-R432 IonicContact OE2-CZ 2.69Å; E244-R432 IonicContact OE2-NH1 3.14Å; E244-R432 PolarHBondContact OE2-NH1 2.79Å; E244-Y434 HydrophobicContact CB-CE1 4.32Å; E244-Y434 PolarHBondContact OE2-OH 3.35Å
245	G	72.6	Confident	62.1	Low	3 Å²	3	60.9 Å²	60.9	3%	0.031	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.7	11.1	177.3	0	0	0	0	0	115.8	P243 V405 E407 Y434 S436	P243-G245 PolarHBondContact O-N 3.16Å; G245-V405 WeakPolarHBondContact O-CB 3.39Å; G245-V405 WeakPolarHBondContact O-CG2 3.44Å; G245-E407 PolarHBondContact N-OE2 2.66Å; G245-Y434 VanDerWaalsContact CA-CG 3.48Å; G245-S436 WeakPolarHBondContact O-CB 3.12Å; G245-S436 PolarHBondContact O-OG 2.71Å
246	V	70.8	Confident	64	Low	48 Å²	48	61.3 Å²	61.3	29%	0.291	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-98.4	129.7	170.5	179.9	0	0	0	0	109.6	C107 P243 E244	C107-V246 HydrophobicContact CB-CG1 4.26Å; P243-V246 HydrophobicContact CB-CG2 3.89Å; P243-V246 HydrophobicContact CG-CG2 4.21Å; P243-V246 PolarHBondContact O-N 2.9Å; E244-V246 PolarHBondContact O-N 2.9Å
247	Y	73	Confident	65.9	Low	47 Å²	47	60.2 Å²	60.2	18%	0.184	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-101.1	133.1	170.9	176.6	-86.9	0	0	0	110.2	L251 V394 K396	Y247-L251 HydrophobicContact CD2-CD2 4.39Å; Y247-L251 HydrophobicContact CE2-CD2 4.07Å; Y247-V394 HydrophobicContact CD2-CG1 4.11Å; Y247-K396 HydrophobicContact CD1-CB 4.04Å; Y247-K396 HydrophobicContact CD1-CD 3.55Å; Y247-K396 HydrophobicContact CD1-CG 4.42Å; Y247-K396 HydrophobicContact CD2-CB 3.68Å; Y247-K396 HydrophobicContact CE1-CB 4.27Å; Y247-K396 HydrophobicContact CE1-CD 3.95Å; Y247-K396 HydrophobicContact CE2-CB 3.95Å; Y247-K396 HydrophobicContact CG-CB 3.73Å; Y247-K396 HydrophobicContact CG-CD 3.95Å; Y247-K396 HydrophobicContact CG-CG 4.38Å
248	C	68.1	Low	67.5	Low	2 Å²	2	63.1 Å²	63.1	1%	0.014	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	129.2	174.9	-62	0	0	0	0	111.8	Y82 C107 P242 L251	Y82-C248 HydrophobicContact CD1-CB 3.62Å; Y82-C248 HydrophobicContact CE1-CB 4.13Å; Y82-C248 HydrophobicContact CG-CB 4.5Å; C107-C248 HydrophobicContact CB-CB 3.74Å; C107-C248 WeakPolarHBondContact CB-SG 3.49Å; C107-C248 CarbonylContact O-C 3.15Å; C107-C248 WeakPolarHBondContact SG-CB 3.42Å; C107-C248 CovalentContact SG-SG 2.03Å; C107-C248 PolarHBondContact SG-SG 2.73Å; P242-C248 WeakPolarHBondContact CG-SG 3.38Å; C248-L251 WeakPolarHBondContact O-CB 3.44Å; C248-L251 PolarHBondContact O-N 3.45Å
249	S	67.1	Low	69.2	Low	45 Å²	45	57.6 Å²	57.6	32%	0.315	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	143.1	168.1	-40.9	0	0	0	0	110.2	C107 S108 R109 L251	C107-S249 WeakPolarHBondContact O-CA 3.46Å; C107-S249 WeakPolarHBondContact O-CB 3.29Å; C107-S249 PolarHBondContact O-N 3.08Å; C107-S249 PolarHBondContact O-OG 2.88Å; S108-S249 CarbonylContact C-O 3.53Å; S108-S249 VanDerWaalsContact CA-O 3.3Å; S108-S249 WeakPolarHBondContact CA-O 3.38Å; R109-S249 PolarHBondContact N-O 3.14Å; R109-S249 VanDerWaalsContact N-O 3.09Å; S249-L251 PolarHBondContact O-N 3.49Å; S249-L251 VanDerWaalsContact O-N 3.17Å
250	G	66.1	Low	70.9	Confident	52 Å²	52	58.3 Å²	58.3	54%	0.536	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.7	-4.6	-177.4	0	0	0	0	0	115.3	R109 K252	R109-G250 WeakPolarHBondContact CD-O 3.22Å; R109-G250 PolarHBondContact NH1-O 3.26Å; G250-K252 PolarHBondContact O-N 2.89Å
251	L	69.7	Low	72	Confident	10 Å²	10	54.2 Å²	54.2	5%	0.052	30%	0.299	C	S	.	.			trans	-46.8	129.2	163.5	-177.8	71.7	0	0	0	108.9	Y82 Y247 C248 S249 Y379 V380 V394	Y82-L251 HydrophobicContact CE1-CD1 3.96Å; Y82-L251 WeakPolarHBondContact OH-CD1 3.42Å; Y247-L251 HydrophobicContact CD2-CD2 4.39Å; Y247-L251 HydrophobicContact CE2-CD2 4.07Å; C248-L251 WeakPolarHBondContact O-CB 3.44Å; C248-L251 PolarHBondContact O-N 3.45Å; S249-L251 PolarHBondContact O-N 3.49Å; S249-L251 VanDerWaalsContact O-N 3.17Å; L251-Y379 WeakPolarHBondContact CD1-O 3.38Å; L251-V380 HydrophobicContact CD1-CG2 4.14Å; L251-V380 HydrophobicContact CD2-CG2 4.35Å; L251-V394 HydrophobicContact CD2-CB 4.34Å
252	K	69	Low	73	Confident	100 Å²	100	59.2 Å²	59.2	44%	0.435	32%	0.321	S	S	.	.			trans	-72	136.5	-171.8	-156.4	175.8	157.8	-142.2	0	110.2	G250 D254 G378	G250-K252 PolarHBondContact O-N 2.89Å; K252-D254 WeakPolarHBondContact CB-OD2 3.3Å; K252-D254 WeakPolarHBondContact CD-OD1 3.34Å; K252-D254 VanDerWaalsContact CE-OD1 3.28Å; K252-D254 WeakPolarHBondContact CE-OD1 3.25Å; K252-D254 IonicContact NZ-OD1 2.64Å; K252-D254 PolarHBondContact NZ-OD1 2.93Å; K252-D254 PolarHBondContact O-N 2.94Å; K252-G378 WeakPolarHBondContact O-CA 3.41Å
253	N	69	Low	74	Confident	95 Å²	95	59.7 Å²	59.7	51%	0.508	32%	0.323	S	S	.	.			trans	-70.4	88.8	157.4	-67.3	4.7	0	0	0	107.8
254	D	68.5	Low	74.8	Confident	55 Å²	55	56 Å²	56	29%	0.294	30%	0.298	S	S	.	.			trans	-86.7	167.7	169.7	-83.5	-52.6	0	0	0	111.1	K252 F256 W393	K252-D254 WeakPolarHBondContact CB-OD2 3.3Å; K252-D254 WeakPolarHBondContact CD-OD1 3.34Å; K252-D254 VanDerWaalsContact CE-OD1 3.28Å; K252-D254 WeakPolarHBondContact CE-OD1 3.25Å; K252-D254 IonicContact NZ-OD1 2.64Å; K252-D254 PolarHBondContact NZ-OD1 2.93Å; K252-D254 PolarHBondContact O-N 2.94Å; D254-F256 PolarHBondContact O-N 3.36Å; D254-W393 HydrophobicContact CB-CH2 3.73Å; D254-W393 HydrophobicContact CB-CZ3 3.84Å
255	S	74.6	Confident	75.3	Confident	110 Å²	110	54.4 Å²	54.4	77%	0.769	29%	0.291	S	S	*	.			trans	-70	98.4	-178	55.8	0	0	0	0	111.4	W393	S255-W393 VanDerWaalsContact O-CH2 3.22Å; S255-W393 WeakPolarHBondContact O-CH2 3.45Å
256	F	82.1	Confident	75.9	Confident	44 Å²	44	54.4 Å²	54.4	19%	0.193	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-55.9	142.6	-179.7	-167.7	-101	0	0	0	112.5	D254 E258 T366 L370 V372 F377 W393 V408 F410	D254-F256 PolarHBondContact O-N 3.36Å; F256-E258 PolarHBondContact O-N 2.96Å; F256-T366 HydrophobicContact CD1-CG2 4.16Å; F256-T366 HydrophobicContact CE1-CG2 3.95Å; F256-L370 HydrophobicContact CE1-CD1 3.81Å; F256-L370 HydrophobicContact CZ-CD1 3.85Å; F256-V372 HydrophobicContact CD1-CG1 3.57Å; F256-V372 HydrophobicContact CE1-CG1 3.42Å; F256-V372 VanDerWaalsContact CE1-CG1 3.42Å; F256-V372 HydrophobicContact CG-CG1 4.33Å; F256-V372 HydrophobicContact CZ-CG1 4.08Å; F256-F377 HydrophobicContact CD2-CB 3.31Å; F256-F377 HydrophobicContact CD2-CD1 4.48Å; F256-F377 HydrophobicContact CD2-CD2 4.05Å; F256-F377 AromaticContact CD2-CG 3.72Å; F256-F377 HydrophobicContact CD2-CG 3.72Å; F256-F377 HydrophobicContact CE2-CB 3.52Å; F256-F377 AromaticContact CE2-CD1 3.81Å; F256-F377 HydrophobicContact CE2-CD1 3.81Å; F256-F377 AromaticContact CE2-CD2 3.8Å; F256-F377 HydrophobicContact CE2-CD2 3.8Å; F256-F377 HydrophobicContact CE2-CE1 4.49Å; F256-F377 HydrophobicContact CE2-CE2 4.47Å; F256-F377 AromaticContact CE2-CG 3.42Å; F256-F377 HydrophobicContact CE2-CG 3.42Å; F256-F377 VanDerWaalsContact CE2-CG 3.42Å; F256-F377 HydrophobicContact CG-CB 4.29Å; F256-F377 HydrophobicContact CZ-CD1 4.49Å; F256-F377 HydrophobicContact CZ-CD2 4.17Å; F256-F377 HydrophobicContact CZ-CE2 4.47Å; F256-F377 HydrophobicContact CZ-CG 4.19Å; F256-W393 HydrophobicContact CB-CZ3 4.36Å; F256-W393 HydrophobicContact CD2-CB 4.19Å; F256-W393 AromaticContact CD2-CD2 3.81Å; F256-W393 HydrophobicContact CD2-CD2 3.81Å; F256-W393 AromaticContact CD2-CE3 3.59Å; F256-W393 HydrophobicContact CD2-CE3 3.59Å; F256-W393 HydrophobicContact CD2-CG 4.09Å; F256-W393 HydrophobicContact CD2-CZ3 4.23Å; F256-W393 HydrophobicContact CE2-CB 3.73Å; F256-W393 HydrophobicContact CE2-CD2 4.2Å; F256-W393 HydrophobicContact CE2-CE3 4.32Å; F256-W393 AromaticContact CE2-CG 3.97Å; F256-W393 HydrophobicContact CE2-CG 3.97Å; F256-V408 HydrophobicContact CZ-CB 4.46Å; F256-V408 HydrophobicContact CZ-CG1 4.43Å; F256-V408 HydrophobicContact CZ-CG2 4.42Å; F256-F410 HydrophobicContact CE1-CE2 4.11Å; F256-F410 AromaticContact CE1-CZ 3.66Å; F256-F410 HydrophobicContact CE1-CZ 3.66Å; F256-F410 AromaticContact CE2-CE2 3.8Å; F256-F410 HydrophobicContact CE2-CE2 3.8Å; F256-F410 HydrophobicContact CE2-CZ 4.22Å; F256-F410 AromaticContact CZ-CE2 3.5Å; F256-F410 HydrophobicContact CZ-CE2 3.5Å; F256-F410 VanDerWaalsContact CZ-CE2 3.5Å; F256-F410 AromaticContact CZ-CZ 3.47Å; F256-F410 HydrophobicContact CZ-CZ 3.47Å; F256-F410 VanDerWaalsContact CZ-CZ 3.47Å
257	P	81.4	Confident	76.6	Confident	18 Å²	18	52.7 Å²	52.7	12%	0.117	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-67.5	125.9	-177.5	-19.3	33.1	0	0	0	112.3	W393 F410 V426	P257-W393 HydrophobicContact CG-CZ2 4.05Å; P257-F410 HydrophobicContact CB-CE1 4.23Å; P257-F410 HydrophobicContact CB-CE2 4.4Å; P257-F410 HydrophobicContact CB-CZ 4.16Å; P257-F410 HydrophobicContact CG-CD2 4.06Å; P257-F410 HydrophobicContact CG-CE2 3.91Å; P257-F410 HydrophobicContact CG-CG 4.44Å; P257-F410 HydrophobicContact CG-CZ 4.16Å; P257-V426 HydrophobicContact CB-CB 4.24Å; P257-V426 HydrophobicContact CB-CG1 3.69Å; P257-V426 HydrophobicContact CG-CG1 4.27Å
258	E	80.8	Confident	77.4	Confident	106 Å²	106	50.5 Å²	50.5	50%	0.495	27%	0.272	S	S	.	.	P	Polyproline II helix	trans	-82.4	128.5	174.1	-173.7	-178.2	-141.4	0	0	111.2	F256 K260	F256-E258 PolarHBondContact O-N 2.96Å; E258-K260 HydrophobicContact CB-CG 4.46Å; E258-K260 HydrophobicContact CG-CG 4.2Å; E258-K260 PolarHBondContact O-N 3.48Å; E258-K260 WeakPolarHBondContact OE2-CE 3.38Å
259	V	80.7	Confident	78.2	Confident	5 Å²	5	54.4 Å²	54.4	3%	0.03	29%	0.29	C	S	.	.			trans	-80.8	103.8	173.2	179.4	0	0	0	0	108.7	F261 A365 T366 L369 F410 P428	V259-F261 HydrophobicContact CG1-CD2 3.65Å; V259-F261 HydrophobicContact CG1-CE2 4.21Å; V259-F261 PolarHBondContact O-N 3.3Å; V259-A365 HydrophobicContact CB-CB 4.36Å; V259-A365 HydrophobicContact CG1-CB 4.06Å; V259-A365 WeakPolarHBondContact O-CB 3.47Å; V259-T366 HydrophobicContact CG2-CG2 4.39Å; V259-T366 PolarHBondContact N-OG1 3.29Å; V259-L369 HydrophobicContact CG1-CD1 4.31Å; V259-F410 HydrophobicContact CG2-CE1 4.46Å; V259-P428 HydrophobicContact CG2-CG 4.47Å
260	K	77.3	Confident	79.1	Confident	156 Å²	156	52.3 Å²	52.3	68%	0.678	28%	0.275	S	S	*	.			trans	-89.2	16	-167.3	-67.7	179.7	-178.5	175.6	0	116.4	E258 Q262	E258-K260 HydrophobicContact CB-CG 4.46Å; E258-K260 HydrophobicContact CG-CG 4.2Å; E258-K260 PolarHBondContact O-N 3.48Å; E258-K260 WeakPolarHBondContact OE2-CE 3.38Å; K260-Q262 PolarHBondContact O-N 2.95Å
261	F	76.1	Confident	79.9	Confident	20 Å²	20	52.9 Å²	52.9	9%	0.088	27%	0.266	C	S	.	.			trans	-76.2	128.1	-178.6	-62.8	-77.6	0	0	0	112.8	V259 F264 V425 L427 N457	V259-F261 HydrophobicContact CG1-CD2 3.65Å; V259-F261 HydrophobicContact CG1-CE2 4.21Å; V259-F261 PolarHBondContact O-N 3.3Å; F261-F264 HydrophobicContact CB-CB 4.2Å; F261-F264 HydrophobicContact CB-CD1 3.69Å; F261-F264 HydrophobicContact CB-CG 4.31Å; F261-F264 HydrophobicContact CG-CB 4.46Å; F261-V425 HydrophobicContact CE1-CG1 3.88Å; F261-V425 HydrophobicContact CE2-CG1 3.89Å; F261-V425 HydrophobicContact CZ-CG1 3.18Å; F261-L427 HydrophobicContact CD2-CD2 4.26Å; F261-L427 HydrophobicContact CE2-CD1 4.25Å; F261-L427 HydrophobicContact CE2-CD2 3.32Å; F261-L427 HydrophobicContact CE2-CG 3.7Å; F261-L427 HydrophobicContact CZ-CD1 3.96Å; F261-L427 HydrophobicContact CZ-CD2 3.89Å; F261-L427 HydrophobicContact CZ-CG 3.9Å; F261-N457 HydrophobicContact CD1-CB 3.87Å; F261-N457 VanDerWaalsContact CD1-CG 3.49Å; F261-N457 HydrophobicContact CE1-CB 3.48Å; F261-N457 VanDerWaalsContact CE1-CB 3.48Å; F261-N457 VanDerWaalsContact CE1-CG 3.41Å; F261-N457 HydrophobicContact CZ-CB 4.35Å
262	Q	81.3	Confident	80.2	Confident	138 Å²	138	54.1 Å²	54.1	65%	0.645	27%	0.272	S	S	*	.	S	Bend	trans	-74.8	-41.8	168.3	-64.8	179.5	-2.9	0	0	111.4	K260 A287	K260-Q262 PolarHBondContact O-N 2.95Å; Q262-A287 WeakPolarHBondContact O-CB 3.42Å; Q262-A287 PolarHBondContact O-N 2.88Å
263	N	84.2	Confident	80.4	Confident	21 Å²	21	52.9 Å²	52.9	11%	0.112	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	124	-177.4	-77	-53.4	0	0	0	110	Y285 S286 D288 N457 S458 I461	N263-Y285 WeakPolarHBondContact CA-O 3.46Å; N263-S286 WeakPolarHBondContact OD1-CA 3.3Å; N263-S286 WeakPolarHBondContact OD1-CB 3.46Å; N263-S286 PolarHBondContact OD1-OG 2.69Å; N263-D288 VanDerWaalsContact CG-OD1 3.3Å; N263-D288 PolarHBondContact ND2-OD1 3.45Å; N263-D288 PolarHBondContact OD1-OD1 2.84Å; N263-N457 PolarHBondContact O-OD1 3.14Å; N263-S458 WeakPolarHBondContact CB-O 3.47Å; N263-S458 PolarHBondContact O-N 2.89Å; N263-I461 WeakPolarHBondContact OD1-CG1 3.41Å
264	F	84.8	Confident	80.4	Confident	11 Å²	11	55 Å²	55	5%	0.048	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	155.3	176.5	68.6	-89.6	0	0	0	112.6	F261 V266 L283 Y285 A365 I368 L369 F456	F261-F264 HydrophobicContact CB-CB 4.2Å; F261-F264 HydrophobicContact CB-CD1 3.69Å; F261-F264 HydrophobicContact CB-CG 4.31Å; F261-F264 HydrophobicContact CG-CB 4.46Å; F264-V266 HydrophobicContact CD2-CB 4.13Å; F264-V266 HydrophobicContact CD2-CG2 3.91Å; F264-V266 HydrophobicContact CE2-CB 4.06Å; F264-V266 HydrophobicContact CE2-CG2 3.96Å; F264-L283 HydrophobicContact CE2-CD2 4.07Å; F264-L283 HydrophobicContact CZ-CD2 4.27Å; F264-Y285 AromaticContact CD1-CD1 3.55Å; F264-Y285 HydrophobicContact CD1-CD1 3.55Å; F264-Y285 HydrophobicContact CD1-CE1 4.33Å; F264-Y285 HydrophobicContact CD1-CG 4.17Å; F264-Y285 AromaticContact CE1-CD1 3.17Å; F264-Y285 HydrophobicContact CE1-CD1 3.17Å; F264-Y285 AromaticContact CE1-CE1 3.84Å; F264-Y285 HydrophobicContact CE1-CE1 3.84Å; F264-Y285 AromaticContact CE1-CG 3.55Å; F264-Y285 HydrophobicContact CE1-CG 3.55Å; F264-Y285 HydrophobicContact CZ-CD1 4.02Å; F264-Y285 AromaticContact CZ-CG 3.92Å; F264-Y285 HydrophobicContact CZ-CG 3.92Å; F264-Y285 PolarHBondContact N-O 3.05Å; F264-Y285 VanDerWaalsContact N-O 3.08Å; F264-Y285 PolarHBondContact O-N 3.24Å; F264-A365 HydrophobicContact CD1-CB 4.48Å; F264-A365 HydrophobicContact CE1-CB 3.64Å; F264-A365 HydrophobicContact CZ-CB 4.4Å; F264-I368 HydrophobicContact CZ-CG2 4.45Å; F264-L369 HydrophobicContact CE2-CD1 4.05Å; F264-L369 HydrophobicContact CE2-CD2 4.07Å; F264-L369 HydrophobicContact CE2-CG 4.28Å; F264-L369 HydrophobicContact CZ-CD1 3.87Å; F264-L369 HydrophobicContact CZ-CD2 4.25Å; F264-L369 HydrophobicContact CZ-CG 4.01Å; F264-F456 WeakPolarHBondContact CA-O 3.44Å
265	M	84.4	Confident	80.4	Confident	57 Å²	57	57.6 Å²	57.6	28%	0.281	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	141.8	159.7	174.1	-178.2	71.6	0	0	107.8	L283 F284 F456	M265-L283 CarbonylContact C-O 3.59Å; M265-L283 WeakPolarHBondContact CA-O 3.13Å; M265-F284 HydrophobicContact CB-CD1 4.05Å; M265-F284 HydrophobicContact CB-CE1 4.28Å; M265-F284 HydrophobicContact CG-CD1 3.8Å; M265-F284 HydrophobicContact CG-CE1 3.59Å; M265-F284 HydrophobicContact CG-CZ 4.44Å; M265-F284 HydrophobicContact SD-CD1 4.18Å; M265-F284 HydrophobicContact SD-CE1 3.46Å; M265-F284 WeakPolarHBondContact SD-CE1 3.33Å; M265-F284 HydrophobicContact SD-CZ 4.27Å; M265-F456 HydrophobicContact CB-CB 4.34Å; M265-F456 HydrophobicContact CE-CB 3.78Å; M265-F456 HydrophobicContact CE-CD1 4.2Å; M265-F456 HydrophobicContact CE-CG 4.08Å; M265-F456 PolarHBondContact N-O 3.47Å; M265-F456 PolarHBondContact O-N 2.83Å
266	V	85.3	Confident	80	Confident	2 Å²	2	60.9 Å²	60.9	1%	0.012	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	132.8	169.4	135.9	0	0	0	0	107.2	F264 V268 K282 L283 L369 F453 P455	F264-V266 HydrophobicContact CD2-CB 4.13Å; F264-V266 HydrophobicContact CD2-CG2 3.91Å; F264-V266 HydrophobicContact CE2-CB 4.06Å; F264-V266 HydrophobicContact CE2-CG2 3.96Å; V266-V268 HydrophobicContact CG1-CG2 3.29Å; V266-K282 WeakPolarHBondContact O-CA 3.28Å; V266-L283 HydrophobicContact CG1-CB 4.39Å; V266-L283 PolarHBondContact N-O 3.06Å; V266-L283 PolarHBondContact O-N 2.92Å; V266-L369 HydrophobicContact CG1-CD2 4.24Å; V266-L369 HydrophobicContact CG2-CD2 4.47Å; V266-F453 HydrophobicContact CG1-CD1 4.11Å; V266-P455 HydrophobicContact CG2-CB 4Å
267	S	86.1	Confident	79.3	Confident	13 Å²	13	64.5 Å²	64.5	9%	0.091	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	141.1	154.3	-142.9	0	0	0	0	108.5	E280 I281 K282 L454	S267-E280 VanDerWaalsContact OG-CD 3.26Å; S267-E280 VanDerWaalsContact OG-CG 3.25Å; S267-E280 WeakPolarHBondContact OG-CG 3.37Å; S267-E280 PolarHBondContact OG-OE1 3.27Å; S267-I281 CarbonylContact C-O 3.5Å; S267-K282 WeakPolarHBondContact OG-CE 3.43Å; S267-K282 VanDerWaalsContact OG-CG 3.32Å; S267-K282 WeakPolarHBondContact OG-CG 3.39Å; S267-L454 PolarHBondContact N-O 2.87Å; S267-L454 PolarHBondContact O-N 2.89Å
268	V	88	Confident	79.1	Confident	0 Å²	0	68.3 Å²	68.3	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	114.5	177.1	-163.3	0	0	0	0	109.4	V266 E280 I281 L302 Y451 N452 F453	V266-V268 HydrophobicContact CG1-CG2 3.29Å; V268-E280 WeakPolarHBondContact O-CA 3.47Å; V268-I281 HydrophobicContact CB-CB 4.42Å; V268-I281 PolarHBondContact N-O 3.07Å; V268-I281 PolarHBondContact O-N 3.22Å; V268-L302 HydrophobicContact CB-CD1 4.21Å; V268-L302 HydrophobicContact CG1-CD1 4.08Å; V268-L302 HydrophobicContact CG2-CD1 3.99Å; V268-Y451 HydrophobicContact CG1-CD1 3.81Å; V268-Y451 HydrophobicContact CG1-CG 4.24Å; V268-N452 VanDerWaalsContact CA-O 3.29Å; V268-N452 WeakPolarHBondContact CA-O 3.2Å; V268-F453 HydrophobicContact CG1-CD1 4.28Å; V268-F453 HydrophobicContact CG1-CE1 4.26Å; V268-F453 HydrophobicContact CG2-CD1 3.76Å; V268-F453 HydrophobicContact CG2-CE1 3.91Å
269	E	85.6	Confident	79	Confident	84 Å²	84	64.2 Å²	64.2	39%	0.393	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	121.4	170.7	-53.8	178.7	151.1	0	0	108.7	Y451 N452	E269-Y451 VanDerWaalsContact O-CA 3.3Å; E269-Y451 WeakPolarHBondContact O-CA 3.25Å; E269-N452 HydrophobicContact CB-CB 4.13Å; E269-N452 HydrophobicContact CG-CB 4.49Å; E269-N452 PolarHBondContact N-O 3.39Å; E269-N452 PolarHBondContact O-N 3.18Å; E269-N452 PolarHBondContact OE2-ND2 2.98Å
270	V	85.5	Confident	79.2	Confident	1 Å²	1	68.9 Å²	68.9	1%	0.006	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	106.5	-176.5	-173.2	0	0	0	0	109.6	Q272 G279 I281 M297 T449 F450 Y451	V270-Q272 HydrophobicContact CG1-CG 4.31Å; V270-G279 PolarHBondContact N-O 3.03Å; V270-G279 PolarHBondContact O-N 2.81Å; V270-I281 HydrophobicContact CG2-CD1 3.62Å; V270-I281 HydrophobicContact CG2-CG1 3.75Å; V270-M297 HydrophobicContact CB-CE 4.3Å; V270-M297 HydrophobicContact CB-SD 4.37Å; V270-M297 HydrophobicContact CG1-CE 4.01Å; V270-M297 HydrophobicContact CG1-SD 4.42Å; V270-M297 HydrophobicContact CG2-SD 4.19Å; V270-T449 HydrophobicContact CG1-CG2 3.93Å; V270-F450 WeakPolarHBondContact CA-O 3.16Å; V270-Y451 HydrophobicContact CB-CD1 4.47Å; V270-Y451 HydrophobicContact CB-CE1 4.33Å; V270-Y451 HydrophobicContact CG1-CD1 4.23Å; V270-Y451 HydrophobicContact CG1-CE1 3.7Å; V270-Y451 HydrophobicContact CG2-CD1 3.78Å; V270-Y451 HydrophobicContact CG2-CE1 3.77Å
271	L	82.7	Confident	79.7	Confident	65 Å²	65	61.5 Å²	61.5	34%	0.34	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	96	179.5	-66.4	169.1	0	0	0	110.1	P278 T449 F450	L271-P278 HydrophobicContact CD2-CB 3.87Å; L271-T449 WeakPolarHBondContact O-CA 3.07Å; L271-F450 HydrophobicContact CB-CB 4.25Å; L271-F450 HydrophobicContact CB-CD2 4.36Å; L271-F450 HydrophobicContact CD1-CD2 4.43Å; L271-F450 PolarHBondContact N-O 3.01Å; L271-F450 PolarHBondContact O-N 3.19Å
272	Q	76.6	Confident	80.4	Confident	36 Å²	36	63.4 Å²	63.4	17%	0.168	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	111.3	173.8	-69.9	-173.7	9	0	0	110.8	V270 K274 L275 K276 S299 T449	V270-Q272 HydrophobicContact CG1-CG 4.31Å; Q272-K274 VanDerWaalsContact C-N 3.31Å; Q272-K274 PolarHBondContact O-N 2.81Å; Q272-K274 VanDerWaalsContact O-N 3.14Å; Q272-L275 HydrophobicContact CB-CB 4.42Å; Q272-L275 PolarHBondContact O-N 3.5Å; Q272-L275 VanDerWaalsContact O-N 3.09Å; Q272-K276 PolarHBondContact O-N 3.41Å; Q272-S299 PolarHBondContact NE2-O 3.39Å; Q272-S299 PolarHBondContact NE2-OG 3.38Å; Q272-T449 HydrophobicContact CG-CG2 3.66Å
273	H	73.3	Confident	80.9	Confident	74 Å²	74	56.9 Å²	56.9	34%	0.343	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.8	-43.8	-171.4	-179.8	54.8	0	0	0	114.5	K276 Y448	H273-K276 WeakPolarHBondContact O-CG 3.47Å; H273-Y448 HydrophobicContact CB-CD1 3.98Å; H273-Y448 HydrophobicContact CB-CD2 3.71Å; H273-Y448 HydrophobicContact CB-CE1 3.95Å; H273-Y448 HydrophobicContact CB-CE2 3.67Å; H273-Y448 HydrophobicContact CB-CG 3.9Å; H273-Y448 VanDerWaalsContact CB-O 3.31Å; H273-Y448 WeakPolarHBondContact CB-O 3.36Å; H273-Y448 AromaticContact CD2-CE1 3.63Å; H273-Y448 AromaticContact CE1-CE1 3.8Å; H273-Y448 AromaticContact CE1-CZ 3.65Å; H273-Y448 PolarHBondContact CE1-OH 3.14Å; H273-Y448 VanDerWaalsContact CE1-OH 3.26Å; H273-Y448 AromaticContact CG-CD1 3.91Å; H273-Y448 AromaticContact CG-CE1 3.44Å; H273-Y448 VanDerWaalsContact CG-CE1 3.44Å; H273-Y448 AromaticContact CG-CE2 3.79Å; H273-Y448 AromaticContact CG-CZ 3.4Å; H273-Y448 VanDerWaalsContact CG-CZ 3.4Å; H273-Y448 PolarHBondContact N-O 2.79Å; H273-Y448 VanDerWaalsContact N-O 3.08Å; H273-Y448 AromaticContact ND1-CE1 3.56Å; H273-Y448 AromaticContact ND1-CE2 3.69Å; H273-Y448 AromaticContact ND1-CZ 3.13Å; H273-Y448 PolarHBondContact ND1-OH 3.09Å; H273-Y448 AromaticContact NE2-CE1 3.88Å
274	K	70.1	Confident	81.3	Confident	140 Å²	140	56.4 Å²	56.4	61%	0.609	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-30.9	-177.5	-78.4	-173.7	-178.7	164.4	0	114.2	Q272 T447	Q272-K274 VanDerWaalsContact C-N 3.31Å; Q272-K274 PolarHBondContact O-N 2.81Å; Q272-K274 VanDerWaalsContact O-N 3.14Å; K274-T447 HydrophobicContact CD-CG2 3.5Å; K274-T447 HydrophobicContact CG-CG2 4.03Å; K274-T447 VanDerWaalsContact NZ-CG2 3.27Å
275	L	68.2	Low	81.7	Confident	108 Å²	108	56.4 Å²	56.4	57%	0.565	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-27.4	179.9	-61.3	-172.7	0	0	0	112.2	Q272 L277	Q272-L275 HydrophobicContact CB-CB 4.42Å; Q272-L275 PolarHBondContact O-N 3.5Å; Q272-L275 VanDerWaalsContact O-N 3.09Å; L275-L277 HydrophobicContact CB-CB 4.42Å; L275-L277 PolarHBondContact O-N 3.34Å
276	K	66.4	Low	82	Confident	179 Å²	179	53.7 Å²	53.7	78%	0.778	27%	0.268	S	S	*	.			trans	56.6	10.3	-172.7	-57.2	-177.2	178.8	179.2	0	114.7	Q272 H273	Q272-K276 PolarHBondContact O-N 3.41Å; H273-K276 WeakPolarHBondContact O-CG 3.47Å
277	L	66.8	Low	82.3	Confident	121 Å²	121	55.2 Å²	55.2	63%	0.634	28%	0.28	S	S	*	.	P	Polyproline II helix	trans	-89.3	120.9	174.4	-67.8	171.1	0	0	0	108.8	L275	L275-L277 HydrophobicContact CB-CB 4.42Å; L275-L277 PolarHBondContact O-N 3.34Å
278	P	76.5	Confident	82.4	Confident	98 Å²	98	57.8 Å²	57.8	64%	0.636	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.6	126	165.7	29.6	-31.4	0	0	0	109.3	L271	L271-P278 HydrophobicContact CD2-CB 3.87Å
279	G	80.2	Confident	82.6	Confident	20 Å²	20	59.9 Å²	59.9	21%	0.206	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	156.8	160.9	0	0	0	0	0	110.4	V270	V270-G279 PolarHBondContact N-O 3.03Å; V270-G279 PolarHBondContact O-N 2.81Å
280	E	84.9	Confident	83	Confident	102 Å²	102	58.7 Å²	58.7	48%	0.477	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	122.2	166.8	-170.3	-168.2	-159.6	0	0	108.2	S267 V268 K282	S267-E280 VanDerWaalsContact OG-CD 3.26Å; S267-E280 VanDerWaalsContact OG-CG 3.25Å; S267-E280 WeakPolarHBondContact OG-CG 3.37Å; S267-E280 PolarHBondContact OG-OE1 3.27Å; V268-E280 WeakPolarHBondContact O-CA 3.47Å; E280-K282 VanDerWaalsContact CD-CE 3.46Å; E280-K282 WeakPolarHBondContact OE1-CE 3.45Å; E280-K282 IonicContact OE1-NZ 2.72Å; E280-K282 PolarHBondContact OE1-NZ 3.48Å; E280-K282 WeakPolarHBondContact OE2-CE 3.48Å; E280-K282 IonicContact OE2-NZ 3.84Å; E280-K282 PolarHBondContact OE2-NZ 3.41Å
281	I	87.7	Confident	83.4	Confident	1 Å²	1	58.7 Å²	58.7	1%	0.005	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	121	173.2	-54.9	175.2	0	0	0	108.6	S267 V268 V270 T295 M297 S300 L302 F304	S267-I281 CarbonylContact C-O 3.5Å; V268-I281 HydrophobicContact CB-CB 4.42Å; V268-I281 PolarHBondContact N-O 3.07Å; V268-I281 PolarHBondContact O-N 3.22Å; V270-I281 HydrophobicContact CG2-CD1 3.62Å; V270-I281 HydrophobicContact CG2-CG1 3.75Å; I281-T295 WeakPolarHBondContact CA-OG1 3.37Å; I281-M297 HydrophobicContact CD1-CB 3.84Å; I281-M297 HydrophobicContact CD1-CG 4.22Å; I281-M297 HydrophobicContact CD1-SD 3.61Å; I281-M297 HydrophobicContact CG1-CB 4.01Å; I281-M297 HydrophobicContact CG1-CG 4.45Å; I281-M297 HydrophobicContact CG1-SD 3.6Å; I281-S300 WeakPolarHBondContact CD1-OG 3.3Å; I281-L302 HydrophobicContact CD1-CD1 4.01Å; I281-F304 HydrophobicContact CG2-CE2 3.43Å; I281-F304 VanDerWaalsContact CG2-CE2 3.43Å; I281-F304 HydrophobicContact CG2-CZ 3.54Å
282	K	90.2	Very high	84	Confident	61 Å²	61	55.6 Å²	55.6	27%	0.265	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	135.2	173.2	-79.3	162.6	169.1	139	0	110.2	V266 S267 E280 F284 F294 T295	V266-K282 WeakPolarHBondContact O-CA 3.28Å; S267-K282 WeakPolarHBondContact OG-CE 3.43Å; S267-K282 VanDerWaalsContact OG-CG 3.32Å; S267-K282 WeakPolarHBondContact OG-CG 3.39Å; E280-K282 VanDerWaalsContact CD-CE 3.46Å; E280-K282 WeakPolarHBondContact OE1-CE 3.45Å; E280-K282 IonicContact OE1-NZ 2.72Å; E280-K282 PolarHBondContact OE1-NZ 3.48Å; E280-K282 WeakPolarHBondContact OE2-CE 3.48Å; E280-K282 IonicContact OE2-NZ 3.84Å; E280-K282 PolarHBondContact OE2-NZ 3.41Å; K282-F284 HydrophobicContact CB-CE2 4.14Å; K282-F284 HydrophobicContact CB-CZ 4.36Å; K282-F294 WeakPolarHBondContact O-CA 3.46Å; K282-F294 WeakPolarHBondContact O-CB 3.46Å; K282-T295 HydrophobicContact CB-CG2 4.48Å; K282-T295 PolarHBondContact N-OG1 3.45Å; K282-T295 PolarHBondContact O-N 2.87Å; K282-T295 VanDerWaalsContact O-N 3.13Å
283	L	91.7	Very high	84.9	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	131	172.1	173.3	66.5	0	0	0	109.5	F264 M265 V266 S293 F294 F304 I368 L369	F264-L283 HydrophobicContact CE2-CD2 4.07Å; F264-L283 HydrophobicContact CZ-CD2 4.27Å; M265-L283 CarbonylContact C-O 3.59Å; M265-L283 WeakPolarHBondContact CA-O 3.13Å; V266-L283 HydrophobicContact CG1-CB 4.39Å; V266-L283 PolarHBondContact N-O 3.06Å; V266-L283 PolarHBondContact O-N 2.92Å; L283-S293 CarbonylContact C-O 3.57Å; L283-S293 WeakPolarHBondContact CA-O 3.43Å; L283-F294 HydrophobicContact CB-CB 4.49Å; L283-F294 HydrophobicContact CD1-CB 4.01Å; L283-F294 HydrophobicContact CD1-CD1 4.13Å; L283-F294 HydrophobicContact CD1-CG 4.45Å; L283-F304 HydrophobicContact CB-CE1 4.33Å; L283-F304 HydrophobicContact CB-CE2 4.19Å; L283-F304 HydrophobicContact CB-CZ 4Å; L283-F304 HydrophobicContact CD1-CD2 4.23Å; L283-F304 HydrophobicContact CD1-CG 4.27Å; L283-F304 HydrophobicContact CD2-CD1 3.82Å; L283-F304 HydrophobicContact CD2-CE1 3.9Å; L283-F304 HydrophobicContact CD2-CG 4.25Å; L283-F304 HydrophobicContact CD2-CZ 4.4Å; L283-I368 HydrophobicContact CD1-CD1 4.39Å; L283-I368 HydrophobicContact CD2-CD1 4.44Å; L283-L369 HydrophobicContact CD2-CD2 3.84Å
284	F	92.5	Very high	85.9	Confident	12 Å²	12	50.4 Å²	50.4	5%	0.053	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	123	168.3	-50.5	-88	0	0	0	107.2	M265 K282 A292 S293 P462 R465 F466	M265-F284 HydrophobicContact CB-CD1 4.05Å; M265-F284 HydrophobicContact CB-CE1 4.28Å; M265-F284 HydrophobicContact CG-CD1 3.8Å; M265-F284 HydrophobicContact CG-CE1 3.59Å; M265-F284 HydrophobicContact CG-CZ 4.44Å; M265-F284 HydrophobicContact SD-CD1 4.18Å; M265-F284 HydrophobicContact SD-CE1 3.46Å; M265-F284 WeakPolarHBondContact SD-CE1 3.33Å; M265-F284 HydrophobicContact SD-CZ 4.27Å; K282-F284 HydrophobicContact CB-CE2 4.14Å; K282-F284 HydrophobicContact CB-CZ 4.36Å; F284-A292 CarbonylContact O-C 3.58Å; F284-A292 WeakPolarHBondContact O-CA 3.38Å; F284-S293 WeakPolarHBondContact CD2-O 3.35Å; F284-S293 PolarHBondContact N-O 3.33Å; F284-S293 PolarHBondContact O-N 3.32Å; F284-P462 HydrophobicContact CD1-CG 4.17Å; F284-R465 HydrophobicContact CD1-CB 3.57Å; F284-R465 HydrophobicContact CD1-CG 3.85Å; F284-R465 HydrophobicContact CD2-CB 3.94Å; F284-R465 HydrophobicContact CE1-CB 3.53Å; F284-R465 HydrophobicContact CE1-CG 3.39Å; F284-R465 HydrophobicContact CE2-CB 3.93Å; F284-R465 HydrophobicContact CE2-CG 4.44Å; F284-R465 HydrophobicContact CG-CB 3.79Å; F284-R465 HydrophobicContact CZ-CB 3.74Å; F284-R465 HydrophobicContact CZ-CG 3.76Å; F284-F466 HydrophobicContact CB-CD2 4.49Å; F284-F466 HydrophobicContact CB-CE1 4.25Å; F284-F466 HydrophobicContact CB-CE2 3.69Å; F284-F466 HydrophobicContact CB-CZ 3.55Å; F284-F466 WeakPolarHBondContact O-CZ 3.44Å
285	Y	92.2	Very high	86.9	Confident	10 Å²	10	45 Å²	45	4%	0.039	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	136.6	-175	170.5	-87.7	0	0	0	111	N263 F264 A287 F362 K363 A365 I368	N263-Y285 WeakPolarHBondContact CA-O 3.46Å; F264-Y285 AromaticContact CD1-CD1 3.55Å; F264-Y285 HydrophobicContact CD1-CD1 3.55Å; F264-Y285 HydrophobicContact CD1-CE1 4.33Å; F264-Y285 HydrophobicContact CD1-CG 4.17Å; F264-Y285 AromaticContact CE1-CD1 3.17Å; F264-Y285 HydrophobicContact CE1-CD1 3.17Å; F264-Y285 AromaticContact CE1-CE1 3.84Å; F264-Y285 HydrophobicContact CE1-CE1 3.84Å; F264-Y285 AromaticContact CE1-CG 3.55Å; F264-Y285 HydrophobicContact CE1-CG 3.55Å; F264-Y285 HydrophobicContact CZ-CD1 4.02Å; F264-Y285 AromaticContact CZ-CG 3.92Å; F264-Y285 HydrophobicContact CZ-CG 3.92Å; F264-Y285 PolarHBondContact N-O 3.05Å; F264-Y285 VanDerWaalsContact N-O 3.08Å; F264-Y285 PolarHBondContact O-N 3.24Å; Y285-A287 HydrophobicContact CE1-CB 3.86Å; Y285-F362 AromaticContact CD2-CE1 3.98Å; Y285-F362 HydrophobicContact CD2-CE1 3.98Å; Y285-F362 AromaticContact CD2-CZ 3.68Å; Y285-F362 HydrophobicContact CD2-CZ 3.68Å; Y285-F362 HydrophobicContact CE2-CD1 4.24Å; Y285-F362 AromaticContact CE2-CE1 3.26Å; Y285-F362 HydrophobicContact CE2-CE1 3.26Å; Y285-F362 HydrophobicContact CE2-CE2 4.43Å; Y285-F362 AromaticContact CE2-CZ 3.39Å; Y285-F362 HydrophobicContact CE2-CZ 3.39Å; Y285-F362 AromaticContact CZ-CE1 3.72Å; Y285-K363 PolarHBondContact OH-O 3.33Å; Y285-A365 HydrophobicContact CE1-CB 4.01Å; Y285-A365 PolarHBondContact OH-N 2.59Å; Y285-I368 HydrophobicContact CD2-CD1 3.63Å; Y285-I368 HydrophobicContact CD2-CG2 4.12Å; Y285-I368 HydrophobicContact CE2-CD1 4.07Å; Y285-I368 HydrophobicContact CE2-CG2 4.12Å
286	S	92.2	Very high	88	Confident	0 Å²	0	40 Å²	40	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	115.1	171.5	171.4	0	0	0	0	111	N263 D288 K289 R290 L291 F362 I461	N263-S286 WeakPolarHBondContact OD1-CA 3.3Å; N263-S286 WeakPolarHBondContact OD1-CB 3.46Å; N263-S286 PolarHBondContact OD1-OG 2.69Å; S286-D288 PolarHBondContact OG-OD1 2.78Å; S286-K289 PolarHBondContact OG-N 2.91Å; S286-K289 VanDerWaalsContact OG-N 3.14Å; S286-R290 CarbonylContact O-C 3.55Å; S286-R290 WeakPolarHBondContact O-CA 3.09Å; S286-R290 PolarHBondContact O-N 3.27Å; S286-L291 PolarHBondContact N-O 2.89Å; S286-L291 PolarHBondContact O-N 3.38Å; S286-F362 WeakPolarHBondContact O-CE1 3.49Å; S286-I461 VanDerWaalsContact OG-CD1 3.32Å; S286-I461 WeakPolarHBondContact OG-CD1 3.13Å
287	A	91	Very high	88.8	Confident	34 Å²	34	33.1 Å²	33.1	28%	0.281	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-38	171.8	0	0	0	0	0	112.2	Q262 Y285 K289 R290	Q262-A287 WeakPolarHBondContact O-CB 3.42Å; Q262-A287 PolarHBondContact O-N 2.88Å; Y285-A287 HydrophobicContact CE1-CB 3.86Å; A287-K289 VanDerWaalsContact C-N 3.28Å; A287-K289 PolarHBondContact O-N 2.77Å; A287-R290 WeakPolarHBondContact O-CG 3.44Å; A287-R290 PolarHBondContact O-N 3.15Å
288	D	88.6	Confident	89.3	Confident	67 Å²	67	32 Å²	32	36%	0.358	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-9.7	-174.5	75.5	-65.1	0	0	0	114	N263 S286	N263-D288 VanDerWaalsContact CG-OD1 3.3Å; N263-D288 PolarHBondContact ND2-OD1 3.45Å; N263-D288 PolarHBondContact OD1-OD1 2.84Å; S286-D288 PolarHBondContact OG-OD1 2.78Å
289	K	90.9	Very high	89.1	Confident	45 Å²	45	30.4 Å²	30.4	20%	0.196	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.3	-0.4	167.3	-57.8	-66.6	163.8	-71.4	0	113.3	S286 A287 L291 I461 W463 P516	S286-K289 PolarHBondContact OG-N 2.91Å; S286-K289 VanDerWaalsContact OG-N 3.14Å; A287-K289 VanDerWaalsContact C-N 3.28Å; A287-K289 PolarHBondContact O-N 2.77Å; K289-L291 VanDerWaalsContact C-N 3.3Å; K289-L291 HydrophobicContact CB-CD1 3.89Å; K289-L291 HydrophobicContact CB-CG 3.8Å; K289-L291 WeakPolarHBondContact O-CG 3.29Å; K289-L291 PolarHBondContact O-N 3Å; K289-I461 HydrophobicContact CB-CD1 4.14Å; K289-I461 HydrophobicContact CG-CD1 3.35Å; K289-W463 HydrophobicContact CB-CH2 4.42Å; K289-W463 HydrophobicContact CD-CH2 4.48Å; K289-W463 HydrophobicContact CG-CH2 3.98Å; K289-W463 HydrophobicContact CG-CZ2 4.37Å; K289-P516 HydrophobicContact CD-CG 4.26Å
290	R	94.3	Very high	88.9	Confident	58 Å²	58	29.8 Å²	29.8	22%	0.219	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.1	47.4	-178.2	-58.5	171	-73.2	-103.6	-12.5	112.3	S286 A287 F321 D322 F362	S286-R290 CarbonylContact O-C 3.55Å; S286-R290 WeakPolarHBondContact O-CA 3.09Å; S286-R290 PolarHBondContact O-N 3.27Å; A287-R290 WeakPolarHBondContact O-CG 3.44Å; A287-R290 PolarHBondContact O-N 3.15Å; R290-F321 HydrophobicContact CB-CB 3.87Å; R290-F321 WeakPolarHBondContact O-CB 3.4Å; R290-F321 PolarHBondContact O-N 3.47Å; R290-F321 VanDerWaalsContact O-N 3.15Å; R290-D322 IonicContact CZ-OD1 2.84Å; R290-D322 IonicContact CZ-OD2 2.76Å; R290-D322 IonicContact NE-OD1 2.71Å; R290-D322 PolarHBondContact NE-OD1 3.23Å; R290-D322 IonicContact NH2-OD1 2.63Å; R290-D322 PolarHBondContact NH2-OD1 2.97Å; R290-D322 IonicContact NH2-OD2 2.64Å; R290-D322 PolarHBondContact NH2-OD2 3.25Å; R290-F362 HydrophobicContact CB-CB 4.43Å; R290-F362 HydrophobicContact CB-CD1 3.97Å; R290-F362 HydrophobicContact CB-CE1 4.35Å; R290-F362 HydrophobicContact CB-CG 4.13Å; R290-F362 HydrophobicContact CG-CB 4.48Å; R290-F362 HydrophobicContact CG-CD1 4.08Å; R290-F362 HydrophobicContact CG-CG 4.46Å
291	L	95	Very high	88.6	Confident	1 Å²	1	26.8 Å²	26.8	1%	0.005	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	140.6	-178.7	-55.3	-179.7	0	0	0	111.3	S286 K289 H319 D320 W463 F466 L517	S286-L291 PolarHBondContact N-O 2.89Å; S286-L291 PolarHBondContact O-N 3.38Å; K289-L291 VanDerWaalsContact C-N 3.3Å; K289-L291 HydrophobicContact CB-CD1 3.89Å; K289-L291 HydrophobicContact CB-CG 3.8Å; K289-L291 WeakPolarHBondContact O-CG 3.29Å; K289-L291 PolarHBondContact O-N 3Å; L291-H319 WeakPolarHBondContact CA-O 3.41Å; L291-D320 HydrophobicContact CD2-CB 3.91Å; L291-W463 HydrophobicContact CD1-CE3 4.49Å; L291-W463 HydrophobicContact CD1-CH2 3.86Å; L291-W463 HydrophobicContact CD1-CZ3 3.42Å; L291-W463 VanDerWaalsContact CD1-CZ3 3.42Å; L291-F466 HydrophobicContact CB-CD1 4.02Å; L291-F466 HydrophobicContact CB-CE1 3.57Å; L291-F466 HydrophobicContact CB-CZ 4.25Å; L291-F466 HydrophobicContact CD1-CD1 4.29Å; L291-F466 HydrophobicContact CD1-CE1 4.49Å; L291-L517 HydrophobicContact CD1-CD2 4.04Å; L291-L517 HydrophobicContact CD1-CG 4.43Å; L291-L517 HydrophobicContact CD2-CD1 4.31Å
292	A	94.8	Very high	88.6	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	124.4	167.9	0	0	0	0	0	109.9	F284 T318 H319 T348 F362 I368	F284-A292 CarbonylContact O-C 3.58Å; F284-A292 WeakPolarHBondContact O-CA 3.38Å; A292-T318 CarbonylContact O-C 3.45Å; A292-T318 WeakPolarHBondContact O-CA 3.45Å; A292-H319 PolarHBondContact N-O 2.9Å; A292-H319 VanDerWaalsContact N-O 3.14Å; A292-H319 PolarHBondContact O-N 3.41Å; A292-T348 HydrophobicContact CB-CG2 4.03Å; A292-F362 HydrophobicContact CB-CE2 4.18Å; A292-F362 HydrophobicContact CB-CZ 4.34Å; A292-I368 HydrophobicContact CB-CD1 4.12Å
293	S	94.9	Very high	88.5	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	130.1	174.3	168.9	0	0	0	0	109.2	L283 F284 V317 T318 R465 F466	L283-S293 CarbonylContact C-O 3.57Å; L283-S293 WeakPolarHBondContact CA-O 3.43Å; F284-S293 WeakPolarHBondContact CD2-O 3.35Å; F284-S293 PolarHBondContact N-O 3.33Å; F284-S293 PolarHBondContact O-N 3.32Å; S293-V317 CarbonylContact C-O 3.58Å; S293-V317 VanDerWaalsContact CA-O 3.29Å; S293-V317 WeakPolarHBondContact CA-O 3.27Å; S293-T318 WeakPolarHBondContact CB-OG1 3.22Å; S293-T318 PolarHBondContact OG-OG1 2.88Å; S293-R465 PolarHBondContact OG-O 2.89Å; S293-F466 VanDerWaalsContact CB-CD1 3.47Å
294	F	94	Very high	88.4	Confident	1 Å²	1	24.1 Å²	24.1	0%	0.004	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	156.6	-177.8	53.6	-85.4	0	0	0	113.8	K282 L283 F304 L308 V316 V317 H319 T348	K282-F294 WeakPolarHBondContact O-CA 3.46Å; K282-F294 WeakPolarHBondContact O-CB 3.46Å; L283-F294 HydrophobicContact CB-CB 4.49Å; L283-F294 HydrophobicContact CD1-CB 4.01Å; L283-F294 HydrophobicContact CD1-CD1 4.13Å; L283-F294 HydrophobicContact CD1-CG 4.45Å; F294-F304 HydrophobicContact CB-CD2 3.84Å; F294-F304 HydrophobicContact CB-CE2 3.84Å; F294-F304 HydrophobicContact CD1-CD2 4.13Å; F294-F304 AromaticContact CD2-CD2 3.76Å; F294-F304 HydrophobicContact CD2-CD2 3.76Å; F294-F304 HydrophobicContact CD2-CE2 4.23Å; F294-F304 HydrophobicContact CE2-CD2 4.33Å; F294-F304 AromaticContact CG-CD2 3.63Å; F294-F304 HydrophobicContact CG-CD2 3.63Å; F294-F304 HydrophobicContact CG-CE2 4.11Å; F294-F304 VanDerWaalsContact CZ-O 3.28Å; F294-F304 WeakPolarHBondContact CZ-O 3.5Å; F294-L308 HydrophobicContact CE2-CD1 3.68Å; F294-L308 HydrophobicContact CZ-CD1 3.79Å; F294-V316 WeakPolarHBondContact O-CA 3.33Å; F294-V317 HydrophobicContact CD2-CB 4.37Å; F294-V317 HydrophobicContact CE1-CB 4.44Å; F294-V317 HydrophobicContact CE2-CB 3.94Å; F294-V317 HydrophobicContact CE2-CG1 4.42Å; F294-V317 HydrophobicContact CE2-CG2 4.3Å; F294-V317 HydrophobicContact CZ-CB 3.98Å; F294-V317 HydrophobicContact CZ-CG1 4.04Å; F294-V317 PolarHBondContact N-O 3.39Å; F294-V317 PolarHBondContact O-N 3.49Å; F294-H319 AromaticContact CE1-CE1 3.96Å; F294-H319 AromaticContact CE1-ND1 3.98Å; F294-H319 AromaticContact CZ-CE1 3.75Å; F294-T348 HydrophobicContact CD1-CG2 4.49Å; F294-T348 HydrophobicContact CE1-CG2 3.7Å; F294-T348 HydrophobicContact CZ-CG2 4.23Å
295	T	92.1	Very high	88.2	Confident	28 Å²	28	23.8 Å²	23.8	17%	0.172	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	131	169.3	49.2	0	0	0	0	110.3	I281 K282	I281-T295 WeakPolarHBondContact CA-OG1 3.37Å; K282-T295 HydrophobicContact CB-CG2 4.48Å; K282-T295 PolarHBondContact N-OG1 3.45Å; K282-T295 PolarHBondContact O-N 2.87Å; K282-T295 VanDerWaalsContact O-N 3.13Å
296	N	90.9	Very high	87.9	Confident	3 Å²	3	25.6 Å²	25.6	2%	0.016	14%	0.141	C	C	.	.			trans	-66.6	142.2	178.6	-176.9	42.7	0	0	0	111.8	N298 S312 P313 Y315 V317	N296-N298 PolarHBondContact ND2-OD1 2.79Å; N296-N298 PolarHBondContact OD1-OD1 2.79Å; N296-S312 PolarHBondContact ND2-O 3.14Å; N296-P313 CarbonylContact O-C 3.51Å; N296-P313 WeakPolarHBondContact O-CA 3.16Å; N296-Y315 VanDerWaalsContact CB-O 3.3Å; N296-Y315 WeakPolarHBondContact CB-O 3.41Å; N296-Y315 PolarHBondContact N-O 2.93Å; N296-V317 HydrophobicContact CB-CG2 4.28Å
297	M	84.6	Confident	87.6	Confident	33 Å²	33	27.3 Å²	27.3	16%	0.163	16%	0.16	C	C	.	.			trans	-153.8	95.3	170.1	-172.9	170.2	-178.4	0	0	109.9	V270 I281 S299 S300	V270-M297 HydrophobicContact CB-CE 4.3Å; V270-M297 HydrophobicContact CB-SD 4.37Å; V270-M297 HydrophobicContact CG1-CE 4.01Å; V270-M297 HydrophobicContact CG1-SD 4.42Å; V270-M297 HydrophobicContact CG2-SD 4.19Å; I281-M297 HydrophobicContact CD1-CB 3.84Å; I281-M297 HydrophobicContact CD1-CG 4.22Å; I281-M297 HydrophobicContact CD1-SD 3.61Å; I281-M297 HydrophobicContact CG1-CB 4.01Å; I281-M297 HydrophobicContact CG1-CG 4.45Å; I281-M297 HydrophobicContact CG1-SD 3.6Å; M297-S299 PolarHBondContact O-N 3.32Å; M297-S300 WeakPolarHBondContact O-CB 3.48Å; M297-S300 PolarHBondContact O-N 3.23Å
298	N	75.5	Confident	87.5	Confident	99 Å²	99	26.9 Å²	26.9	53%	0.529	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-25.3	-173.6	-62.5	5.8	0	0	0	114.8	N296 L310	N296-N298 PolarHBondContact ND2-OD1 2.79Å; N296-N298 PolarHBondContact OD1-OD1 2.79Å; N298-L310 PolarHBondContact ND2-O 3.13Å; N298-L310 PolarHBondContact OD1-O 2.94Å
299	S	72.6	Confident	87.4	Confident	64 Å²	64	31.7 Å²	31.7	45%	0.448	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.7	7.6	179.2	59	0	0	0	0	113.9	Q272 M297	Q272-S299 PolarHBondContact NE2-O 3.39Å; Q272-S299 PolarHBondContact NE2-OG 3.38Å; M297-S299 PolarHBondContact O-N 3.32Å
300	S	76.1	Confident	87.3	Confident	7 Å²	7	30.9 Å²	30.9	5%	0.049	18%	0.176	C	C	.	.			trans	-81.5	132.4	-179.5	177.2	0	0	0	0	112.7	I281 M297 L302 S305 Q306	I281-S300 WeakPolarHBondContact CD1-OG 3.3Å; M297-S300 WeakPolarHBondContact O-CB 3.48Å; M297-S300 PolarHBondContact O-N 3.23Å; S300-L302 VanDerWaalsContact C-N 3.32Å; S300-L302 WeakPolarHBondContact OG-CB 3.43Å; S300-L302 WeakPolarHBondContact OG-CG 3.41Å; S300-L302 PolarHBondContact OG-N 3.48Å; S300-S305 WeakPolarHBondContact CB-OG 3.33Å; S300-S305 PolarHBondContact OG-OG 3.01Å; S300-Q306 PolarHBondContact O-NE2 2.88Å
301	V	79.4	Confident	86.9	Confident	39 Å²	39	32.7 Å²	32.7	24%	0.236	20%	0.197	C	C	.	.			trans	-87.4	-4.7	176.2	-167.6	0	0	0	0	111.7	Q306 K371 I433 Y451	V301-Q306 VanDerWaalsContact CA-NE2 3.26Å; V301-Q306 PolarHBondContact O-NE2 2.87Å; V301-K371 WeakPolarHBondContact O-CE 3.28Å; V301-I433 HydrophobicContact CB-CD1 3.55Å; V301-I433 HydrophobicContact CG1-CD1 3.48Å; V301-I433 VanDerWaalsContact CG1-CD1 3.48Å; V301-I433 HydrophobicContact CG2-CD1 4.15Å; V301-Y451 HydrophobicContact CB-CE2 4.41Å; V301-Y451 PolarHBondContact N-OH 2.87Å
302	L	86.6	Confident	86.6	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	20%	0.204	C	C	.	.	S	Bend	trans	-67.2	141.9	174.7	-55.1	174.5	0	0	0	111.2	V268 I281 S300 F304 S305 Q306 L431 Y451 F453	V268-L302 HydrophobicContact CB-CD1 4.21Å; V268-L302 HydrophobicContact CG1-CD1 4.08Å; V268-L302 HydrophobicContact CG2-CD1 3.99Å; I281-L302 HydrophobicContact CD1-CD1 4.01Å; S300-L302 VanDerWaalsContact C-N 3.32Å; S300-L302 WeakPolarHBondContact OG-CB 3.43Å; S300-L302 WeakPolarHBondContact OG-CG 3.41Å; S300-L302 PolarHBondContact OG-N 3.48Å; L302-F304 HydrophobicContact CB-CD1 4.07Å; L302-F304 HydrophobicContact CB-CE1 3.77Å; L302-F304 HydrophobicContact CB-CZ 4.31Å; L302-F304 HydrophobicContact CD1-CE1 3.59Å; L302-F304 HydrophobicContact CD1-CZ 3.64Å; L302-F304 HydrophobicContact CG-CE1 4.28Å; L302-F304 PolarHBondContact O-N 3.48Å; L302-S305 PolarHBondContact O-OG 2.96Å; L302-Q306 PolarHBondContact O-NE2 2.88Å; L302-L431 HydrophobicContact CD2-CD2 4.06Å; L302-Y451 HydrophobicContact CD1-CD1 3.8Å; L302-Y451 HydrophobicContact CD1-CE1 4.03Å; L302-Y451 HydrophobicContact CD2-CD1 3.68Å; L302-Y451 HydrophobicContact CD2-CE1 4.06Å; L302-Y451 HydrophobicContact CD2-CG 3.95Å; L302-Y451 HydrophobicContact CG-CD1 3.69Å; L302-Y451 HydrophobicContact CG-CE1 3.68Å; L302-Y451 HydrophobicContact CG-CG 4.44Å; L302-F453 HydrophobicContact CD2-CE1 4.37Å; L302-F453 HydrophobicContact CD2-CZ 4.09Å
303	P	87.6	Confident	86.1	Confident	5 Å²	5	37.6 Å²	37.6	3%	0.032	23%	0.229	C	C	.	.	S	Bend	trans	-59.6	-47.6	-174.9	-21.9	30.3	0	0	0	113.9	S305 Q306 G347 I368 L369 K371	P303-S305 VanDerWaalsContact C-N 3.25Å; P303-S305 PolarHBondContact O-N 2.82Å; P303-S305 VanDerWaalsContact O-N 3.16Å; P303-Q306 WeakPolarHBondContact O-CB 3.49Å; P303-Q306 PolarHBondContact O-N 3.42Å; P303-G347 CarbonylContact O-C 3.59Å; P303-G347 VanDerWaalsContact O-CA 3.25Å; P303-G347 WeakPolarHBondContact O-CA 3.34Å; P303-I368 WeakPolarHBondContact CB-O 3.26Å; P303-I368 WeakPolarHBondContact CD-O 3.44Å; P303-I368 WeakPolarHBondContact CG-O 3.41Å; P303-L369 WeakPolarHBondContact CD-O 3.45Å; P303-K371 HydrophobicContact CG-CG 4.12Å
304	F	90.2	Very high	85.8	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-34	-173.4	61.4	-94.2	0	0	0	114.7	I281 L283 F294 L302 Q306 T348 I368	I281-F304 HydrophobicContact CG2-CE2 3.43Å; I281-F304 VanDerWaalsContact CG2-CE2 3.43Å; I281-F304 HydrophobicContact CG2-CZ 3.54Å; L283-F304 HydrophobicContact CB-CE1 4.33Å; L283-F304 HydrophobicContact CB-CE2 4.19Å; L283-F304 HydrophobicContact CB-CZ 4Å; L283-F304 HydrophobicContact CD1-CD2 4.23Å; L283-F304 HydrophobicContact CD1-CG 4.27Å; L283-F304 HydrophobicContact CD2-CD1 3.82Å; L283-F304 HydrophobicContact CD2-CE1 3.9Å; L283-F304 HydrophobicContact CD2-CG 4.25Å; L283-F304 HydrophobicContact CD2-CZ 4.4Å; F294-F304 HydrophobicContact CB-CD2 3.84Å; F294-F304 HydrophobicContact CB-CE2 3.84Å; F294-F304 HydrophobicContact CD1-CD2 4.13Å; F294-F304 AromaticContact CD2-CD2 3.76Å; F294-F304 HydrophobicContact CD2-CD2 3.76Å; F294-F304 HydrophobicContact CD2-CE2 4.23Å; F294-F304 HydrophobicContact CE2-CD2 4.33Å; F294-F304 AromaticContact CG-CD2 3.63Å; F294-F304 HydrophobicContact CG-CD2 3.63Å; F294-F304 HydrophobicContact CG-CE2 4.11Å; F294-F304 VanDerWaalsContact CZ-O 3.28Å; F294-F304 WeakPolarHBondContact CZ-O 3.5Å; L302-F304 HydrophobicContact CB-CD1 4.07Å; L302-F304 HydrophobicContact CB-CE1 3.77Å; L302-F304 HydrophobicContact CB-CZ 4.31Å; L302-F304 HydrophobicContact CD1-CE1 3.59Å; L302-F304 HydrophobicContact CD1-CZ 3.64Å; L302-F304 HydrophobicContact CG-CE1 4.28Å; L302-F304 PolarHBondContact O-N 3.48Å; F304-Q306 VanDerWaalsContact C-N 3.29Å; F304-Q306 PolarHBondContact O-N 3.32Å; F304-T348 HydrophobicContact CB-CG2 3.72Å; F304-I368 HydrophobicContact CB-CD1 4.2Å; F304-I368 HydrophobicContact CB-CG1 3.67Å; F304-I368 WeakPolarHBondContact CD1-O 3.09Å; F304-I368 PolarHBondContact N-O 3.2Å
305	S	88	Confident	85.8	Confident	6 Å²	6	44.4 Å²	44.4	4%	0.042	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-5.7	178	37	0	0	0	0	114.7	S300 L302 P303	S300-S305 WeakPolarHBondContact CB-OG 3.33Å; S300-S305 PolarHBondContact OG-OG 3.01Å; L302-S305 PolarHBondContact O-OG 2.96Å; P303-S305 VanDerWaalsContact C-N 3.25Å; P303-S305 PolarHBondContact O-N 2.82Å; P303-S305 VanDerWaalsContact O-N 3.16Å
306	Q	87.5	Confident	85.9	Confident	47 Å²	47	44.1 Å²	44.1	22%	0.22	26%	0.258	C	S	.	.			trans	-93.8	155.9	-173.6	-74.2	167.7	9.6	0	0	113.9	S300 V301 L302 P303 F304 L308 G347	S300-Q306 PolarHBondContact O-NE2 2.88Å; V301-Q306 VanDerWaalsContact CA-NE2 3.26Å; V301-Q306 PolarHBondContact O-NE2 2.87Å; L302-Q306 PolarHBondContact O-NE2 2.88Å; P303-Q306 WeakPolarHBondContact O-CB 3.49Å; P303-Q306 PolarHBondContact O-N 3.42Å; F304-Q306 VanDerWaalsContact C-N 3.29Å; F304-Q306 PolarHBondContact O-N 3.32Å; Q306-L308 VanDerWaalsContact C-N 3.29Å; Q306-L308 PolarHBondContact O-N 2.94Å; Q306-G347 PolarHBondContact O-N 3.04Å
307	G	85.4	Confident	86.1	Confident	37 Å²	37	44 Å²	44	38%	0.381	26%	0.257	S	S	.	.	S	Bend	trans	77.1	12.1	175.3	0	0	0	0	0	114.9	T345	G307-T345 WeakPolarHBondContact CA-O 3.47Å; G307-T345 PolarHBondContact O-OG1 3.5Å
308	L	88.3	Confident	86.7	Confident	25 Å²	25	42.5 Å²	42.5	13%	0.131	25%	0.25	C	C	.	.			trans	-101.2	138.2	172.9	-56.3	-179.6	0	0	0	110.2	F294 Q306 L310 V317 P343 A346	F294-L308 HydrophobicContact CE2-CD1 3.68Å; F294-L308 HydrophobicContact CZ-CD1 3.79Å; Q306-L308 VanDerWaalsContact C-N 3.29Å; Q306-L308 PolarHBondContact O-N 2.94Å; L308-L310 HydrophobicContact CB-CD1 4.37Å; L308-L310 HydrophobicContact CB-CG 4.33Å; L308-L310 HydrophobicContact CD1-CD1 4.24Å; L308-V317 HydrophobicContact CD1-CG1 4.15Å; L308-V317 HydrophobicContact CD1-CG2 4.2Å; L308-P343 HydrophobicContact CD2-CG 4.17Å; L308-A346 HydrophobicContact CD2-CB 3.96Å
309	N	86.2	Confident	87.7	Confident	168 Å²	168	37.8 Å²	37.8	90%	0.898	23%	0.225	S	C	*	.			trans	-106.8	72.7	175.4	-169.8	16.9	0	0	0	109.8
310	L	89.9	Confident	88.8	Confident	28 Å²	28	34.8 Å²	34.8	15%	0.147	20%	0.204	C	C	.	.			trans	-117	146.6	-178.4	-64.7	178	0	0	0	109.9	N298 L308 Y315 V317 V328	N298-L310 PolarHBondContact ND2-O 3.13Å; N298-L310 PolarHBondContact OD1-O 2.94Å; L308-L310 HydrophobicContact CB-CD1 4.37Å; L308-L310 HydrophobicContact CB-CG 4.33Å; L308-L310 HydrophobicContact CD1-CD1 4.24Å; L310-Y315 HydrophobicContact CB-CD2 4.3Å; L310-V317 HydrophobicContact CD1-CG2 3.4Å; L310-V317 VanDerWaalsContact CD1-CG2 3.4Å; L310-V328 HydrophobicContact CD1-CG1 4.22Å; L310-V328 HydrophobicContact CD1-CG2 4.46Å; L310-V328 HydrophobicContact CD2-CG1 4.11Å; L310-V328 HydrophobicContact CD2-CG2 4.24Å
311	S	86	Confident	89.7	Confident	96 Å²	96	34.6 Å²	34.6	67%	0.671	20%	0.202	S	C	*	.	S	Bend	trans	-91	-41.9	-172.5	50.6	0	0	0	0	114.5
312	S	88.3	Confident	90.4	Very high	21 Å²	21	34 Å²	34	15%	0.147	20%	0.198	C	C	.	.			trans	-97.3	139.4	-176	-176	0	0	0	0	112.5	N296 E314	N296-S312 PolarHBondContact ND2-O 3.14Å; S312-E314 PolarHBondContact O-N 2.81Å; S312-E314 WeakPolarHBondContact OG-CB 3.31Å; S312-E314 PolarHBondContact OG-N 2.99Å
313	P	84.7	Confident	90.8	Very high	82 Å²	82	34.4 Å²	34.4	53%	0.532	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-14.7	167.5	32.7	-35.9	0	0	0	112.9	N296 Y315	N296-P313 CarbonylContact O-C 3.51Å; N296-P313 WeakPolarHBondContact O-CA 3.16Å; P313-Y315 PolarHBondContact O-N 3.14Å
314	E	87.8	Confident	91.2	Very high	103 Å²	103	34.2 Å²	34.2	48%	0.481	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-4.4	178.6	-55.7	-178.8	131.9	0	0	113.1	S312 G331 P332	S312-E314 PolarHBondContact O-N 2.81Å; S312-E314 WeakPolarHBondContact OG-CB 3.31Å; S312-E314 PolarHBondContact OG-N 2.99Å; E314-G331 WeakPolarHBondContact O-CA 3.33Å; E314-G331 PolarHBondContact O-N 3.37Å; E314-P332 HydrophobicContact CB-CG 4.14Å; E314-P332 HydrophobicContact CG-CG 4.36Å
315	Y	93.4	Very high	91.5	Very high	42 Å²	42	34.2 Å²	34.2	17%	0.165	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	126	179.6	-65	-11.5	0	0	0	111.2	N296 L310 P313 V328 I329 N330 V337	N296-Y315 VanDerWaalsContact CB-O 3.3Å; N296-Y315 WeakPolarHBondContact CB-O 3.41Å; N296-Y315 PolarHBondContact N-O 2.93Å; L310-Y315 HydrophobicContact CB-CD2 4.3Å; P313-Y315 PolarHBondContact O-N 3.14Å; Y315-V328 HydrophobicContact CD2-CG1 3.99Å; Y315-V328 HydrophobicContact CG-CG1 4.15Å; Y315-I329 CarbonylContact C-O 3.57Å; Y315-I329 VanDerWaalsContact CA-O 3.31Å; Y315-I329 WeakPolarHBondContact CA-O 3.2Å; Y315-N330 HydrophobicContact CD1-CB 4.28Å; Y315-N330 HydrophobicContact CE1-CB 4.24Å; Y315-V337 HydrophobicContact CD1-CG2 4.19Å; Y315-V337 HydrophobicContact CE1-CG2 3.88Å; Y315-V337 HydrophobicContact CE2-CG1 4.27Å
316	V	94.3	Very high	91.9	Very high	21 Å²	21	34.4 Å²	34.4	13%	0.127	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	125.3	167.8	-175.1	0	0	0	0	107.9	F294 I329 M814	F294-V316 WeakPolarHBondContact O-CA 3.33Å; V316-I329 PolarHBondContact N-O 3.39Å; V316-I329 PolarHBondContact O-N 3.49Å; V316-M814 HydrophobicContact CG2-CE 3.93Å
317	V	95.4	Very high	92.4	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	124.4	-179.5	-171.2	0	0	0	0	108.1	S293 F294 N296 L308 L310 H319 Q326 Y327	S293-V317 CarbonylContact C-O 3.58Å; S293-V317 VanDerWaalsContact CA-O 3.29Å; S293-V317 WeakPolarHBondContact CA-O 3.27Å; F294-V317 HydrophobicContact CD2-CB 4.37Å; F294-V317 HydrophobicContact CE1-CB 4.44Å; F294-V317 HydrophobicContact CE2-CB 3.94Å; F294-V317 HydrophobicContact CE2-CG1 4.42Å; F294-V317 HydrophobicContact CE2-CG2 4.3Å; F294-V317 HydrophobicContact CZ-CB 3.98Å; F294-V317 HydrophobicContact CZ-CG1 4.04Å; F294-V317 PolarHBondContact N-O 3.39Å; F294-V317 PolarHBondContact O-N 3.49Å; N296-V317 HydrophobicContact CB-CG2 4.28Å; L308-V317 HydrophobicContact CD1-CG1 4.15Å; L308-V317 HydrophobicContact CD1-CG2 4.2Å; L310-V317 HydrophobicContact CD1-CG2 3.4Å; L310-V317 VanDerWaalsContact CD1-CG2 3.4Å; V317-H319 WeakPolarHBondContact CG1-NE2 3.41Å; V317-Q326 HydrophobicContact CG1-CG 3.79Å; V317-Y327 WeakPolarHBondContact CA-O 3.38Å
318	T	96.6	Very high	92.9	Very high	2 Å²	2	30.5 Å²	30.5	1%	0.012	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	121.6	172.6	-64.8	0	0	0	0	109.9	A292 S293 Q326 Y327 F466 V468 L517	A292-T318 CarbonylContact O-C 3.45Å; A292-T318 WeakPolarHBondContact O-CA 3.45Å; S293-T318 WeakPolarHBondContact CB-OG1 3.22Å; S293-T318 PolarHBondContact OG-OG1 2.88Å; T318-Q326 CarbonylContact O-C 3.56Å; T318-Q326 WeakPolarHBondContact O-CA 3.43Å; T318-Y327 HydrophobicContact CG2-CD2 4.45Å; T318-Y327 PolarHBondContact N-O 3.27Å; T318-Y327 PolarHBondContact O-N 2.87Å; T318-F466 HydrophobicContact CG2-CD1 4.16Å; T318-V468 HydrophobicContact CG2-CG1 3.94Å; T318-L517 HydrophobicContact CG2-CD1 4.09Å
319	H	96.8	Very high	93.2	Very high	0 Å²	0	30 Å²	30	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	127.5	171.5	-62.2	160.5	0	0	0	110.4	L291 A292 F294 V317 F321 Q326 I342 T348	L291-H319 WeakPolarHBondContact CA-O 3.41Å; A292-H319 PolarHBondContact N-O 2.9Å; A292-H319 VanDerWaalsContact N-O 3.14Å; A292-H319 PolarHBondContact O-N 3.41Å; F294-H319 AromaticContact CE1-CE1 3.96Å; F294-H319 AromaticContact CE1-ND1 3.98Å; F294-H319 AromaticContact CZ-CE1 3.75Å; V317-H319 WeakPolarHBondContact CG1-NE2 3.41Å; H319-F321 HydrophobicContact CB-CD2 4.09Å; H319-F321 HydrophobicContact CB-CE2 3.77Å; H319-Q326 PolarHBondContact NE2-OE1 2.94Å; H319-I342 HydrophobicContact CB-CD1 3.95Å; H319-I342 HydrophobicContact CB-CG1 4.26Å; H319-T348 PolarHBondContact ND1-OG1 3.35Å
320	D	96.1	Very high	93.5	Very high	1 Å²	1	23.7 Å²	23.7	1%	0.005	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	104.2	171	175.4	-4.5	0	0	0	108.9	L291 D322 S323 G324 L325 Y327 I342 S515 L517	L291-D320 HydrophobicContact CD2-CB 3.91Å; D320-D322 VanDerWaalsContact C-N 3.28Å; D320-D322 PolarHBondContact O-N 3.14Å; D320-D322 WeakPolarHBondContact OD1-CB 3.46Å; D320-D322 PolarHBondContact OD1-N 2.67Å; D320-S323 WeakPolarHBondContact CB-OG 3.18Å; D320-S323 PolarHBondContact OD1-N 2.64Å; D320-S323 VanDerWaalsContact OD1-N 3.14Å; D320-S323 PolarHBondContact OD2-OG 2.94Å; D320-G324 CarbonylContact O-C 3.57Å; D320-G324 VanDerWaalsContact O-CA 3.28Å; D320-G324 WeakPolarHBondContact O-CA 3.4Å; D320-G324 PolarHBondContact O-N 2.82Å; D320-L325 PolarHBondContact N-O 3.26Å; D320-L325 PolarHBondContact O-N 2.94Å; D320-Y327 HydrophobicContact CB-CE2 4.15Å; D320-I342 WeakPolarHBondContact O-CD1 3.19Å; D320-S515 WeakPolarHBondContact OD2-CB 3.25Å; D320-S515 PolarHBondContact OD2-OG 3.13Å; D320-L517 HydrophobicContact CB-CD1 3.82Å
321	F	96	Very high	93.3	Very high	3 Å²	3	23.3 Å²	23.3	1%	0.013	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-4.7	-179.5	-80.6	-115.8	0	0	0	113.5	R290 H319 I342 T348 L360 F362 T548	R290-F321 HydrophobicContact CB-CB 3.87Å; R290-F321 WeakPolarHBondContact O-CB 3.4Å; R290-F321 PolarHBondContact O-N 3.47Å; R290-F321 VanDerWaalsContact O-N 3.15Å; H319-F321 HydrophobicContact CB-CD2 4.09Å; H319-F321 HydrophobicContact CB-CE2 3.77Å; F321-I342 HydrophobicContact CD2-CD1 3.72Å; F321-I342 HydrophobicContact CE2-CD1 3.8Å; F321-I342 HydrophobicContact CG-CD1 4.18Å; F321-I342 HydrophobicContact CZ-CD1 4.34Å; F321-I342 HydrophobicContact CZ-CG2 4.42Å; F321-T348 WeakPolarHBondContact CE2-OG1 3.21Å; F321-L360 HydrophobicContact CE1-CB 4.48Å; F321-L360 HydrophobicContact CE1-CD2 3.73Å; F321-L360 HydrophobicContact CE1-CG 3.86Å; F321-L360 HydrophobicContact CZ-CD2 3.9Å; F321-L360 HydrophobicContact CZ-CG 4.42Å; F321-F362 HydrophobicContact CB-CD2 4.4Å; F321-F362 HydrophobicContact CD1-CB 3.85Å; F321-F362 AromaticContact CD1-CD2 3.88Å; F321-F362 HydrophobicContact CD1-CD2 3.88Å; F321-F362 HydrophobicContact CD1-CG 4.32Å; F321-F362 AromaticContact CD2-CD2 3.43Å; F321-F362 HydrophobicContact CD2-CD2 3.43Å; F321-F362 VanDerWaalsContact CD2-CD2 3.43Å; F321-F362 AromaticContact CD2-CE2 3.79Å; F321-F362 HydrophobicContact CD2-CE2 3.79Å; F321-F362 HydrophobicContact CD2-CG 4.44Å; F321-F362 HydrophobicContact CE1-CB 4.22Å; F321-F362 AromaticContact CE1-CD2 3.94Å; F321-F362 HydrophobicContact CE1-CD2 3.94Å; F321-F362 AromaticContact CE2-CD2 3.52Å; F321-F362 HydrophobicContact CE2-CD2 3.52Å; F321-F362 AromaticContact CE2-CE2 3.84Å; F321-F362 HydrophobicContact CE2-CE2 3.84Å; F321-F362 HydrophobicContact CG-CB 4.19Å; F321-F362 AromaticContact CG-CD2 3.64Å; F321-F362 HydrophobicContact CG-CD2 3.64Å; F321-F362 HydrophobicContact CG-CE2 4.4Å; F321-F362 HydrophobicContact CG-CG 4.25Å; F321-F362 AromaticContact CZ-CD2 3.79Å; F321-F362 HydrophobicContact CZ-CD2 3.79Å; F321-F362 HydrophobicContact CZ-CE2 4.46Å; F321-T548 HydrophobicContact CB-CG2 4.05Å; F321-T548 HydrophobicContact CD1-CG2 3.69Å; F321-T548 HydrophobicContact CE1-CG2 4.49Å; F321-T548 HydrophobicContact CG-CG2 4.12Å; F321-T548 VanDerWaalsContact O-CB 3.25Å; F321-T548 WeakPolarHBondContact O-CB 3.14Å; F321-T548 VanDerWaalsContact O-CG2 3.3Å; F321-T548 WeakPolarHBondContact O-CG2 3.41Å; F321-T548 PolarHBondContact O-OG1 2.92Å
322	D	94.2	Very high	93.4	Very high	28 Å²	28	22.1 Å²	22.1	15%	0.15	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-41.9	173.3	-79.2	22.4	0	0	0	110.5	R290 D320 Q552	R290-D322 IonicContact CZ-OD1 2.84Å; R290-D322 IonicContact CZ-OD2 2.76Å; R290-D322 IonicContact NE-OD1 2.71Å; R290-D322 PolarHBondContact NE-OD1 3.23Å; R290-D322 IonicContact NH2-OD1 2.63Å; R290-D322 PolarHBondContact NH2-OD1 2.97Å; R290-D322 IonicContact NH2-OD2 2.64Å; R290-D322 PolarHBondContact NH2-OD2 3.25Å; D320-D322 VanDerWaalsContact C-N 3.28Å; D320-D322 PolarHBondContact O-N 3.14Å; D320-D322 WeakPolarHBondContact OD1-CB 3.46Å; D320-D322 PolarHBondContact OD1-N 2.67Å; D322-Q552 PolarHBondContact O-N 3.24Å
323	S	94.2	Very high	93.3	Very high	8 Å²	8	23.7 Å²	23.7	6%	0.056	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88	-15.6	172.6	64.6	0	0	0	0	114.2	D320 L325 F551	D320-S323 WeakPolarHBondContact CB-OG 3.18Å; D320-S323 PolarHBondContact OD1-N 2.64Å; D320-S323 VanDerWaalsContact OD1-N 3.14Å; D320-S323 PolarHBondContact OD2-OG 2.94Å; S323-L325 VanDerWaalsContact C-N 3.34Å; S323-F551 WeakPolarHBondContact O-CE2 3.49Å
324	G	95.9	Very high	93.5	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.6	18	-176.4	0	0	0	0	0	114.3	D320 I342 G545 T546	D320-G324 CarbonylContact O-C 3.57Å; D320-G324 VanDerWaalsContact O-CA 3.28Å; D320-G324 WeakPolarHBondContact O-CA 3.4Å; D320-G324 PolarHBondContact O-N 2.82Å; G324-I342 PolarHBondContact O-N 2.94Å; G324-G545 CarbonylContact O-C 3.57Å; G324-G545 WeakPolarHBondContact O-CA 3.41Å; G324-T546 VanDerWaalsContact CA-O 3.31Å; G324-T546 WeakPolarHBondContact CA-O 3.4Å; G324-T546 PolarHBondContact O-N 2.89Å
325	L	96.8	Very high	93.7	Very high	1 Å²	1	21 Å²	21	1%	0.005	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	144.4	-170.4	-64.9	174.7	0	0	0	113.3	D320 S323 Y327 I342 V543 E554	D320-L325 PolarHBondContact N-O 3.26Å; D320-L325 PolarHBondContact O-N 2.94Å; S323-L325 VanDerWaalsContact C-N 3.34Å; L325-Y327 HydrophobicContact CB-CE2 4.04Å; L325-I342 VanDerWaalsContact C-CG1 3.45Å; L325-I342 WeakPolarHBondContact O-CG1 3.12Å; L325-V543 HydrophobicContact CD2-CB 3.87Å; L325-V543 HydrophobicContact CD2-CG1 3.8Å; L325-E554 HydrophobicContact CD1-CG 4.23Å
326	Q	96.6	Very high	93.8	Very high	9 Å²	9	21.1 Å²	21.1	4%	0.042	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	122	168.6	171.5	-175.6	-51.4	0	0	108.5	V317 T318 H319 V328 V339 T340 I342	V317-Q326 HydrophobicContact CG1-CG 3.79Å; T318-Q326 CarbonylContact O-C 3.56Å; T318-Q326 WeakPolarHBondContact O-CA 3.43Å; H319-Q326 PolarHBondContact NE2-OE1 2.94Å; Q326-V328 HydrophobicContact CG-CG2 3.97Å; Q326-V339 WeakPolarHBondContact O-CA 3.5Å; Q326-T340 PolarHBondContact N-O 3.42Å; Q326-T340 PolarHBondContact O-N 2.86Å; Q326-I342 HydrophobicContact CB-CG1 4.17Å
327	Y	96.6	Very high	93.8	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	131.5	170	-54.1	-90.7	0	0	0	108.7	V317 T318 D320 L325 V339 V468 C471 L472 L517	V317-Y327 WeakPolarHBondContact CA-O 3.38Å; T318-Y327 HydrophobicContact CG2-CD2 4.45Å; T318-Y327 PolarHBondContact N-O 3.27Å; T318-Y327 PolarHBondContact O-N 2.87Å; D320-Y327 HydrophobicContact CB-CE2 4.15Å; L325-Y327 HydrophobicContact CB-CE2 4.04Å; Y327-V339 HydrophobicContact CD1-CG1 3.94Å; Y327-V339 HydrophobicContact CD1-CG2 3.85Å; Y327-V339 HydrophobicContact CE1-CG1 3.96Å; Y327-V339 HydrophobicContact CE1-CG2 4.36Å; Y327-V468 HydrophobicContact CD1-CB 4.05Å; Y327-V468 HydrophobicContact CD1-CG1 4.39Å; Y327-V468 HydrophobicContact CD1-CG2 4.22Å; Y327-V468 HydrophobicContact CD2-CB 4.37Å; Y327-V468 HydrophobicContact CD2-CG1 3.94Å; Y327-V468 HydrophobicContact CD2-CG2 4.38Å; Y327-V468 HydrophobicContact CE1-CG2 4.26Å; Y327-V468 HydrophobicContact CE2-CG2 4.41Å; Y327-V468 HydrophobicContact CG-CB 3.94Å; Y327-V468 HydrophobicContact CG-CG1 3.77Å; Y327-V468 HydrophobicContact CG-CG2 4.28Å; Y327-C471 HydrophobicContact CD1-CB 3.84Å; Y327-L472 HydrophobicContact CE1-CD2 4.1Å; Y327-L517 HydrophobicContact CD2-CD1 4.31Å; Y327-L517 HydrophobicContact CE2-CD1 3.83Å
328	V	96	Very high	93.7	Very high	2 Å²	2	27.4 Å²	27.4	1%	0.012	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	119.1	177.4	-171.8	0	0	0	0	108.8	L310 Y315 Q326 V337 N338	L310-V328 HydrophobicContact CD1-CG1 4.22Å; L310-V328 HydrophobicContact CD1-CG2 4.46Å; L310-V328 HydrophobicContact CD2-CG1 4.11Å; L310-V328 HydrophobicContact CD2-CG2 4.24Å; Y315-V328 HydrophobicContact CD2-CG1 3.99Å; Y315-V328 HydrophobicContact CG-CG1 4.15Å; Q326-V328 HydrophobicContact CG-CG2 3.97Å; V328-V337 HydrophobicContact CB-CB 4.36Å; V328-V337 HydrophobicContact CG1-CB 4.09Å; V328-V337 PolarHBondContact O-N 2.87Å; V328-N338 PolarHBondContact N-O 3.44Å; V328-N338 PolarHBondContact O-N 2.89Å
329	I	94.8	Very high	93.7	Very high	14 Å²	14	28.4 Å²	28.4	7%	0.072	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	134.5	-174	-62.2	166.2	0	0	0	108.8	Y315 V316 G331 T335 V468	Y315-I329 CarbonylContact C-O 3.57Å; Y315-I329 VanDerWaalsContact CA-O 3.31Å; Y315-I329 WeakPolarHBondContact CA-O 3.2Å; V316-I329 PolarHBondContact N-O 3.39Å; V316-I329 PolarHBondContact O-N 3.49Å; I329-G331 PolarHBondContact O-N 3.03Å; I329-T335 CarbonylContact C-O 3.6Å; I329-T335 WeakPolarHBondContact CA-O 3.13Å; I329-V468 HydrophobicContact CD1-CB 4.24Å; I329-V468 HydrophobicContact CD1-CG1 4.12Å
330	N	93	Very high	93.6	Very high	37 Å²	37	30 Å²	30	20%	0.198	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	108.8	171.7	-176.5	-4.5	0	0	0	108.6	Y315 P332 A333 A334 T335 V337	Y315-N330 HydrophobicContact CD1-CB 4.28Å; Y315-N330 HydrophobicContact CE1-CB 4.24Å; N330-P332 WeakPolarHBondContact OD1-CD 3.47Å; N330-A333 HydrophobicContact CB-CB 4.21Å; N330-A333 PolarHBondContact O-N 3.35Å; N330-A334 VanDerWaalsContact O-CA 3.31Å; N330-A334 WeakPolarHBondContact O-CA 3.32Å; N330-A334 PolarHBondContact O-N 2.84Å; N330-T335 PolarHBondContact N-O 3.48Å; N330-T335 PolarHBondContact O-N 3.49Å; N330-V337 HydrophobicContact CB-CG2 3.78Å
331	G	86.2	Confident	93.6	Very high	19 Å²	19	32.5 Å²	32.5	20%	0.196	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-58.8	-170.5	0	0	0	0	0	113.8	E314 I329 A333 A334	E314-G331 WeakPolarHBondContact O-CA 3.33Å; E314-G331 PolarHBondContact O-N 3.37Å; I329-G331 PolarHBondContact O-N 3.03Å; G331-A333 VanDerWaalsContact C-N 3.3Å; G331-A333 PolarHBondContact O-N 2.87Å; G331-A334 PolarHBondContact O-N 3.21Å
332	P	87	Confident	93.7	Very high	72 Å²	72	32.3 Å²	32.3	47%	0.468	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-34.6	178.9	-27.3	35.5	0	0	0	114.6	E314 N330	E314-P332 HydrophobicContact CB-CG 4.14Å; E314-P332 HydrophobicContact CG-CG 4.36Å; N330-P332 WeakPolarHBondContact OD1-CD 3.47Å
333	A	87.9	Confident	93.7	Very high	54 Å²	54	32.8 Å²	32.8	45%	0.446	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-12.6	-179.2	0	0	0	0	0	113.9	N330 G331 T335	N330-A333 HydrophobicContact CB-CB 4.21Å; N330-A333 PolarHBondContact O-N 3.35Å; G331-A333 VanDerWaalsContact C-N 3.3Å; G331-A333 PolarHBondContact O-N 2.87Å; A333-T335 HydrophobicContact CB-CG2 4.32Å; A333-T335 PolarHBondContact O-N 2.89Å; A333-T335 VanDerWaalsContact O-N 3.08Å
334	A	87.9	Confident	93.6	Very high	54 Å²	54	37.6 Å²	37.6	45%	0.446	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.1	19.8	-167.5	0	0	0	0	0	115.1	N330 G331 T470	N330-A334 VanDerWaalsContact O-CA 3.31Å; N330-A334 WeakPolarHBondContact O-CA 3.32Å; N330-A334 PolarHBondContact O-N 2.84Å; G331-A334 PolarHBondContact O-N 3.21Å; A334-T470 VanDerWaalsContact O-CB 3.24Å; A334-T470 WeakPolarHBondContact O-CB 3.42Å; A334-T470 WeakPolarHBondContact O-CG2 3.3Å; A334-T470 PolarHBondContact O-OG1 3.33Å
335	T	92.3	Very high	93.3	Very high	73 Å²	73	42.3 Å²	42.3	45%	0.448	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	142.9	-178.1	48.9	0	0	0	0	112.1	I329 N330 A333 V337	I329-T335 CarbonylContact C-O 3.6Å; I329-T335 WeakPolarHBondContact CA-O 3.13Å; N330-T335 PolarHBondContact N-O 3.48Å; N330-T335 PolarHBondContact O-N 3.49Å; A333-T335 HydrophobicContact CB-CG2 4.32Å; A333-T335 PolarHBondContact O-N 2.89Å; A333-T335 VanDerWaalsContact O-N 3.08Å; T335-V337 PolarHBondContact O-N 3.48Å
336	C	94.8	Very high	93.1	Very high	46 Å²	46	42.3 Å²	42.3	31%	0.311	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	131.4	168.9	-166.3	0	0	0	0	110.4	T470 C471	C336-T470 WeakPolarHBondContact CB-O 3Å; C336-C471 HydrophobicContact CB-CB 3.81Å; C336-C471 WeakPolarHBondContact CB-SG 3.4Å; C336-C471 WeakPolarHBondContact SG-CA 3.39Å; C336-C471 WeakPolarHBondContact SG-CB 3.18Å; C336-C471 CovalentContact SG-SG 2.03Å; C336-C471 PolarHBondContact SG-SG 3.5Å
337	V	94.3	Very high	92.9	Very high	66 Å²	66	42.1 Å²	42.1	40%	0.4	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	-46.5	173.5	-179.4	0	0	0	0	109.9	Y315 V328 N330 T335	Y315-V337 HydrophobicContact CD1-CG2 4.19Å; Y315-V337 HydrophobicContact CE1-CG2 3.88Å; Y315-V337 HydrophobicContact CE2-CG1 4.27Å; V328-V337 HydrophobicContact CB-CB 4.36Å; V328-V337 HydrophobicContact CG1-CB 4.09Å; V328-V337 PolarHBondContact O-N 2.87Å; N330-V337 HydrophobicContact CB-CG2 3.78Å; T335-V337 PolarHBondContact O-N 3.48Å
338	N	94.2	Very high	92.8	Very high	86 Å²	86	42.1 Å²	42.1	46%	0.46	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.2	159.7	179.4	-154.4	-4.7	0	0	0	112.3	V328 T340	V328-N338 PolarHBondContact N-O 3.44Å; V328-N338 PolarHBondContact O-N 2.89Å; N338-T340 HydrophobicContact CB-CG2 4.43Å; N338-T340 WeakPolarHBondContact ND2-CG2 3.44Å
339	V	96	Very high	92.6	Very high	23 Å²	23	42.4 Å²	42.4	14%	0.139	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	123.8	164.2	-174.6	0	0	0	0	107.9	Q326 Y327 C471 V543	Q326-V339 WeakPolarHBondContact O-CA 3.5Å; Y327-V339 HydrophobicContact CD1-CG1 3.94Å; Y327-V339 HydrophobicContact CD1-CG2 3.85Å; Y327-V339 HydrophobicContact CE1-CG1 3.96Å; Y327-V339 HydrophobicContact CE1-CG2 4.36Å; V339-C471 HydrophobicContact CG2-CB 3.72Å; V339-V543 HydrophobicContact CG1-CG2 4.38Å
340	T	95.9	Very high	92.5	Very high	33 Å²	33	45.6 Å²	45.6	20%	0.202	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	164.2	-175	61.6	0	0	0	0	110.9	Q326 N338	Q326-T340 PolarHBondContact N-O 3.42Å; Q326-T340 PolarHBondContact O-N 2.86Å; N338-T340 HydrophobicContact CB-CG2 4.43Å; N338-T340 WeakPolarHBondContact ND2-CG2 3.44Å
341	P	95.9	Very high	92.4	Very high	54 Å²	54	48.9 Å²	48.9	35%	0.351	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.3	148.8	156	24.8	-34.5	0	0	0	110.8	P343 T546	P341-P343 WeakPolarHBondContact O-CD 3.48Å; P341-T546 WeakPolarHBondContact CB-OG1 3.38Å
342	I	96.5	Very high	92.5	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-65.1	122.1	172	-61.1	165.3	0	0	0	108.8	H319 D320 F321 G324 L325 Q326 L344 A346 L360 T546	H319-I342 HydrophobicContact CB-CD1 3.95Å; H319-I342 HydrophobicContact CB-CG1 4.26Å; D320-I342 WeakPolarHBondContact O-CD1 3.19Å; F321-I342 HydrophobicContact CD2-CD1 3.72Å; F321-I342 HydrophobicContact CE2-CD1 3.8Å; F321-I342 HydrophobicContact CG-CD1 4.18Å; F321-I342 HydrophobicContact CZ-CD1 4.34Å; F321-I342 HydrophobicContact CZ-CG2 4.42Å; G324-I342 PolarHBondContact O-N 2.94Å; L325-I342 VanDerWaalsContact C-CG1 3.45Å; L325-I342 WeakPolarHBondContact O-CG1 3.12Å; Q326-I342 HydrophobicContact CB-CG1 4.17Å; I342-L344 PolarHBondContact O-N 2.9Å; I342-A346 HydrophobicContact CG2-CB 3.88Å; I342-L360 HydrophobicContact CB-CD2 4.28Å; I342-L360 HydrophobicContact CG2-CD2 3.6Å; I342-T546 PolarHBondContact N-OG1 3.03Å; I342-T546 WeakPolarHBondContact O-CB 3.44Å; I342-T546 PolarHBondContact O-OG1 2.81Å
343	P	94.4	Very high	92.4	Very high	37 Å²	37	48.7 Å²	48.7	24%	0.24	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-56.3	138.1	178.9	-26.1	34.2	0	0	0	112	L308 P341 T345 A346	L308-P343 HydrophobicContact CD2-CG 4.17Å; P341-P343 WeakPolarHBondContact O-CD 3.48Å; P343-T345 PolarHBondContact O-N 3.12Å; P343-A346 HydrophobicContact CB-CB 4.25Å; P343-A346 WeakPolarHBondContact O-CB 3.44Å; P343-A346 PolarHBondContact O-N 3.45Å
344	L	92.2	Very high	91.9	Very high	110 Å²	110	53.8 Å²	53.8	58%	0.576	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-15.4	175.5	-62.2	177.4	0	0	0	113	I342 L351 T546	I342-L344 PolarHBondContact O-N 2.9Å; L344-L351 HydrophobicContact CD2-CD1 4.25Å; L344-T546 HydrophobicContact CD2-CG2 3.76Å
345	T	91.3	Very high	91.2	Very high	98 Å²	98	57 Å²	57	60%	0.601	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-14.3	173.5	45	0	0	0	0	114.2	G307 P343 G347	G307-T345 WeakPolarHBondContact CA-O 3.47Å; G307-T345 PolarHBondContact O-OG1 3.5Å; P343-T345 PolarHBondContact O-N 3.12Å; T345-G347 PolarHBondContact O-N 3.18Å
346	A	92.6	Very high	90.4	Very high	2 Å²	2	56.9 Å²	56.9	2%	0.017	33%	0.331	C	S	.	.			trans	-64.3	120.3	-170.6	0	0	0	0	0	111.6	L308 I342 P343 T348 G349	L308-A346 HydrophobicContact CD2-CB 3.96Å; I342-A346 HydrophobicContact CG2-CB 3.88Å; P343-A346 HydrophobicContact CB-CB 4.25Å; P343-A346 WeakPolarHBondContact O-CB 3.44Å; P343-A346 PolarHBondContact O-N 3.45Å; A346-T348 PolarHBondContact O-N 3.29Å; A346-G349 PolarHBondContact O-N 3.03Å
347	G	91.4	Very high	89.7	Confident	5 Å²	5	59.6 Å²	59.6	5%	0.052	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	5.5	-168.5	0	0	0	0	0	116.3	P303 Q306 T345 G349 K363	P303-G347 CarbonylContact O-C 3.59Å; P303-G347 VanDerWaalsContact O-CA 3.25Å; P303-G347 WeakPolarHBondContact O-CA 3.34Å; Q306-G347 PolarHBondContact O-N 3.04Å; T345-G347 PolarHBondContact O-N 3.18Å; G347-G349 VanDerWaalsContact C-N 3.33Å; G347-K363 WeakPolarHBondContact O-CD 3.49Å
348	T	93.7	Very high	89.4	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-10.3	162.5	65.8	0	0	0	0	113.1	A292 F294 F304 H319 F321 A346 K363 I368	A292-T348 HydrophobicContact CB-CG2 4.03Å; F294-T348 HydrophobicContact CD1-CG2 4.49Å; F294-T348 HydrophobicContact CE1-CG2 3.7Å; F294-T348 HydrophobicContact CZ-CG2 4.23Å; F304-T348 HydrophobicContact CB-CG2 3.72Å; H319-T348 PolarHBondContact ND1-OG1 3.35Å; F321-T348 WeakPolarHBondContact CE2-OG1 3.21Å; A346-T348 PolarHBondContact O-N 3.29Å; T348-K363 WeakPolarHBondContact O-CB 3.48Å; T348-K363 PolarHBondContact O-N 3Å; T348-K363 VanDerWaalsContact O-N 3.11Å; T348-I368 HydrophobicContact CG2-CD1 3.95Å; T348-I368 HydrophobicContact CG2-CG1 4.35Å
349	G	93	Very high	89.2	Confident	8 Å²	8	56.8 Å²	56.8	8%	0.082	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	166.8	177.3	0	0	0	0	0	112.5	A346 G347 A361 K363	A346-G349 PolarHBondContact O-N 3.03Å; G347-G349 VanDerWaalsContact C-N 3.33Å; G349-A361 CarbonylContact C-O 3.6Å; G349-A361 VanDerWaalsContact CA-O 3.22Å; G349-A361 WeakPolarHBondContact CA-O 3.32Å; G349-K363 WeakPolarHBondContact O-CD 3.25Å
350	K	92.3	Very high	89.1	Confident	81 Å²	81	55.7 Å²	55.7	35%	0.352	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	135.4	167.5	63.8	-167.1	-178.4	-164.3	0	109.5	S352 A361 K363 E367	K350-S352 PolarHBondContact O-N 3.47Å; K350-A361 HydrophobicContact CG-CB 4Å; K350-A361 PolarHBondContact N-O 2.92Å; K350-A361 PolarHBondContact O-N 2.64Å; K350-K363 HydrophobicContact CB-CG 4.2Å; K350-K363 HydrophobicContact CD-CG 4.22Å; K350-K363 HydrophobicContact CG-CG 4.32Å; K350-E367 IonicContact NZ-OE1 3.55Å; K350-E367 PolarHBondContact NZ-OE1 2.91Å; K350-E367 IonicContact NZ-OE2 2.66Å; K350-E367 PolarHBondContact NZ-OE2 2.98Å
351	L	90.9	Very high	89	Confident	106 Å²	106	54.5 Å²	54.5	56%	0.555	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.7	115.3	-179.1	-169.6	70.2	0	0	0	109.1	L344 P358	L344-L351 HydrophobicContact CD2-CD1 4.25Å; L351-P358 HydrophobicContact CD1-CB 4.17Å
352	S	88.8	Confident	89	Confident	13 Å²	13	53.4 Å²	53.4	9%	0.091	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	153	172.8	-177.9	0	0	0	0	110.6	K350 E354 P358 Y359	K350-S352 PolarHBondContact O-N 3.47Å; S352-E354 WeakPolarHBondContact OG-CG 3.45Å; S352-E354 PolarHBondContact OG-N 2.89Å; S352-E354 PolarHBondContact OG-OE1 2.9Å; S352-P358 WeakPolarHBondContact O-CA 3.32Å; S352-Y359 PolarHBondContact N-O 2.93Å; S352-Y359 PolarHBondContact O-N 3.35Å
353	S	84.2	Confident	88.8	Confident	73 Å²	73	53.6 Å²	53.6	51%	0.51	30%	0.303	S	S	.	.			trans	-129.1	13.8	176.2	-62.8	0	0	0	0	112.5	K355 G356	S353-K355 PolarHBondContact O-N 2.85Å; S353-G356 PolarHBondContact O-N 2.85Å
354	E	77.5	Confident	88.7	Confident	162 Å²	162	54.4 Å²	54.4	76%	0.757	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	-28.3	-177.4	-73.7	154.9	-137.9	0	0	113.7	S352	S352-E354 WeakPolarHBondContact OG-CG 3.45Å; S352-E354 PolarHBondContact OG-N 2.89Å; S352-E354 PolarHBondContact OG-OE1 2.9Å
355	K	72.9	Confident	88.5	Confident	121 Å²	121	49.3 Å²	49.3	53%	0.526	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	26	-177.9	-57	175.9	-169.5	176.8	0	112.4	S353 Q357 Y359 E549	S353-K355 PolarHBondContact O-N 2.85Å; K355-Q357 PolarHBondContact O-N 3.11Å; K355-Q357 VanDerWaalsContact O-N 3.07Å; K355-Y359 HydrophobicContact CB-CD1 4.48Å; K355-Y359 HydrophobicContact CB-CE1 3.83Å; K355-Y359 HydrophobicContact CD-CE1 3.9Å; K355-Y359 WeakPolarHBondContact CE-OH 3.46Å; K355-Y359 HydrophobicContact CG-CE1 3.83Å; K355-E549 VanDerWaalsContact NZ-CG 3.33Å; K355-E549 IonicContact NZ-OE1 3.45Å; K355-E549 PolarHBondContact NZ-OE1 2.92Å
356	G	75.6	Confident	88.4	Confident	71 Å²	71	45 Å²	45	73%	0.732	25%	0.253	S	S	*	.	S	Bend	trans	73.8	-7.6	173	0	0	0	0	0	116.2	S353	S353-G356 PolarHBondContact O-N 2.85Å
357	Q	81	Confident	88.3	Confident	103 Å²	103	46.2 Å²	46.2	48%	0.481	26%	0.258	S	S	.	.	S	Bend	trans	-135.9	142.9	173.3	-66.6	-178.1	-37.3	0	0	108.4	K355 Y359 R547	K355-Q357 PolarHBondContact O-N 3.11Å; K355-Q357 VanDerWaalsContact O-N 3.07Å; Q357-Y359 WeakPolarHBondContact O-CD1 3.42Å; Q357-Y359 PolarHBondContact O-N 3Å; Q357-R547 VanDerWaalsContact OE1-CZ 3.26Å
358	P	86.5	Confident	88.3	Confident	83 Å²	83	46 Å²	46	54%	0.539	26%	0.256	S	S	.	.			trans	-66.6	133.6	-176.8	26.2	-33.9	0	0	0	111.5	L351 S352	L351-P358 HydrophobicContact CD1-CB 4.17Å; S352-P358 WeakPolarHBondContact O-CA 3.32Å
359	Y	91.2	Very high	88	Confident	9 Å²	9	46.1 Å²	46.1	4%	0.035	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	154.4	172.7	62.7	-91.2	0	0	0	111.2	S352 K355 Q357 A361 R547 E549	S352-Y359 PolarHBondContact N-O 2.93Å; S352-Y359 PolarHBondContact O-N 3.35Å; K355-Y359 HydrophobicContact CB-CD1 4.48Å; K355-Y359 HydrophobicContact CB-CE1 3.83Å; K355-Y359 HydrophobicContact CD-CE1 3.9Å; K355-Y359 WeakPolarHBondContact CE-OH 3.46Å; K355-Y359 HydrophobicContact CG-CE1 3.83Å; Q357-Y359 WeakPolarHBondContact O-CD1 3.42Å; Q357-Y359 PolarHBondContact O-N 3Å; Y359-A361 HydrophobicContact CD2-CB 4.39Å; Y359-A361 HydrophobicContact CE2-CB 4.1Å; Y359-A361 PolarHBondContact O-N 3.38Å; Y359-R547 CarbonylContact C-O 3.56Å; Y359-R547 VanDerWaalsContact CA-O 3.29Å; Y359-R547 WeakPolarHBondContact CA-O 3.5Å; Y359-R547 WeakPolarHBondContact CB-O 3.44Å; Y359-E549 HydrophobicContact CD2-CB 3.83Å; Y359-E549 HydrophobicContact CE2-CB 3.69Å; Y359-E549 HydrophobicContact CE2-CG 3.98Å
360	L	93.7	Very high	87.7	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	104.8	175.4	-162	71.4	0	0	0	109.6	F321 I342 T546 R547 T548	F321-L360 HydrophobicContact CE1-CB 4.48Å; F321-L360 HydrophobicContact CE1-CD2 3.73Å; F321-L360 HydrophobicContact CE1-CG 3.86Å; F321-L360 HydrophobicContact CZ-CD2 3.9Å; F321-L360 HydrophobicContact CZ-CG 4.42Å; I342-L360 HydrophobicContact CB-CD2 4.28Å; I342-L360 HydrophobicContact CG2-CD2 3.6Å; L360-T546 HydrophobicContact CB-CG2 3.95Å; L360-T546 HydrophobicContact CD2-CG2 4.29Å; L360-R547 PolarHBondContact N-O 2.96Å; L360-T548 VanDerWaalsContact O-CA 3.22Å; L360-T548 WeakPolarHBondContact O-CA 3.11Å; L360-T548 WeakPolarHBondContact O-CB 3.38Å
361	A	93.9	Very high	87.3	Confident	8 Å²	8	43 Å²	43	7%	0.066	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	144.7	171.7	0	0	0	0	0	109.9	G349 K350 Y359	G349-A361 CarbonylContact C-O 3.6Å; G349-A361 VanDerWaalsContact CA-O 3.22Å; G349-A361 WeakPolarHBondContact CA-O 3.32Å; K350-A361 HydrophobicContact CG-CB 4Å; K350-A361 PolarHBondContact N-O 2.92Å; K350-A361 PolarHBondContact O-N 2.64Å; Y359-A361 HydrophobicContact CD2-CB 4.39Å; Y359-A361 HydrophobicContact CE2-CB 4.1Å; Y359-A361 PolarHBondContact O-N 3.38Å
362	F	94.7	Very high	86.9	Confident	31 Å²	31	40.1 Å²	40.1	14%	0.136	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	135	173.9	-167.5	-126.2	0	0	0	109.5	Y285 S286 R290 A292 F321	Y285-F362 AromaticContact CD2-CE1 3.98Å; Y285-F362 HydrophobicContact CD2-CE1 3.98Å; Y285-F362 AromaticContact CD2-CZ 3.68Å; Y285-F362 HydrophobicContact CD2-CZ 3.68Å; Y285-F362 HydrophobicContact CE2-CD1 4.24Å; Y285-F362 AromaticContact CE2-CE1 3.26Å; Y285-F362 HydrophobicContact CE2-CE1 3.26Å; Y285-F362 HydrophobicContact CE2-CE2 4.43Å; Y285-F362 AromaticContact CE2-CZ 3.39Å; Y285-F362 HydrophobicContact CE2-CZ 3.39Å; Y285-F362 AromaticContact CZ-CE1 3.72Å; S286-F362 WeakPolarHBondContact O-CE1 3.49Å; R290-F362 HydrophobicContact CB-CB 4.43Å; R290-F362 HydrophobicContact CB-CD1 3.97Å; R290-F362 HydrophobicContact CB-CE1 4.35Å; R290-F362 HydrophobicContact CB-CG 4.13Å; R290-F362 HydrophobicContact CG-CB 4.48Å; R290-F362 HydrophobicContact CG-CD1 4.08Å; R290-F362 HydrophobicContact CG-CG 4.46Å; A292-F362 HydrophobicContact CB-CE2 4.18Å; A292-F362 HydrophobicContact CB-CZ 4.34Å; F321-F362 HydrophobicContact CB-CD2 4.4Å; F321-F362 HydrophobicContact CD1-CB 3.85Å; F321-F362 AromaticContact CD1-CD2 3.88Å; F321-F362 HydrophobicContact CD1-CD2 3.88Å; F321-F362 HydrophobicContact CD1-CG 4.32Å; F321-F362 AromaticContact CD2-CD2 3.43Å; F321-F362 HydrophobicContact CD2-CD2 3.43Å; F321-F362 VanDerWaalsContact CD2-CD2 3.43Å; F321-F362 AromaticContact CD2-CE2 3.79Å; F321-F362 HydrophobicContact CD2-CE2 3.79Å; F321-F362 HydrophobicContact CD2-CG 4.44Å; F321-F362 HydrophobicContact CE1-CB 4.22Å; F321-F362 AromaticContact CE1-CD2 3.94Å; F321-F362 HydrophobicContact CE1-CD2 3.94Å; F321-F362 AromaticContact CE2-CD2 3.52Å; F321-F362 HydrophobicContact CE2-CD2 3.52Å; F321-F362 AromaticContact CE2-CE2 3.84Å; F321-F362 HydrophobicContact CE2-CE2 3.84Å; F321-F362 HydrophobicContact CG-CB 4.19Å; F321-F362 AromaticContact CG-CD2 3.64Å; F321-F362 HydrophobicContact CG-CD2 3.64Å; F321-F362 HydrophobicContact CG-CE2 4.4Å; F321-F362 HydrophobicContact CG-CG 4.25Å; F321-F362 AromaticContact CZ-CD2 3.79Å; F321-F362 HydrophobicContact CZ-CD2 3.79Å; F321-F362 HydrophobicContact CZ-CE2 4.46Å
363	K	93.7	Very high	86.4	Confident	4 Å²	4	42.6 Å²	42.6	2%	0.017	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-74.8	148.4	176.8	-85	176.6	150.4	-152.6	0	111.4	Y285 G347 T348 G349 K350 E367 I368 D373	Y285-K363 PolarHBondContact OH-O 3.33Å; G347-K363 WeakPolarHBondContact O-CD 3.49Å; T348-K363 WeakPolarHBondContact O-CB 3.48Å; T348-K363 PolarHBondContact O-N 3Å; T348-K363 VanDerWaalsContact O-N 3.11Å; G349-K363 WeakPolarHBondContact O-CD 3.25Å; K350-K363 HydrophobicContact CB-CG 4.2Å; K350-K363 HydrophobicContact CD-CG 4.22Å; K350-K363 HydrophobicContact CG-CG 4.32Å; K363-E367 WeakPolarHBondContact CA-OE2 3.31Å; K363-E367 HydrophobicContact CB-CB 3.76Å; K363-E367 HydrophobicContact CD-CB 3.99Å; K363-E367 WeakPolarHBondContact CD-O 3.48Å; K363-E367 HydrophobicContact CG-CB 3.8Å; K363-E367 PolarHBondContact NZ-O 3.14Å; K363-I368 HydrophobicContact CB-CB 4.37Å; K363-D373 VanDerWaalsContact CE-OD2 3.28Å; K363-D373 WeakPolarHBondContact CE-OD2 3.47Å; K363-D373 IonicContact NZ-OD1 3.64Å; K363-D373 PolarHBondContact NZ-OD1 3.42Å; K363-D373 IonicContact NZ-OD2 2.93Å; K363-D373 PolarHBondContact NZ-OD2 2.9Å
364	N	91.3	Very high	86.3	Confident	55 Å²	55	47 Å²	47	29%	0.294	25%	0.245	S	C	.	.	P	Polyproline II helix	trans	-74	170.4	173	82.4	14.4	0	0	0	111.7	T366 E367 I368	N364-T366 PolarHBondContact O-N 3.39Å; N364-T366 VanDerWaalsContact O-N 3.13Å; N364-T366 WeakPolarHBondContact OD1-CA 3.42Å; N364-T366 WeakPolarHBondContact OD1-CB 3.03Å; N364-T366 PolarHBondContact OD1-N 2.86Å; N364-E367 PolarHBondContact N-OE2 3.43Å; N364-E367 PolarHBondContact O-N 2.79Å; N364-E367 WeakPolarHBondContact OD1-CG 3.28Å; N364-E367 PolarHBondContact OD1-N 3.47Å; N364-I368 VanDerWaalsContact O-CG2 3.31Å; N364-I368 WeakPolarHBondContact O-CG2 3.41Å; N364-I368 PolarHBondContact O-N 3.16Å
365	A	88.8	Confident	86.7	Confident	3 Å²	3	39.8 Å²	39.8	3%	0.025	21%	0.212	C	C	.	.	H	α-helix	trans	-60.4	-23	-177.7	0	0	0	0	0	114.3	V259 F264 Y285 I368 L369	V259-A365 HydrophobicContact CB-CB 4.36Å; V259-A365 HydrophobicContact CG1-CB 4.06Å; V259-A365 WeakPolarHBondContact O-CB 3.47Å; F264-A365 HydrophobicContact CD1-CB 4.48Å; F264-A365 HydrophobicContact CE1-CB 3.64Å; F264-A365 HydrophobicContact CZ-CB 4.4Å; Y285-A365 HydrophobicContact CE1-CB 4.01Å; Y285-A365 PolarHBondContact OH-N 2.59Å; A365-I368 WeakPolarHBondContact O-CG2 3.37Å; A365-L369 WeakPolarHBondContact O-CD1 3.25Å; A365-L369 WeakPolarHBondContact O-CG 3.44Å
366	T	89.1	Confident	87.4	Confident	6 Å²	6	39.5 Å²	39.5	4%	0.037	22%	0.216	C	C	.	.	H	α-helix	trans	-81.2	-49	173.9	-40.9	0	0	0	0	110.8	F256 V259 N364 I368 L369 L370 V372	F256-T366 HydrophobicContact CD1-CG2 4.16Å; F256-T366 HydrophobicContact CE1-CG2 3.95Å; V259-T366 HydrophobicContact CG2-CG2 4.39Å; V259-T366 PolarHBondContact N-OG1 3.29Å; N364-T366 PolarHBondContact O-N 3.39Å; N364-T366 VanDerWaalsContact O-N 3.13Å; N364-T366 WeakPolarHBondContact OD1-CA 3.42Å; N364-T366 WeakPolarHBondContact OD1-CB 3.03Å; N364-T366 PolarHBondContact OD1-N 2.86Å; T366-I368 VanDerWaalsContact C-N 3.27Å; T366-I368 PolarHBondContact O-N 2.87Å; T366-L369 PolarHBondContact O-N 3.45Å; T366-L370 HydrophobicContact CG2-CD1 4.46Å; T366-L370 WeakPolarHBondContact O-CB 3.43Å; T366-L370 PolarHBondContact O-N 3.41Å; T366-L370 VanDerWaalsContact O-O 3.12Å; T366-V372 HydrophobicContact CG2-CG1 3.97Å; T366-V372 HydrophobicContact CG2-CG2 3.88Å
367	E	90.7	Very high	88	Confident	28 Å²	28	36.6 Å²	36.6	13%	0.131	18%	0.183	C	C	.	.	H	α-helix	trans	-64.8	-24.1	-179.4	-69.2	174.8	140.4	0	0	114.4	K350 K363 N364 L370 V372	K350-E367 IonicContact NZ-OE1 3.55Å; K350-E367 PolarHBondContact NZ-OE1 2.91Å; K350-E367 IonicContact NZ-OE2 2.66Å; K350-E367 PolarHBondContact NZ-OE2 2.98Å; K363-E367 WeakPolarHBondContact CA-OE2 3.31Å; K363-E367 HydrophobicContact CB-CB 3.76Å; K363-E367 HydrophobicContact CD-CB 3.99Å; K363-E367 WeakPolarHBondContact CD-O 3.48Å; K363-E367 HydrophobicContact CG-CB 3.8Å; K363-E367 PolarHBondContact NZ-O 3.14Å; N364-E367 PolarHBondContact N-OE2 3.43Å; N364-E367 PolarHBondContact O-N 2.79Å; N364-E367 WeakPolarHBondContact OD1-CG 3.28Å; N364-E367 PolarHBondContact OD1-N 3.47Å; E367-L370 CarbonylContact C-O 3.59Å; E367-V372 HydrophobicContact CB-CG2 4.41Å; E367-V372 HydrophobicContact CG-CG2 3.93Å
368	I	89.9	Confident	88.2	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-85.4	-36.9	177.5	-165.7	173.1	0	0	0	112.2	F264 L283 Y285 A292 P303 F304 T348 K363 N364 A365 T366	F264-I368 HydrophobicContact CZ-CG2 4.45Å; L283-I368 HydrophobicContact CD1-CD1 4.39Å; L283-I368 HydrophobicContact CD2-CD1 4.44Å; Y285-I368 HydrophobicContact CD2-CD1 3.63Å; Y285-I368 HydrophobicContact CD2-CG2 4.12Å; Y285-I368 HydrophobicContact CE2-CD1 4.07Å; Y285-I368 HydrophobicContact CE2-CG2 4.12Å; A292-I368 HydrophobicContact CB-CD1 4.12Å; P303-I368 WeakPolarHBondContact CB-O 3.26Å; P303-I368 WeakPolarHBondContact CD-O 3.44Å; P303-I368 WeakPolarHBondContact CG-O 3.41Å; F304-I368 HydrophobicContact CB-CD1 4.2Å; F304-I368 HydrophobicContact CB-CG1 3.67Å; F304-I368 WeakPolarHBondContact CD1-O 3.09Å; F304-I368 PolarHBondContact N-O 3.2Å; T348-I368 HydrophobicContact CG2-CD1 3.95Å; T348-I368 HydrophobicContact CG2-CG1 4.35Å; K363-I368 HydrophobicContact CB-CB 4.37Å; N364-I368 VanDerWaalsContact O-CG2 3.31Å; N364-I368 WeakPolarHBondContact O-CG2 3.41Å; N364-I368 PolarHBondContact O-N 3.16Å; A365-I368 WeakPolarHBondContact O-CG2 3.37Å; T366-I368 VanDerWaalsContact C-N 3.27Å; T366-I368 PolarHBondContact O-N 2.87Å
369	L	88.5	Confident	88.1	Confident	3 Å²	3	30.9 Å²	30.9	2%	0.016	15%	0.147	C	C	.	.	H	α-helix	trans	-82.3	-35.1	178.6	-71.8	175.5	0	0	0	112.7	V259 F264 V266 L283 P303 A365 T366 P428 F453	V259-L369 HydrophobicContact CG1-CD1 4.31Å; F264-L369 HydrophobicContact CE2-CD1 4.05Å; F264-L369 HydrophobicContact CE2-CD2 4.07Å; F264-L369 HydrophobicContact CE2-CG 4.28Å; F264-L369 HydrophobicContact CZ-CD1 3.87Å; F264-L369 HydrophobicContact CZ-CD2 4.25Å; F264-L369 HydrophobicContact CZ-CG 4.01Å; V266-L369 HydrophobicContact CG1-CD2 4.24Å; V266-L369 HydrophobicContact CG2-CD2 4.47Å; L283-L369 HydrophobicContact CD2-CD2 3.84Å; P303-L369 WeakPolarHBondContact CD-O 3.45Å; A365-L369 WeakPolarHBondContact O-CD1 3.25Å; A365-L369 WeakPolarHBondContact O-CG 3.44Å; T366-L369 PolarHBondContact O-N 3.45Å; L369-P428 HydrophobicContact CD1-CG 4.28Å; L369-F453 HydrophobicContact CD2-CD1 4.43Å; L369-F453 HydrophobicContact CD2-CE1 4.07Å
370	L	87.2	Confident	87.5	Confident	3 Å²	3	31 Å²	31	2%	0.016	15%	0.149	C	C	.	.	S	Bend	trans	-134.7	145.2	-168	-56.9	171.2	0	0	0	110.2	F256 T366 E367 V372 V408 F410 L431 F453	F256-L370 HydrophobicContact CE1-CD1 3.81Å; F256-L370 HydrophobicContact CZ-CD1 3.85Å; T366-L370 HydrophobicContact CG2-CD1 4.46Å; T366-L370 WeakPolarHBondContact O-CB 3.43Å; T366-L370 PolarHBondContact O-N 3.41Å; T366-L370 VanDerWaalsContact O-O 3.12Å; E367-L370 CarbonylContact C-O 3.59Å; L370-V372 HydrophobicContact CB-CG1 4.13Å; L370-V372 PolarHBondContact O-N 2.85Å; L370-V408 HydrophobicContact CD1-CG1 4.09Å; L370-V408 HydrophobicContact CD2-CG1 4.22Å; L370-V408 HydrophobicContact CD2-CG2 3.95Å; L370-F410 HydrophobicContact CD1-CE1 4.49Å; L370-F410 HydrophobicContact CD1-CZ 3.97Å; L370-L431 HydrophobicContact CD2-CD2 4.33Å; L370-F453 HydrophobicContact CD2-CZ 4.25Å
371	K	83.6	Confident	86.7	Confident	22 Å²	22	31.3 Å²	31.3	10%	0.096	15%	0.152	C	C	.	.			trans	-73	37	-178.3	-67.1	-175.8	172.7	-173.1	0	114.2	V301 P303 D373 R374 L375 E397	V301-K371 WeakPolarHBondContact O-CE 3.28Å; P303-K371 HydrophobicContact CG-CG 4.12Å; K371-D373 PolarHBondContact O-N 2.9Å; K371-D373 VanDerWaalsContact O-N 3.17Å; K371-R374 PolarHBondContact O-N 3.15Å; K371-L375 HydrophobicContact CB-CD1 3.83Å; K371-L375 HydrophobicContact CB-CG 3.9Å; K371-L375 HydrophobicContact CD-CD1 4.06Å; K371-L375 HydrophobicContact CD-CG 4.48Å; K371-L375 WeakPolarHBondContact O-CB 3.31Å; K371-L375 PolarHBondContact O-N 2.89Å; K371-E397 IonicContact NZ-OE1 2.61Å; K371-E397 PolarHBondContact NZ-OE1 2.88Å; K371-E397 IonicContact NZ-OE2 3.39Å; K371-E397 PolarHBondContact NZ-OE2 2.89Å
372	V	81.7	Confident	86	Confident	45 Å²	45	34.3 Å²	34.3	27%	0.273	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-15.3	-178.1	-63.6	0	0	0	0	113.6	F256 T366 E367 L370 R374 F377	F256-V372 HydrophobicContact CD1-CG1 3.57Å; F256-V372 HydrophobicContact CE1-CG1 3.42Å; F256-V372 VanDerWaalsContact CE1-CG1 3.42Å; F256-V372 HydrophobicContact CG-CG1 4.33Å; F256-V372 HydrophobicContact CZ-CG1 4.08Å; T366-V372 HydrophobicContact CG2-CG1 3.97Å; T366-V372 HydrophobicContact CG2-CG2 3.88Å; E367-V372 HydrophobicContact CB-CG2 4.41Å; E367-V372 HydrophobicContact CG-CG2 3.93Å; L370-V372 HydrophobicContact CB-CG1 4.13Å; L370-V372 PolarHBondContact O-N 2.85Å; V372-R374 VanDerWaalsContact C-N 3.26Å; V372-F377 HydrophobicContact CG1-CD2 4.05Å; V372-F377 HydrophobicContact CG1-CE2 3.93Å
373	D	79.5	Confident	85.1	Confident	65 Å²	65	33.7 Å²	33.7	35%	0.348	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-10.7	171.2	62.5	-44.2	0	0	0	113.7	K363 K371	K363-D373 VanDerWaalsContact CE-OD2 3.28Å; K363-D373 WeakPolarHBondContact CE-OD2 3.47Å; K363-D373 IonicContact NZ-OD1 3.64Å; K363-D373 PolarHBondContact NZ-OD1 3.42Å; K363-D373 IonicContact NZ-OD2 2.93Å; K363-D373 PolarHBondContact NZ-OD2 2.9Å; K371-D373 PolarHBondContact O-N 2.9Å; K371-D373 VanDerWaalsContact O-N 3.17Å
374	R	82	Confident	84.2	Confident	164 Å²	164	38 Å²	38	62%	0.619	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-131.7	-25.4	-175.9	-58.2	-177.3	-170.6	-167.7	0.5	114	K371 V372	K371-R374 PolarHBondContact O-N 3.15Å; V372-R374 VanDerWaalsContact C-N 3.26Å
375	L	85.8	Confident	83.6	Confident	11 Å²	11	35.8 Å²	35.8	6%	0.058	17%	0.171	C	C	.	.			trans	-116.6	122.6	-171.5	-58.5	-173	0	0	0	111.2	K371 F377 A395 E397 H406	K371-L375 HydrophobicContact CB-CD1 3.83Å; K371-L375 HydrophobicContact CB-CG 3.9Å; K371-L375 HydrophobicContact CD-CD1 4.06Å; K371-L375 HydrophobicContact CD-CG 4.48Å; K371-L375 WeakPolarHBondContact O-CB 3.31Å; K371-L375 PolarHBondContact O-N 2.89Å; L375-F377 HydrophobicContact CB-CD2 4.29Å; L375-F377 HydrophobicContact CB-CE2 3.79Å; L375-F377 HydrophobicContact CB-CZ 4.22Å; L375-F377 HydrophobicContact CD1-CZ 4.24Å; L375-F377 VanDerWaalsContact O-CD2 3.31Å; L375-F377 WeakPolarHBondContact O-CD2 3.45Å; L375-F377 PolarHBondContact O-N 2.91Å; L375-A395 HydrophobicContact CB-CB 3.88Å; L375-A395 HydrophobicContact CD1-CB 4.37Å; L375-E397 HydrophobicContact CD1-CB 4.31Å; L375-E397 HydrophobicContact CD2-CB 3.64Å; L375-E397 HydrophobicContact CD2-CG 3.9Å; L375-H406 HydrophobicContact CD1-CB 4.19Å
376	N	86.6	Confident	82.9	Confident	115 Å²	115	40.2 Å²	40.2	62%	0.615	19%	0.194	S	C	*	.			trans	-76.1	109.2	167.4	-70.2	-38.1	0	0	0	109.1	A395	N376-A395 VanDerWaalsContact O-CB 3.26Å; N376-A395 WeakPolarHBondContact O-CB 3.36Å
377	F	87.9	Confident	82	Confident	10 Å²	10	47.3 Å²	47.3	4%	0.044	23%	0.232	C	C	.	.			trans	-89.5	136.6	172.5	-70.5	-89.2	0	0	0	110.5	F256 V372 L375 W393 A395 H406 V408	F256-F377 HydrophobicContact CD2-CB 3.31Å; F256-F377 HydrophobicContact CD2-CD1 4.48Å; F256-F377 HydrophobicContact CD2-CD2 4.05Å; F256-F377 AromaticContact CD2-CG 3.72Å; F256-F377 HydrophobicContact CD2-CG 3.72Å; F256-F377 HydrophobicContact CE2-CB 3.52Å; F256-F377 AromaticContact CE2-CD1 3.81Å; F256-F377 HydrophobicContact CE2-CD1 3.81Å; F256-F377 AromaticContact CE2-CD2 3.8Å; F256-F377 HydrophobicContact CE2-CD2 3.8Å; F256-F377 HydrophobicContact CE2-CE1 4.49Å; F256-F377 HydrophobicContact CE2-CE2 4.47Å; F256-F377 AromaticContact CE2-CG 3.42Å; F256-F377 HydrophobicContact CE2-CG 3.42Å; F256-F377 VanDerWaalsContact CE2-CG 3.42Å; F256-F377 HydrophobicContact CG-CB 4.29Å; F256-F377 HydrophobicContact CZ-CD1 4.49Å; F256-F377 HydrophobicContact CZ-CD2 4.17Å; F256-F377 HydrophobicContact CZ-CE2 4.47Å; F256-F377 HydrophobicContact CZ-CG 4.19Å; V372-F377 HydrophobicContact CG1-CD2 4.05Å; V372-F377 HydrophobicContact CG1-CE2 3.93Å; L375-F377 HydrophobicContact CB-CD2 4.29Å; L375-F377 HydrophobicContact CB-CE2 3.79Å; L375-F377 HydrophobicContact CB-CZ 4.22Å; L375-F377 HydrophobicContact CD1-CZ 4.24Å; L375-F377 VanDerWaalsContact O-CD2 3.31Å; L375-F377 WeakPolarHBondContact O-CD2 3.45Å; L375-F377 PolarHBondContact O-N 2.91Å; F377-W393 HydrophobicContact CB-CB 4.46Å; F377-W393 HydrophobicContact CB-CE3 4.21Å; F377-W393 HydrophobicContact CD1-CB 4.43Å; F377-A395 HydrophobicContact CB-CB 4.43Å; F377-A395 HydrophobicContact CD1-CB 3.48Å; F377-A395 VanDerWaalsContact CD1-CB 3.48Å; F377-A395 HydrophobicContact CD2-CB 4.19Å; F377-A395 HydrophobicContact CE1-CB 3.6Å; F377-A395 HydrophobicContact CE2-CB 4.31Å; F377-A395 HydrophobicContact CG-CB 3.78Å; F377-A395 HydrophobicContact CZ-CB 4.03Å; F377-H406 HydrophobicContact CE1-CB 4.07Å; F377-H406 HydrophobicContact CZ-CB 4.37Å; F377-V408 HydrophobicContact CD1-CG2 4.33Å; F377-V408 HydrophobicContact CE1-CG2 3.63Å; F377-V408 HydrophobicContact CZ-CG2 4.06Å
378	G	85.8	Confident	81	Confident	1 Å²	1	47.8 Å²	47.8	1%	0.01	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	147.7	168.3	0	0	0	0	0	112.2	K252 W393 V394	K252-G378 WeakPolarHBondContact O-CA 3.41Å; G378-W393 VanDerWaalsContact C-CE3 3.43Å; G378-W393 CarbonylContact O-C 3.09Å; G378-W393 WeakPolarHBondContact O-CA 3.39Å; G378-V394 PolarHBondContact N-O 3.32Å; G378-V394 PolarHBondContact O-N 2.98Å
379	Y	84.6	Confident	80.3	Confident	66 Å²	66	51 Å²	51	26%	0.259	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	131	177	-179.5	-119.6	0	0	0	109.9	L251 G381 E391 W393	L251-Y379 WeakPolarHBondContact CD1-O 3.38Å; Y379-G381 WeakPolarHBondContact CE2-O 3.48Å; Y379-G381 VanDerWaalsContact CZ-CA 3.45Å; Y379-G381 WeakPolarHBondContact OH-CA 3.43Å; Y379-E391 HydrophobicContact CE2-CB 4.1Å; Y379-E391 HydrophobicContact CE2-CG 4.15Å; Y379-W393 HydrophobicContact CD2-CD2 4.19Å; Y379-W393 AromaticContact CD2-CE2 3.63Å; Y379-W393 HydrophobicContact CD2-CG 4.44Å; Y379-W393 AromaticContact CD2-CZ2 3.96Å; Y379-W393 HydrophobicContact CD2-CZ2 3.96Å; Y379-W393 AromaticContact CD2-NE1 3.54Å; Y379-W393 HydrophobicContact CG-CZ2 4.17Å; Y379-W393 VanDerWaalsContact N-CE3 3.32Å
380	V	78.4	Confident	80	Confident	12 Å²	12	51 Å²	51	7%	0.073	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	-50.7	178.4	173.9	0	0	0	0	110.9	L241 P242 L251 V392 V394	L241-V380 HydrophobicContact CB-CG1 4.23Å; L241-V380 HydrophobicContact CD1-CG1 4.23Å; L241-V380 HydrophobicContact CD2-CG1 4Å; L241-V380 WeakPolarHBondContact CD2-O 3.44Å; L241-V380 HydrophobicContact CG-CG1 4.38Å; P242-V380 HydrophobicContact CG-CG1 4.34Å; L251-V380 HydrophobicContact CD1-CG2 4.14Å; L251-V380 HydrophobicContact CD2-CG2 4.35Å; V380-V392 PolarHBondContact N-O 2.81Å; V380-V394 HydrophobicContact CG2-CB 3.82Å; V380-V394 HydrophobicContact CG2-CG2 3.5Å; V380-V394 VanDerWaalsContact CG2-CG2 3.5Å
381	G	76.6	Confident	79.8	Confident	6 Å²	6	52.2 Å²	52.2	6%	0.062	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	157.4	-159.7	-173.9	0	0	0	0	0	110.5	Y379 V392	Y379-G381 WeakPolarHBondContact CE2-O 3.48Å; Y379-G381 VanDerWaalsContact CZ-CA 3.45Å; Y379-G381 WeakPolarHBondContact OH-CA 3.43Å; G381-V392 PolarHBondContact O-N 3.29Å
382	K	79.6	Confident	80	Confident	71 Å²	71	51.2 Å²	51.2	31%	0.309	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	147.8	165.6	-50.8	-172	-134.1	73.7	0	111.2	E237 L241 M389 L390 E391	E237-K382 WeakPolarHBondContact OE1-CB 3.35Å; E237-K382 WeakPolarHBondContact OE1-CG 3.18Å; E237-K382 IonicContact OE1-NZ 3.54Å; E237-K382 PolarHBondContact OE1-NZ 2.92Å; E237-K382 IonicContact OE2-NZ 2.64Å; E237-K382 PolarHBondContact OE2-NZ 3.22Å; L241-K382 WeakPolarHBondContact CD1-O 3.5Å; K382-M389 HydrophobicContact CB-CE 3.97Å; K382-L390 CarbonylContact C-O 3.52Å; K382-L390 WeakPolarHBondContact CA-O 3.49Å; K382-E391 HydrophobicContact CG-CG 4.04Å
383	R	75.9	Confident	80.4	Confident	18 Å²	18	49.7 Å²	49.7	7%	0.068	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	154.8	171.2	-66.8	-175.6	-172.8	152.5	-1.4	110.4	L241 P242 P243 L390 V392 E407 W409	L241-R383 HydrophobicContact CD1-CG 3.9Å; P242-R383 PolarHBondContact O-NH2 3.26Å; P243-R383 PolarHBondContact O-NH2 3.42Å; R383-L390 PolarHBondContact N-O 3.33Å; R383-L390 PolarHBondContact O-N 2.77Å; R383-V392 HydrophobicContact CB-CG2 3.9Å; R383-V392 HydrophobicContact CG-CG2 4.03Å; R383-E407 IonicContact CZ-OE2 3.83Å; R383-E407 IonicContact NH1-OE1 3.47Å; R383-E407 PolarHBondContact NH1-OE1 2.62Å; R383-E407 IonicContact NH1-OE2 3.54Å; R383-E407 PolarHBondContact NH1-OE2 3.4Å; R383-E407 IonicContact NH2-OE2 3.68Å; R383-W409 HydrophobicContact CB-CE3 4.3Å; R383-W409 HydrophobicContact CB-CH2 3.62Å; R383-W409 HydrophobicContact CB-CZ3 3.38Å; R383-W409 HydrophobicContact CG-CH2 4.37Å; R383-W409 HydrophobicContact CG-CZ3 4.47Å
384	L	75.4	Confident	80.8	Confident	93 Å²	93	46.7 Å²	46.7	49%	0.487	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	127.6	174	-168	71.9	0	0	0	110.4	M388 M389	L384-M388 WeakPolarHBondContact CA-O 3.44Å; L384-M389 HydrophobicContact CB-SD 3.79Å; L384-M389 HydrophobicContact CD1-CG 4.15Å; L384-M389 HydrophobicContact CD1-SD 3.82Å; L384-M389 HydrophobicContact CG-SD 4.44Å
385	L	77.7	Confident	81.1	Confident	10 Å²	10	38.9 Å²	38.9	5%	0.052	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	126	171.6	170.9	56.6	0	0	0	109	D387 M388 L390 W409 A430	L385-D387 VanDerWaalsContact C-N 3.29Å; L385-D387 PolarHBondContact O-N 2.97Å; L385-M388 PolarHBondContact N-O 2.94Å; L385-M388 WeakPolarHBondContact O-CA 3.13Å; L385-M388 WeakPolarHBondContact O-CB 3.34Å; L385-M388 PolarHBondContact O-N 3.36Å; L385-M388 VanDerWaalsContact O-O 3.13Å; L385-L390 HydrophobicContact CB-CD1 4.04Å; L385-L390 HydrophobicContact CD2-CD1 4.03Å; L385-L390 HydrophobicContact CG-CD1 4.31Å; L385-W409 HydrophobicContact CB-CE3 3.63Å; L385-W409 HydrophobicContact CB-CH2 4.21Å; L385-W409 HydrophobicContact CB-CZ3 3.46Å; L385-W409 VanDerWaalsContact CB-CZ3 3.46Å; L385-W409 HydrophobicContact CD2-CB 4.45Å; L385-W409 HydrophobicContact CD2-CD2 3.8Å; L385-W409 HydrophobicContact CD2-CE3 3.74Å; L385-W409 HydrophobicContact CD2-CG 4.14Å; L385-W409 HydrophobicContact CD2-CZ3 4.23Å; L385-W409 HydrophobicContact CG-CE3 4.33Å; L385-W409 HydrophobicContact CG-CZ3 4.43Å; L385-A430 HydrophobicContact CD2-CB 4.02Å
386	D	73.7	Confident	81.2	Confident	95 Å²	95	41.9 Å²	41.9	51%	0.508	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.8	48.6	178.3	-48.9	-35.7	0	0	0	112.2	M388	D386-M388 HydrophobicContact CB-CE 4.05Å; D386-M388 PolarHBondContact O-N 3.29Å; D386-M388 VanDerWaalsContact O-N 3.16Å
387	D	70.8	Confident	81.2	Confident	156 Å²	156	37.9 Å²	37.9	83%	0.834	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	59	13.8	-173.8	-60.9	-33.5	0	0	0	116.2	L385	L385-D387 VanDerWaalsContact C-N 3.29Å; L385-D387 PolarHBondContact O-N 2.97Å
388	M	70.6	Confident	80.9	Confident	38 Å²	38	40.8 Å²	40.8	19%	0.187	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	133.6	176.3	-64.7	171.2	-69.9	0	0	112	L384 L385 D386 L390 W429	L384-M388 WeakPolarHBondContact CA-O 3.44Å; L385-M388 PolarHBondContact N-O 2.94Å; L385-M388 WeakPolarHBondContact O-CA 3.13Å; L385-M388 WeakPolarHBondContact O-CB 3.34Å; L385-M388 PolarHBondContact O-N 3.36Å; L385-M388 VanDerWaalsContact O-O 3.13Å; D386-M388 HydrophobicContact CB-CE 4.05Å; D386-M388 PolarHBondContact O-N 3.29Å; D386-M388 VanDerWaalsContact O-N 3.16Å; M388-L390 HydrophobicContact CB-CD2 4.05Å; M388-L390 HydrophobicContact CB-CG 4.26Å; M388-W429 HydrophobicContact CE-CD2 4.46Å; M388-W429 HydrophobicContact CE-CH2 4.25Å; M388-W429 HydrophobicContact CE-CZ2 3.51Å; M388-W429 HydrophobicContact SD-CZ2 4.37Å
389	M	74.4	Confident	80.3	Confident	68 Å²	68	46.6 Å²	46.6	34%	0.335	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	117.6	168.2	-68.4	-64.6	-76.2	0	0	109.5	A234 E237 K382 L384	A234-M389 HydrophobicContact CB-CE 4.42Å; E237-M389 HydrophobicContact CB-CE 4.33Å; E237-M389 WeakPolarHBondContact OE2-CE 3.39Å; K382-M389 HydrophobicContact CB-CE 3.97Å; L384-M389 HydrophobicContact CB-SD 3.79Å; L384-M389 HydrophobicContact CD1-CG 4.15Å; L384-M389 HydrophobicContact CD1-SD 3.82Å; L384-M389 HydrophobicContact CG-SD 4.44Å
390	L	81.5	Confident	79.5	Confident	2 Å²	2	50 Å²	50	1%	0.01	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	148.6	-175.9	-56.7	178.9	0	0	0	110.7	K382 R383 L385 M388 W409 F410 N411 W429	K382-L390 CarbonylContact C-O 3.52Å; K382-L390 WeakPolarHBondContact CA-O 3.49Å; R383-L390 PolarHBondContact N-O 3.33Å; R383-L390 PolarHBondContact O-N 2.77Å; L385-L390 HydrophobicContact CB-CD1 4.04Å; L385-L390 HydrophobicContact CD2-CD1 4.03Å; L385-L390 HydrophobicContact CG-CD1 4.31Å; M388-L390 HydrophobicContact CB-CD2 4.05Å; M388-L390 HydrophobicContact CB-CG 4.26Å; L390-W409 HydrophobicContact CB-CB 4.47Å; L390-W409 HydrophobicContact CB-CE3 4.2Å; L390-W409 HydrophobicContact CD1-CB 4.14Å; L390-W409 HydrophobicContact CD1-CE3 4.28Å; L390-F410 WeakPolarHBondContact CB-O 3.37Å; L390-N411 HydrophobicContact CD2-CB 3.78Å; L390-W429 HydrophobicContact CD1-CB 3.95Å; L390-W429 HydrophobicContact CD1-CG 3.8Å
391	E	84.7	Confident	78.9	Confident	29 Å²	29	56.8 Å²	56.8	14%	0.136	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	126.1	176.3	-78.9	-179	-173.1	0	0	110.6	Y379 K382 F410 K412	Y379-E391 HydrophobicContact CE2-CB 4.1Å; Y379-E391 HydrophobicContact CE2-CG 4.15Å; K382-E391 HydrophobicContact CG-CG 4.04Å; E391-F410 PolarHBondContact N-O 2.89Å; E391-F410 PolarHBondContact O-N 3.02Å; E391-K412 VanDerWaalsContact CD-CD 3.43Å; E391-K412 WeakPolarHBondContact OE1-CD 3.5Å; E391-K412 WeakPolarHBondContact OE1-CE 3.41Å; E391-K412 IonicContact OE1-NZ 3.9Å; E391-K412 PolarHBondContact OE1-NZ 2.99Å; E391-K412 WeakPolarHBondContact OE2-CD 3.34Å; E391-K412 IonicContact OE2-NZ 3.42Å; E391-K412 PolarHBondContact OE2-NZ 3.18Å
392	V	86.4	Confident	78.6	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	132.8	-171.4	-177.1	0	0	0	0	111.7	V380 G381 R383 V394 E407 V408 W409	V380-V392 PolarHBondContact N-O 2.81Å; G381-V392 PolarHBondContact O-N 3.29Å; R383-V392 HydrophobicContact CB-CG2 3.9Å; R383-V392 HydrophobicContact CG-CG2 4.03Å; V392-V394 HydrophobicContact CG1-CG2 4.27Å; V392-E407 HydrophobicContact CG1-CG 3.61Å; V392-V408 WeakPolarHBondContact CA-O 3.45Å; V392-W409 HydrophobicContact CG2-CD2 3.67Å; V392-W409 HydrophobicContact CG2-CE3 3.53Å; V392-W409 HydrophobicContact CG2-CG 4.19Å; V392-W409 HydrophobicContact CG2-CH2 4.43Å; V392-W409 HydrophobicContact CG2-CZ3 3.94Å
393	W	90.4	Very high	78.5	Confident	14 Å²	14	56.5 Å²	56.5	5%	0.053	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	133.6	-179.9	-70.5	75	0	0	0	110.5	D254 S255 F256 P257 F377 G378 Y379 E407 V408 F410	D254-W393 HydrophobicContact CB-CH2 3.73Å; D254-W393 HydrophobicContact CB-CZ3 3.84Å; S255-W393 VanDerWaalsContact O-CH2 3.22Å; S255-W393 WeakPolarHBondContact O-CH2 3.45Å; F256-W393 HydrophobicContact CB-CZ3 4.36Å; F256-W393 HydrophobicContact CD2-CB 4.19Å; F256-W393 AromaticContact CD2-CD2 3.81Å; F256-W393 HydrophobicContact CD2-CD2 3.81Å; F256-W393 AromaticContact CD2-CE3 3.59Å; F256-W393 HydrophobicContact CD2-CE3 3.59Å; F256-W393 HydrophobicContact CD2-CG 4.09Å; F256-W393 HydrophobicContact CD2-CZ3 4.23Å; F256-W393 HydrophobicContact CE2-CB 3.73Å; F256-W393 HydrophobicContact CE2-CD2 4.2Å; F256-W393 HydrophobicContact CE2-CE3 4.32Å; F256-W393 AromaticContact CE2-CG 3.97Å; F256-W393 HydrophobicContact CE2-CG 3.97Å; P257-W393 HydrophobicContact CG-CZ2 4.05Å; F377-W393 HydrophobicContact CB-CB 4.46Å; F377-W393 HydrophobicContact CB-CE3 4.21Å; F377-W393 HydrophobicContact CD1-CB 4.43Å; G378-W393 VanDerWaalsContact C-CE3 3.43Å; G378-W393 CarbonylContact O-C 3.09Å; G378-W393 WeakPolarHBondContact O-CA 3.39Å; Y379-W393 HydrophobicContact CD2-CD2 4.19Å; Y379-W393 AromaticContact CD2-CE2 3.63Å; Y379-W393 HydrophobicContact CD2-CG 4.44Å; Y379-W393 AromaticContact CD2-CZ2 3.96Å; Y379-W393 HydrophobicContact CD2-CZ2 3.96Å; Y379-W393 AromaticContact CD2-NE1 3.54Å; Y379-W393 HydrophobicContact CG-CZ2 4.17Å; Y379-W393 VanDerWaalsContact N-CE3 3.32Å; W393-E407 CarbonylContact O-C 3.55Å; W393-E407 WeakPolarHBondContact O-CA 3.48Å; W393-V408 PolarHBondContact N-O 3.24Å; W393-V408 PolarHBondContact O-N 3.43Å; W393-F410 AromaticContact CD1-CD2 3.7Å; W393-F410 AromaticContact CD1-CE2 3.99Å; W393-F410 HydrophobicContact CG-CD2 4.46Å; W393-F410 HydrophobicContact CG-CE2 4.37Å
394	V	87.3	Confident	79	Confident	1 Å²	1	58.4 Å²	58.4	1%	0.006	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	137.2	-173.5	-177.2	0	0	0	0	111.9	Y247 L251 G378 V380 V392 V405 H406 E407	Y247-V394 HydrophobicContact CD2-CG1 4.11Å; L251-V394 HydrophobicContact CD2-CB 4.34Å; G378-V394 PolarHBondContact N-O 3.32Å; G378-V394 PolarHBondContact O-N 2.98Å; V380-V394 HydrophobicContact CG2-CB 3.82Å; V380-V394 HydrophobicContact CG2-CG2 3.5Å; V380-V394 VanDerWaalsContact CG2-CG2 3.5Å; V392-V394 HydrophobicContact CG1-CG2 4.27Å; V394-V405 HydrophobicContact CG1-CG1 3.39Å; V394-H406 CarbonylContact C-O 3.51Å; V394-H406 VanDerWaalsContact CA-O 3.3Å; V394-H406 WeakPolarHBondContact CA-O 3.5Å; V394-E407 HydrophobicContact CG2-CB 4.22Å; V394-E407 HydrophobicContact CG2-CG 3.86Å
395	A	89.5	Confident	79.4	Confident	0 Å²	0	54 Å²	54	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	163.3	172.6	0	0	0	0	0	112	L375 N376 F377 V405 H406	L375-A395 HydrophobicContact CB-CB 3.88Å; L375-A395 HydrophobicContact CD1-CB 4.37Å; N376-A395 VanDerWaalsContact O-CB 3.26Å; N376-A395 WeakPolarHBondContact O-CB 3.36Å; F377-A395 HydrophobicContact CB-CB 4.43Å; F377-A395 HydrophobicContact CD1-CB 3.48Å; F377-A395 VanDerWaalsContact CD1-CB 3.48Å; F377-A395 HydrophobicContact CD2-CB 4.19Å; F377-A395 HydrophobicContact CE1-CB 3.6Å; F377-A395 HydrophobicContact CE2-CB 4.31Å; F377-A395 HydrophobicContact CG-CB 3.78Å; F377-A395 HydrophobicContact CZ-CB 4.03Å; A395-V405 WeakPolarHBondContact O-CA 3.29Å; A395-H406 PolarHBondContact N-O 3.33Å; A395-H406 PolarHBondContact O-N 2.77Å
396	K	86.7	Confident	80	Confident	74 Å²	74	53.7 Å²	53.7	32%	0.322	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	120.3	179.1	-177.8	172.5	178.8	175.3	0	110.3	Y247 C403	Y247-K396 HydrophobicContact CD1-CB 4.04Å; Y247-K396 HydrophobicContact CD1-CD 3.55Å; Y247-K396 HydrophobicContact CD1-CG 4.42Å; Y247-K396 HydrophobicContact CD2-CB 3.68Å; Y247-K396 HydrophobicContact CE1-CB 4.27Å; Y247-K396 HydrophobicContact CE1-CD 3.95Å; Y247-K396 HydrophobicContact CE2-CB 3.95Å; Y247-K396 HydrophobicContact CG-CB 3.73Å; Y247-K396 HydrophobicContact CG-CD 3.95Å; Y247-K396 HydrophobicContact CG-CG 4.38Å; K396-C403 VanDerWaalsContact CE-SG 3.55Å
397	E	86.9	Confident	80.7	Confident	32 Å²	32	49.1 Å²	49.1	15%	0.15	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	110.2	173.1	-172.7	168.2	-133.8	0	0	108.2	K371 L375 C403 F404 H406	K371-E397 IonicContact NZ-OE1 2.61Å; K371-E397 PolarHBondContact NZ-OE1 2.88Å; K371-E397 IonicContact NZ-OE2 3.39Å; K371-E397 PolarHBondContact NZ-OE2 2.89Å; L375-E397 HydrophobicContact CD1-CB 4.31Å; L375-E397 HydrophobicContact CD2-CB 3.64Å; L375-E397 HydrophobicContact CD2-CG 3.9Å; E397-C403 CarbonylContact O-C 3.38Å; E397-C403 WeakPolarHBondContact O-CA 3.19Å; E397-F404 HydrophobicContact CB-CB 4.43Å; E397-F404 PolarHBondContact N-O 3.4Å; E397-F404 PolarHBondContact O-N 3.1Å; E397-H406 IonicContact OE2-CD2 2.79Å; E397-H406 IonicContact OE2-CE1 3.19Å; E397-H406 PolarHBondContact OE2-CE1 2.86Å; E397-H406 IonicContact OE2-NE2 2.69Å; E397-H406 PolarHBondContact OE2-NE2 2.96Å
398	A	81.2	Confident	81.7	Confident	71 Å²	71	41.7 Å²	41.7	59%	0.587	22%	0.221	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-122	116.2	-176.1	0	0	0	0	0	110.6	C403	A398-C403 HydrophobicContact CB-CB 4.46Å
399	E	75	Confident	82.6	Confident	122 Å²	122	40 Å²	40	57%	0.57	21%	0.212	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-144.1	126.6	-177	-176	176.6	-174.8	0	0	110.6	N401 T402	E399-N401 PolarHBondContact O-N 3.17Å; E399-T402 PolarHBondContact N-O 3.23Å; E399-T402 WeakPolarHBondContact O-CA 3.49Å; E399-T402 PolarHBondContact O-N 3.3Å; E399-T402 VanDerWaalsContact O-O 3.11Å; E399-T402 PolarHBondContact O-OG1 2.94Å
400	N	66.4	Low	83.1	Confident	137 Å²	137	36.7 Å²	36.7	73%	0.733	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	47	52.1	165.2	-62.9	-39.7	0	0	0	115.5	T402	N400-T402 PolarHBondContact O-N 3.25Å
401	N	66.2	Low	82.8	Confident	155 Å²	155	37.1 Å²	37.1	83%	0.829	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	69.9	1.6	-175.7	-53	-66.4	0	0	0	116.5	E399	E399-N401 PolarHBondContact O-N 3.17Å
402	T	71.4	Confident	81.8	Confident	59 Å²	59	41.2 Å²	41.2	36%	0.362	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	147	163.9	69.3	0	0	0	0	110.1	E399 N400 F404	E399-T402 PolarHBondContact N-O 3.23Å; E399-T402 WeakPolarHBondContact O-CA 3.49Å; E399-T402 PolarHBondContact O-N 3.3Å; E399-T402 VanDerWaalsContact O-O 3.11Å; E399-T402 PolarHBondContact O-OG1 2.94Å; N400-T402 PolarHBondContact O-N 3.25Å; T402-F404 WeakPolarHBondContact OG1-CE2 3.32Å
403	C	76.9	Confident	79.8	Confident	13 Å²	13	45.1 Å²	45.1	9%	0.088	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	113.4	179.9	-173.4	0	0	0	0	109.8	K396 E397 A398 S436 C437	K396-C403 VanDerWaalsContact CE-SG 3.55Å; E397-C403 CarbonylContact O-C 3.38Å; E397-C403 WeakPolarHBondContact O-CA 3.19Å; A398-C403 HydrophobicContact CB-CB 4.46Å; C403-S436 PolarHBondContact O-N 3.45Å; C403-C437 HydrophobicContact CB-CB 3.69Å; C403-C437 WeakPolarHBondContact CB-SG 3.22Å; C403-C437 PolarHBondContact O-N 2.8Å; C403-C437 PolarHBondContact O-SG 3.1Å; C403-C437 VanDerWaalsContact O-SG 3.38Å; C403-C437 WeakPolarHBondContact SG-CB 3.5Å; C403-C437 CovalentContact SG-SG 2.03Å; C403-C437 PolarHBondContact SG-SG 3.48Å
404	F	85.2	Confident	77.5	Confident	57 Å²	57	48 Å²	48	25%	0.25	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	135.2	-176.2	-55.6	-84.8	0	0	0	110.2	E397 T402 I433 Y434 N435	E397-F404 HydrophobicContact CB-CB 4.43Å; E397-F404 PolarHBondContact N-O 3.4Å; E397-F404 PolarHBondContact O-N 3.1Å; T402-F404 WeakPolarHBondContact OG1-CE2 3.32Å; F404-I433 HydrophobicContact CB-CG2 4.06Å; F404-I433 HydrophobicContact CD1-CG2 4.29Å; F404-I433 HydrophobicContact CG-CG2 4.49Å; F404-Y434 CarbonylContact C-O 3.26Å; F404-Y434 VanDerWaalsContact CA-O 3.28Å; F404-Y434 WeakPolarHBondContact CA-O 3.32Å; F404-N435 HydrophobicContact CD1-CB 3.82Å; F404-N435 HydrophobicContact CE1-CB 3.78Å
405	V	84.5	Confident	75.5	Confident	1 Å²	1	50.7 Å²	50.7	1%	0.006	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	121.5	168.1	178.3	0	0	0	0	107.5	G245 V394 A395 I433 Y434 S436	G245-V405 WeakPolarHBondContact O-CB 3.39Å; G245-V405 WeakPolarHBondContact O-CG2 3.44Å; V394-V405 HydrophobicContact CG1-CG1 3.39Å; A395-V405 WeakPolarHBondContact O-CA 3.29Å; V405-I433 WeakPolarHBondContact O-CA 3.38Å; V405-Y434 PolarHBondContact N-O 3.34Å; V405-Y434 PolarHBondContact O-N 3.34Å; V405-S436 VanDerWaalsContact CG2-OG 3.28Å; V405-S436 WeakPolarHBondContact CG2-OG 3.44Å
406	H	90	Very high	73.2	Confident	3 Å²	3	56.2 Å²	56.2	1%	0.014	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	125.9	177.3	-69.5	-107.4	0	0	0	108.5	L375 F377 V394 A395 E397 L431	L375-H406 HydrophobicContact CD1-CB 4.19Å; F377-H406 HydrophobicContact CE1-CB 4.07Å; F377-H406 HydrophobicContact CZ-CB 4.37Å; V394-H406 CarbonylContact C-O 3.51Å; V394-H406 VanDerWaalsContact CA-O 3.3Å; V394-H406 WeakPolarHBondContact CA-O 3.5Å; A395-H406 PolarHBondContact N-O 3.33Å; A395-H406 PolarHBondContact O-N 2.77Å; E397-H406 IonicContact OE2-CD2 2.79Å; E397-H406 IonicContact OE2-CE1 3.19Å; E397-H406 PolarHBondContact OE2-CE1 2.86Å; E397-H406 IonicContact OE2-NE2 2.69Å; E397-H406 PolarHBondContact OE2-NE2 2.96Å; H406-L431 HydrophobicContact CB-CD1 4.27Å
407	E	89	Confident	71.3	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	109.4	-174.1	-175.3	179.1	92.8	0	0	108.9	G245 R383 V392 W393 V394 W409 L431 R432 Y434	G245-E407 PolarHBondContact N-OE2 2.66Å; R383-E407 IonicContact CZ-OE2 3.83Å; R383-E407 IonicContact NH1-OE1 3.47Å; R383-E407 PolarHBondContact NH1-OE1 2.62Å; R383-E407 IonicContact NH1-OE2 3.54Å; R383-E407 PolarHBondContact NH1-OE2 3.4Å; R383-E407 IonicContact NH2-OE2 3.68Å; V392-E407 HydrophobicContact CG1-CG 3.61Å; W393-E407 CarbonylContact O-C 3.55Å; W393-E407 WeakPolarHBondContact O-CA 3.48Å; V394-E407 HydrophobicContact CG2-CB 4.22Å; V394-E407 HydrophobicContact CG2-CG 3.86Å; E407-W409 WeakPolarHBondContact OE1-CZ2 3.42Å; E407-W409 PolarHBondContact OE1-NE1 2.81Å; E407-L431 WeakPolarHBondContact O-CA 3.43Å; E407-R432 HydrophobicContact CB-CB 4.41Å; E407-R432 PolarHBondContact N-O 3.18Å; E407-R432 PolarHBondContact O-N 2.91Å; E407-Y434 HydrophobicContact CB-CE2 3.89Å; E407-Y434 PolarHBondContact OE1-OH 3.08Å
408	V	90.5	Very high	69.3	Low	0 Å²	0	62.7 Å²	62.7	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	125.1	-178.2	-175	0	0	0	0	108.9	F256 L370 F377 V392 W393 F410 P428 L431	F256-V408 HydrophobicContact CZ-CB 4.46Å; F256-V408 HydrophobicContact CZ-CG1 4.43Å; F256-V408 HydrophobicContact CZ-CG2 4.42Å; L370-V408 HydrophobicContact CD1-CG1 4.09Å; L370-V408 HydrophobicContact CD2-CG1 4.22Å; L370-V408 HydrophobicContact CD2-CG2 3.95Å; F377-V408 HydrophobicContact CD1-CG2 4.33Å; F377-V408 HydrophobicContact CE1-CG2 3.63Å; F377-V408 HydrophobicContact CZ-CG2 4.06Å; V392-V408 WeakPolarHBondContact CA-O 3.45Å; W393-V408 PolarHBondContact N-O 3.24Å; W393-V408 PolarHBondContact O-N 3.43Å; V408-F410 HydrophobicContact CB-CE2 4.07Å; V408-F410 HydrophobicContact CG1-CD2 3.85Å; V408-F410 HydrophobicContact CG1-CE1 4.35Å; V408-F410 HydrophobicContact CG1-CE2 3.39Å; V408-F410 HydrophobicContact CG1-CZ 3.69Å; V408-P428 HydrophobicContact CG1-CB 4.31Å; V408-L431 HydrophobicContact CG2-CD1 3.85Å
409	W	89.7	Confident	67.6	Low	1 Å²	1	64.9 Å²	64.9	0%	0.004	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	122.2	179.3	-60.2	65	0	0	0	108.1	E244 R383 L385 L390 V392 E407 W429 A430	E244-W409 HydrophobicContact CG-CZ2 4.35Å; R383-W409 HydrophobicContact CB-CE3 4.3Å; R383-W409 HydrophobicContact CB-CH2 3.62Å; R383-W409 HydrophobicContact CB-CZ3 3.38Å; R383-W409 HydrophobicContact CG-CH2 4.37Å; R383-W409 HydrophobicContact CG-CZ3 4.47Å; L385-W409 HydrophobicContact CB-CE3 3.63Å; L385-W409 HydrophobicContact CB-CH2 4.21Å; L385-W409 HydrophobicContact CB-CZ3 3.46Å; L385-W409 VanDerWaalsContact CB-CZ3 3.46Å; L385-W409 HydrophobicContact CD2-CB 4.45Å; L385-W409 HydrophobicContact CD2-CD2 3.8Å; L385-W409 HydrophobicContact CD2-CE3 3.74Å; L385-W409 HydrophobicContact CD2-CG 4.14Å; L385-W409 HydrophobicContact CD2-CZ3 4.23Å; L385-W409 HydrophobicContact CG-CE3 4.33Å; L385-W409 HydrophobicContact CG-CZ3 4.43Å; L390-W409 HydrophobicContact CB-CB 4.47Å; L390-W409 HydrophobicContact CB-CE3 4.2Å; L390-W409 HydrophobicContact CD1-CB 4.14Å; L390-W409 HydrophobicContact CD1-CE3 4.28Å; V392-W409 HydrophobicContact CG2-CD2 3.67Å; V392-W409 HydrophobicContact CG2-CE3 3.53Å; V392-W409 HydrophobicContact CG2-CG 4.19Å; V392-W409 HydrophobicContact CG2-CH2 4.43Å; V392-W409 HydrophobicContact CG2-CZ3 3.94Å; E407-W409 WeakPolarHBondContact OE1-CZ2 3.42Å; E407-W409 PolarHBondContact OE1-NE1 2.81Å; W409-W429 PolarHBondContact O-N 2.92Å; W409-A430 HydrophobicContact CB-CB 4.24Å; W409-A430 HydrophobicContact CG-CB 4.39Å; W409-A430 PolarHBondContact N-O 3.13Å; W409-A430 PolarHBondContact O-N 2.65Å
410	F	85	Confident	66.3	Low	0 Å²	0	61 Å²	61	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	130	-178.1	-75.5	-83.1	0	0	0	112	F256 P257 V259 L370 L390 E391 W393 V408 V426 L427 P428	F256-F410 HydrophobicContact CE1-CE2 4.11Å; F256-F410 AromaticContact CE1-CZ 3.66Å; F256-F410 HydrophobicContact CE1-CZ 3.66Å; F256-F410 AromaticContact CE2-CE2 3.8Å; F256-F410 HydrophobicContact CE2-CE2 3.8Å; F256-F410 HydrophobicContact CE2-CZ 4.22Å; F256-F410 AromaticContact CZ-CE2 3.5Å; F256-F410 HydrophobicContact CZ-CE2 3.5Å; F256-F410 VanDerWaalsContact CZ-CE2 3.5Å; F256-F410 AromaticContact CZ-CZ 3.47Å; F256-F410 HydrophobicContact CZ-CZ 3.47Å; F256-F410 VanDerWaalsContact CZ-CZ 3.47Å; P257-F410 HydrophobicContact CB-CE1 4.23Å; P257-F410 HydrophobicContact CB-CE2 4.4Å; P257-F410 HydrophobicContact CB-CZ 4.16Å; P257-F410 HydrophobicContact CG-CD2 4.06Å; P257-F410 HydrophobicContact CG-CE2 3.91Å; P257-F410 HydrophobicContact CG-CG 4.44Å; P257-F410 HydrophobicContact CG-CZ 4.16Å; V259-F410 HydrophobicContact CG2-CE1 4.46Å; L370-F410 HydrophobicContact CD1-CE1 4.49Å; L370-F410 HydrophobicContact CD1-CZ 3.97Å; L390-F410 WeakPolarHBondContact CB-O 3.37Å; E391-F410 PolarHBondContact N-O 2.89Å; E391-F410 PolarHBondContact O-N 3.02Å; W393-F410 AromaticContact CD1-CD2 3.7Å; W393-F410 AromaticContact CD1-CE2 3.99Å; W393-F410 HydrophobicContact CG-CD2 4.46Å; W393-F410 HydrophobicContact CG-CE2 4.37Å; V408-F410 HydrophobicContact CB-CE2 4.07Å; V408-F410 HydrophobicContact CG1-CD2 3.85Å; V408-F410 HydrophobicContact CG1-CE1 4.35Å; V408-F410 HydrophobicContact CG1-CE2 3.39Å; V408-F410 HydrophobicContact CG1-CZ 3.69Å; F410-V426 HydrophobicContact CB-CG1 3.83Å; F410-V426 HydrophobicContact CD1-CG1 3.54Å; F410-V426 HydrophobicContact CE1-CG1 4.27Å; F410-V426 HydrophobicContact CG-CG1 3.88Å; F410-L427 CarbonylContact C-O 3.51Å; F410-L427 WeakPolarHBondContact CA-O 3.37Å; F410-L427 VanDerWaalsContact CD1-C 3.47Å; F410-P428 HydrophobicContact CD1-CB 4.25Å; F410-P428 HydrophobicContact CE1-CB 4.03Å; F410-P428 HydrophobicContact CE1-CG 4.5Å
411	N	76.8	Confident	65.2	Low	11 Å²	11	61.6 Å²	61.6	6%	0.059	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	123.4	165	-167.2	-26.5	0	0	0	108.7	L390 A413 V414 L427 W429	L390-N411 HydrophobicContact CD2-CB 3.78Å; N411-A413 PolarHBondContact OD1-N 2.9Å; N411-V414 PolarHBondContact OD1-N 3.24Å; N411-L427 PolarHBondContact N-O 3.31Å; N411-L427 PolarHBondContact O-N 2.92Å; N411-L427 VanDerWaalsContact O-N 3.07Å; N411-W429 HydrophobicContact CB-CB 4.37Å; N411-W429 HydrophobicContact CB-CE3 4.18Å
412	K	61.9	Low	64.2	Low	114 Å²	114	58.6 Å²	58.6	50%	0.496	32%	0.318	S	S	.	.	S	Bend	trans	-103.2	-30	-175.6	-166.1	162.8	-171.6	165.8	0	113.4	E391 V426	E391-K412 VanDerWaalsContact CD-CD 3.43Å; E391-K412 WeakPolarHBondContact OE1-CD 3.5Å; E391-K412 WeakPolarHBondContact OE1-CE 3.41Å; E391-K412 IonicContact OE1-NZ 3.9Å; E391-K412 PolarHBondContact OE1-NZ 2.99Å; E391-K412 WeakPolarHBondContact OE2-CD 3.34Å; E391-K412 IonicContact OE2-NZ 3.42Å; E391-K412 PolarHBondContact OE2-NZ 3.18Å; K412-V426 HydrophobicContact CG-CG2 4.37Å
413	A	44.9	Very low	63.1	Low	83 Å²	83	57.7 Å²	57.7	69%	0.686	32%	0.315	S	S	*	.	S	Bend	trans	-164	30.7	-169.8	0	0	0	0	0	116.6	N411	N411-A413 PolarHBondContact OD1-N 2.9Å
414	V	42.7	Very low	62.1	Low	73 Å²	73	64.9 Å²	64.9	44%	0.442	35%	0.352	S	S	.	.			trans	-114.8	36.5	174.1	-154	0	0	0	0	113.4	N411	N411-V414 PolarHBondContact OD1-N 3.24Å
415	L	44.5	Very low	60.9	Low	59 Å²	59	63.6 Å²	63.6	31%	0.309	35%	0.349	S	S	.	.			trans	-86.3	131.2	163.1	-72.9	160.9	0	0	0	109.4	D417 L420 R421 L427	L415-D417 VanDerWaalsContact C-N 3.29Å; L415-L420 HydrophobicContact CB-CB 4.28Å; L415-L420 HydrophobicContact CD1-CB 3.89Å; L415-L420 HydrophobicContact CD1-CD1 3.98Å; L415-L420 HydrophobicContact CD1-CG 4.49Å; L415-L420 HydrophobicContact CD2-CD1 4.41Å; L415-R421 WeakPolarHBondContact O-CG 3.28Å; L415-R421 PolarHBondContact O-NE 3.26Å; L415-L427 HydrophobicContact CD1-CD1 4.38Å
416	H	41.5	Very low	60.1	Low	116 Å²	116	65 Å²	65	54%	0.537	36%	0.357	S	S	.	.			trans	-83.8	-5.6	175.9	-72.6	-90.3	0	0	0	113.2	R795	H416-R795 PolarHBondContact CD2-NH2 3.27Å; H416-R795 PolarHBondContact NE2-NH2 3.34Å
417	D	46.8	Very low	59.2	Low	85 Å²	85	65.7 Å²	65.7	46%	0.455	36%	0.361	S	S	.	.			trans	-81.4	117.8	175.7	-165.9	-33.4	0	0	0	109.6	L415 V419 L420 R421	L415-D417 VanDerWaalsContact C-N 3.29Å; D417-V419 PolarHBondContact O-N 3.17Å; D417-V419 VanDerWaalsContact OD1-CB 3.3Å; D417-V419 WeakPolarHBondContact OD1-CB 3.01Å; D417-V419 WeakPolarHBondContact OD1-CG2 3.43Å; D417-V419 PolarHBondContact OD1-N 2.84Å; D417-L420 HydrophobicContact CB-CB 4.41Å; D417-L420 HydrophobicContact CB-CD1 4.24Å; D417-L420 HydrophobicContact CB-CG 4.44Å; D417-L420 PolarHBondContact O-N 2.75Å; D417-L420 VanDerWaalsContact O-N 3.1Å; D417-R421 PolarHBondContact O-N 2.64Å
418	E	44.6	Very low	59	Low	157 Å²	157	65.8 Å²	65.8	73%	0.734	36%	0.362	S	S	*	.	H	α-helix	trans	-60.3	-29.8	179.8	-63.6	-174.8	133.5	0	0	112.2	L420 R421 A422	E418-L420 VanDerWaalsContact C-N 3.28Å; E418-L420 PolarHBondContact O-N 2.92Å; E418-R421 PolarHBondContact O-N 3.2Å; E418-A422 PolarHBondContact O-N 2.72Å
419	V	45	Very low	58.7	Low	116 Å²	116	69.1 Å²	69.1	70%	0.703	37%	0.374	S	S	*	.	H	α-helix	trans	-66.2	-32.4	177.9	-175.2	0	0	0	0	111.4	D417	D417-V419 PolarHBondContact O-N 3.17Å; D417-V419 VanDerWaalsContact OD1-CB 3.3Å; D417-V419 WeakPolarHBondContact OD1-CB 3.01Å; D417-V419 WeakPolarHBondContact OD1-CG2 3.43Å; D417-V419 PolarHBondContact OD1-N 2.84Å
420	L	48.3	Very low	58.6	Low	41 Å²	41	69 Å²	69	22%	0.215	37%	0.374	C	S	.	.	H	α-helix	trans	-90.6	-22.7	178.6	-65.6	169.9	0	0	0	112.7	L415 D417 E418 A422 S423 N457	L415-L420 HydrophobicContact CB-CB 4.28Å; L415-L420 HydrophobicContact CD1-CB 3.89Å; L415-L420 HydrophobicContact CD1-CD1 3.98Å; L415-L420 HydrophobicContact CD1-CG 4.49Å; L415-L420 HydrophobicContact CD2-CD1 4.41Å; D417-L420 HydrophobicContact CB-CB 4.41Å; D417-L420 HydrophobicContact CB-CD1 4.24Å; D417-L420 HydrophobicContact CB-CG 4.44Å; D417-L420 PolarHBondContact O-N 2.75Å; D417-L420 VanDerWaalsContact O-N 3.1Å; E418-L420 VanDerWaalsContact C-N 3.28Å; E418-L420 PolarHBondContact O-N 2.92Å; L420-A422 VanDerWaalsContact C-N 3.34Å; L420-S423 PolarHBondContact O-N 2.83Å; L420-S423 PolarHBondContact O-OG 2.78Å; L420-N457 HydrophobicContact CD2-CB 4.47Å
421	R	44.4	Very low	58.8	Low	149 Å²	149	69.4 Å²	69.4	56%	0.562	38%	0.376	S	S	*	.	H	α-helix	trans	-68.8	-30.7	169.7	-71.3	177.6	176.6	-173.5	-7.3	113.3	L415 D417 E418 S423	L415-R421 WeakPolarHBondContact O-CG 3.28Å; L415-R421 PolarHBondContact O-NE 3.26Å; D417-R421 PolarHBondContact O-N 2.64Å; E418-R421 PolarHBondContact O-N 3.2Å; R421-S423 PolarHBondContact O-N 2.66Å
422	A	44.1	Very low	59.4	Low	92 Å²	92	70.3 Å²	70.3	76%	0.76	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-0.2	177.7	0	0	0	0	0	113.6	E418 L420	E418-A422 PolarHBondContact O-N 2.72Å; L420-A422 VanDerWaalsContact C-N 3.34Å
423	S	48.9	Very low	60.6	Low	41 Å²	41	65.2 Å²	65.2	29%	0.287	36%	0.356	S	S	.	.	S	Bend	trans	-125.1	126.6	179.6	60.4	0	0	0	0	109.9	L420 R421 V425	L420-S423 PolarHBondContact O-N 2.83Å; L420-S423 PolarHBondContact O-OG 2.78Å; R421-S423 PolarHBondContact O-N 2.66Å; S423-V425 PolarHBondContact O-N 3.26Å; S423-V425 VanDerWaalsContact OG-CG2 3.27Å; S423-V425 WeakPolarHBondContact OG-CG2 3.49Å
424	D	55.4	Low	62.4	Low	164 Å²	164	62 Å²	62	88%	0.877	33%	0.327	S	S	*	.			trans	-70	67	177.9	-63.9	-62	0	0	0	111.7
425	V	60.3	Low	64.1	Low	30 Å²	30	59.9 Å²	59.9	18%	0.182	31%	0.313	C	S	.	.			trans	-108.7	93.5	-161.9	161.6	0	0	0	0	109.6	F261 S423 L427	F261-V425 HydrophobicContact CE1-CG1 3.88Å; F261-V425 HydrophobicContact CE2-CG1 3.89Å; F261-V425 HydrophobicContact CZ-CG1 3.18Å; S423-V425 PolarHBondContact O-N 3.26Å; S423-V425 VanDerWaalsContact OG-CG2 3.27Å; S423-V425 WeakPolarHBondContact OG-CG2 3.49Å; V425-L427 HydrophobicContact CG1-CD1 4.21Å; V425-L427 HydrophobicContact CG1-CG 4.21Å
426	V	67.5	Low	65.1	Low	29 Å²	29	59.2 Å²	59.2	18%	0.176	31%	0.313	C	S	.	.			trans	-78.1	122.6	175.3	-172.2	0	0	0	0	108.9	P257 F410 K412	P257-V426 HydrophobicContact CB-CB 4.24Å; P257-V426 HydrophobicContact CB-CG1 3.69Å; P257-V426 HydrophobicContact CG-CG1 4.27Å; F410-V426 HydrophobicContact CB-CG1 3.83Å; F410-V426 HydrophobicContact CD1-CG1 3.54Å; F410-V426 HydrophobicContact CE1-CG1 4.27Å; F410-V426 HydrophobicContact CG-CG1 3.88Å; K412-V426 HydrophobicContact CG-CG2 4.37Å
427	L	71.5	Confident	66	Low	19 Å²	19	55 Å²	55	10%	0.099	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	130.7	-175	-96.4	169.7	0	0	0	111	F261 F410 N411 L415 V425 W429 P455	F261-L427 HydrophobicContact CD2-CD2 4.26Å; F261-L427 HydrophobicContact CE2-CD1 4.25Å; F261-L427 HydrophobicContact CE2-CD2 3.32Å; F261-L427 HydrophobicContact CE2-CG 3.7Å; F261-L427 HydrophobicContact CZ-CD1 3.96Å; F261-L427 HydrophobicContact CZ-CD2 3.89Å; F261-L427 HydrophobicContact CZ-CG 3.9Å; F410-L427 CarbonylContact C-O 3.51Å; F410-L427 WeakPolarHBondContact CA-O 3.37Å; F410-L427 VanDerWaalsContact CD1-C 3.47Å; N411-L427 PolarHBondContact N-O 3.31Å; N411-L427 PolarHBondContact O-N 2.92Å; N411-L427 VanDerWaalsContact O-N 3.07Å; L415-L427 HydrophobicContact CD1-CD1 4.38Å; V425-L427 HydrophobicContact CG1-CD1 4.21Å; V425-L427 HydrophobicContact CG1-CG 4.21Å; L427-W429 PolarHBondContact O-N 3Å; L427-P455 HydrophobicContact CB-CG 4.45Å; L427-P455 HydrophobicContact CD1-CB 4.1Å; L427-P455 HydrophobicContact CD1-CG 3.66Å; L427-P455 HydrophobicContact CD2-CB 3.45Å; L427-P455 VanDerWaalsContact CD2-CB 3.45Å; L427-P455 HydrophobicContact CD2-CG 3.6Å; L427-P455 HydrophobicContact CG-CB 4.38Å; L427-P455 HydrophobicContact CG-CG 4.11Å
428	P	84.3	Confident	66.3	Low	2 Å²	2	53.1 Å²	53.1	1%	0.013	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	130.3	169	28.5	-32.9	0	0	0	108.1	V259 L369 V408 F410 F453	V259-P428 HydrophobicContact CG2-CG 4.47Å; L369-P428 HydrophobicContact CD1-CG 4.28Å; V408-P428 HydrophobicContact CG1-CB 4.31Å; F410-P428 HydrophobicContact CD1-CB 4.25Å; F410-P428 HydrophobicContact CE1-CB 4.03Å; F410-P428 HydrophobicContact CE1-CG 4.5Å; P428-F453 HydrophobicContact CB-CD2 3.91Å; P428-F453 HydrophobicContact CB-CE2 4.11Å; P428-F453 HydrophobicContact CB-CG 4.43Å; P428-F453 HydrophobicContact CG-CD2 4.37Å; P428-F453 HydrophobicContact CG-CG 4.43Å; P428-F453 WeakPolarHBondContact O-CB 3.37Å
429	W	84.2	Confident	66.4	Low	69 Å²	69	49.4 Å²	49.4	26%	0.261	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	-47.1	177.6	-174.5	-96	0	0	0	110.4	M388 L390 W409 N411 L427 F453	M388-W429 HydrophobicContact CE-CD2 4.46Å; M388-W429 HydrophobicContact CE-CH2 4.25Å; M388-W429 HydrophobicContact CE-CZ2 3.51Å; M388-W429 HydrophobicContact SD-CZ2 4.37Å; L390-W429 HydrophobicContact CD1-CB 3.95Å; L390-W429 HydrophobicContact CD1-CG 3.8Å; W409-W429 PolarHBondContact O-N 2.92Å; N411-W429 HydrophobicContact CB-CB 4.37Å; N411-W429 HydrophobicContact CB-CE3 4.18Å; L427-W429 PolarHBondContact O-N 3Å; W429-F453 PolarHBondContact O-N 2.84Å
430	A	87.9	Confident	66.3	Low	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	144.7	174.9	0	0	0	0	0	111.5	L385 W409 Y451	L385-A430 HydrophobicContact CD2-CB 4.02Å; W409-A430 HydrophobicContact CB-CB 4.24Å; W409-A430 HydrophobicContact CG-CB 4.39Å; W409-A430 PolarHBondContact N-O 3.13Å; W409-A430 PolarHBondContact O-N 2.65Å; A430-Y451 CarbonylContact C-O 3.52Å; A430-Y451 WeakPolarHBondContact CA-O 3.33Å
431	L	90.1	Very high	66.5	Low	8 Å²	8	53.8 Å²	53.8	4%	0.042	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	122.1	159.7	161.6	66.2	0	0	0	108	L302 L370 H406 E407 V408 I433 Y451 F453	L302-L431 HydrophobicContact CD2-CD2 4.06Å; L370-L431 HydrophobicContact CD2-CD2 4.33Å; H406-L431 HydrophobicContact CB-CD1 4.27Å; E407-L431 WeakPolarHBondContact O-CA 3.43Å; V408-L431 HydrophobicContact CG2-CD1 3.85Å; L431-I433 HydrophobicContact CD1-CD1 4.47Å; L431-I433 HydrophobicContact CD1-CG1 3.88Å; L431-I433 HydrophobicContact CD2-CD1 4.09Å; L431-I433 HydrophobicContact CD2-CG1 4.3Å; L431-I433 HydrophobicContact CG-CD1 4.24Å; L431-I433 HydrophobicContact CG-CG1 3.9Å; L431-Y451 HydrophobicContact CD2-CD2 4.16Å; L431-Y451 HydrophobicContact CG-CD2 4.12Å; L431-Y451 PolarHBondContact N-O 2.86Å; L431-Y451 PolarHBondContact O-N 3.38Å; L431-F453 HydrophobicContact CB-CE2 3.73Å; L431-F453 HydrophobicContact CB-CZ 4.22Å
432	R	88.5	Confident	66.5	Low	30 Å²	30	49.7 Å²	49.7	11%	0.113	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	127	174.3	-57.3	-168.9	166.2	-179.2	-0.8	108.9	E244 E407 Y434 F450	E244-R432 IonicContact OE1-NH1 2.78Å; E244-R432 PolarHBondContact OE1-NH1 3.27Å; E244-R432 IonicContact OE2-CZ 2.69Å; E244-R432 IonicContact OE2-NH1 3.14Å; E244-R432 PolarHBondContact OE2-NH1 2.79Å; E407-R432 HydrophobicContact CB-CB 4.41Å; E407-R432 PolarHBondContact N-O 3.18Å; E407-R432 PolarHBondContact O-N 2.91Å; R432-Y434 HydrophobicContact CB-CD2 4.36Å; R432-Y434 HydrophobicContact CB-CE2 3.5Å; R432-Y434 VanDerWaalsContact CB-CE2 3.5Å; R432-Y434 WeakPolarHBondContact CD-OH 3.24Å; R432-F450 HydrophobicContact CB-CD1 3.96Å; R432-F450 HydrophobicContact CB-CE1 4.23Å; R432-F450 HydrophobicContact CG-CD1 3.59Å; R432-F450 HydrophobicContact CG-CE1 3.93Å; R432-F450 HydrophobicContact CG-CG 4.5Å
433	I	88.2	Confident	66.7	Low	6 Å²	6	52.7 Å²	52.7	3%	0.031	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	115.9	-178.9	-49.5	-179.1	0	0	0	109	V301 F404 V405 L431 Y448 T449 Y451	V301-I433 HydrophobicContact CB-CD1 3.55Å; V301-I433 HydrophobicContact CG1-CD1 3.48Å; V301-I433 VanDerWaalsContact CG1-CD1 3.48Å; V301-I433 HydrophobicContact CG2-CD1 4.15Å; F404-I433 HydrophobicContact CB-CG2 4.06Å; F404-I433 HydrophobicContact CD1-CG2 4.29Å; F404-I433 HydrophobicContact CG-CG2 4.49Å; V405-I433 WeakPolarHBondContact O-CA 3.38Å; L431-I433 HydrophobicContact CD1-CD1 4.47Å; L431-I433 HydrophobicContact CD1-CG1 3.88Å; L431-I433 HydrophobicContact CD2-CD1 4.09Å; L431-I433 HydrophobicContact CD2-CG1 4.3Å; L431-I433 HydrophobicContact CG-CD1 4.24Å; L431-I433 HydrophobicContact CG-CG1 3.9Å; I433-Y448 VanDerWaalsContact O-CA 3.25Å; I433-Y448 WeakPolarHBondContact O-CA 3.41Å; I433-T449 PolarHBondContact N-O 2.8Å; I433-T449 PolarHBondContact O-N 3.01Å; I433-Y451 HydrophobicContact CD1-CD2 4.19Å; I433-Y451 HydrophobicContact CD1-CE2 3.63Å; I433-Y451 HydrophobicContact CG1-CD2 4.42Å; I433-Y451 HydrophobicContact CG1-CE2 4.2Å
434	Y	81.5	Confident	66.5	Low	17 Å²	17	57.9 Å²	57.9	7%	0.067	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	127.2	-174.5	-48.7	-104.7	0	0	0	110.7	E244 G245 F404 V405 E407 R432 S436	E244-Y434 HydrophobicContact CB-CE1 4.32Å; E244-Y434 PolarHBondContact OE2-OH 3.35Å; G245-Y434 VanDerWaalsContact CA-CG 3.48Å; F404-Y434 CarbonylContact C-O 3.26Å; F404-Y434 VanDerWaalsContact CA-O 3.28Å; F404-Y434 WeakPolarHBondContact CA-O 3.32Å; V405-Y434 PolarHBondContact N-O 3.34Å; V405-Y434 PolarHBondContact O-N 3.34Å; E407-Y434 HydrophobicContact CB-CE2 3.89Å; E407-Y434 PolarHBondContact OE1-OH 3.08Å; R432-Y434 HydrophobicContact CB-CD2 4.36Å; R432-Y434 HydrophobicContact CB-CE2 3.5Å; R432-Y434 VanDerWaalsContact CB-CE2 3.5Å; R432-Y434 WeakPolarHBondContact CD-OH 3.24Å; Y434-S436 PolarHBondContact O-N 2.74Å; Y434-S436 VanDerWaalsContact O-N 3.14Å
435	N	78	Confident	66.1	Low	27 Å²	27	57.7 Å²	57.7	14%	0.144	29%	0.289	C	S	.	.			trans	-85.1	76.9	171.9	-174.1	-1.4	0	0	0	110.2	F404 T446 T447	F404-N435 HydrophobicContact CD1-CB 3.82Å; F404-N435 HydrophobicContact CE1-CB 3.78Å; N435-T446 WeakPolarHBondContact O-CG2 3.47Å; N435-T447 WeakPolarHBondContact CB-OG1 3.41Å; N435-T447 PolarHBondContact N-O 3.03Å; N435-T447 PolarHBondContact ND2-OG1 2.75Å
436	S	65.4	Low	65.7	Low	45 Å²	45	57.9 Å²	57.9	32%	0.315	29%	0.29	S	S	.	.			trans	-109.6	-30.9	-166	58.4	0	0	0	0	115.3	G245 C403 V405 Y434 N438	G245-S436 WeakPolarHBondContact O-CB 3.12Å; G245-S436 PolarHBondContact O-OG 2.71Å; C403-S436 PolarHBondContact O-N 3.45Å; V405-S436 VanDerWaalsContact CG2-OG 3.28Å; V405-S436 WeakPolarHBondContact CG2-OG 3.44Å; Y434-S436 PolarHBondContact O-N 2.74Å; Y434-S436 VanDerWaalsContact O-N 3.14Å; S436-N438 VanDerWaalsContact C-N 3.27Å; S436-N438 PolarHBondContact O-N 2.95Å; S436-N438 VanDerWaalsContact O-N 3.15Å
437	C	60.6	Low	65.3	Low	29 Å²	29	58.3 Å²	58.3	20%	0.196	29%	0.293	C	S	.	.			trans	-87.8	27.2	-171.2	31.6	0	0	0	0	115.3	C403	C403-C437 HydrophobicContact CB-CB 3.69Å; C403-C437 WeakPolarHBondContact CB-SG 3.22Å; C403-C437 PolarHBondContact O-N 2.8Å; C403-C437 PolarHBondContact O-SG 3.1Å; C403-C437 VanDerWaalsContact O-SG 3.38Å; C403-C437 WeakPolarHBondContact SG-CB 3.5Å; C403-C437 CovalentContact SG-SG 2.03Å; C403-C437 PolarHBondContact SG-SG 3.48Å
438	N	54	Low	65.1	Low	44 Å²	44	60.9 Å²	60.9	24%	0.235	30%	0.302	C	S	.	.			trans	-104.2	102.5	164.6	-176.2	-21.2	0	0	0	110.1	S436 K440 L441	S436-N438 VanDerWaalsContact C-N 3.27Å; S436-N438 PolarHBondContact O-N 2.95Å; S436-N438 VanDerWaalsContact O-N 3.15Å; N438-K440 PolarHBondContact O-N 2.94Å; N438-K440 WeakPolarHBondContact OD1-CB 3.25Å; N438-K440 PolarHBondContact OD1-N 2.83Å; N438-L441 HydrophobicContact CB-CD1 4.22Å; N438-L441 HydrophobicContact CB-CG 4.37Å; N438-L441 PolarHBondContact O-N 2.63Å
439	P	46.4	Very low	64.5	Low	80 Å²	80	61.7 Å²	61.7	52%	0.519	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	5	-175.1	30.2	-36.7	0	0	0	114.7	G103 R104	G103-P439 WeakPolarHBondContact O-CB 3.31Å; R104-P439 HydrophobicContact CG-CB 4.35Å
440	K	43.8	Very low	64.2	Low	189 Å²	189	60.2 Å²	60.2	82%	0.822	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.4	-5	171.3	-57.7	179.4	-179.3	176.1	0	113.1	N438	N438-K440 PolarHBondContact O-N 2.94Å; N438-K440 WeakPolarHBondContact OD1-CB 3.25Å; N438-K440 PolarHBondContact OD1-N 2.83Å
441	L	50.9	Low	63.7	Low	59 Å²	59	60.2 Å²	60.2	31%	0.309	30%	0.303	S	S	.	.	S	Bend	trans	-96.7	124.1	172	-68.5	177.2	0	0	0	109.7	N438 R445	N438-L441 HydrophobicContact CB-CD1 4.22Å; N438-L441 HydrophobicContact CB-CG 4.37Å; N438-L441 PolarHBondContact O-N 2.63Å; L441-R445 HydrophobicContact CD2-CB 4.22Å
442	P	45.1	Very low	63.2	Low	64 Å²	64	61.7 Å²	61.7	42%	0.416	31%	0.31	S	S	.	.			trans	-56.1	149.9	162.7	-22.9	33.9	0	0	0	110.8	D444 R445	P442-D444 PolarHBondContact O-N 3.34Å; P442-D444 VanDerWaalsContact O-N 3.15Å; P442-R445 WeakPolarHBondContact O-CB 3.38Å; P442-R445 PolarHBondContact O-N 3.01Å
443	Q	49.5	Very low	62.8	Low	154 Å²	154	60.4 Å²	60.4	72%	0.72	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-53.1	-37.6	178.5	-85.6	173.4	-53.1	0	0	112.2	R445 T446	Q443-R445 PolarHBondContact O-N 2.82Å; Q443-T446 WeakPolarHBondContact O-CB 3.32Å; Q443-T446 WeakPolarHBondContact O-CG2 3.3Å; Q443-T446 PolarHBondContact O-N 2.76Å; Q443-T446 PolarHBondContact O-OG1 2.82Å
444	D	43.3	Very low	62.1	Low	151 Å²	151	64.2 Å²	64.2	81%	0.807	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-56.9	-13.1	174.8	-35.1	-31.1	0	0	0	114.8	P442	P442-D444 PolarHBondContact O-N 3.34Å; P442-D444 VanDerWaalsContact O-N 3.15Å
445	R	46.5	Very low	61.5	Low	159 Å²	159	65.3 Å²	65.3	60%	0.6	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-106	-4.3	178.2	-64.1	-165	177.6	-176.9	-2.6	114.2	L441 P442 Q443 T447	L441-R445 HydrophobicContact CD2-CB 4.22Å; P442-R445 WeakPolarHBondContact O-CB 3.38Å; P442-R445 PolarHBondContact O-N 3.01Å; Q443-R445 PolarHBondContact O-N 2.82Å; R445-T447 PolarHBondContact O-N 3.24Å; R445-T447 VanDerWaalsContact O-N 3.17Å
446	T	53.7	Low	60.9	Low	35 Å²	35	68.6 Å²	68.6	22%	0.215	35%	0.348	C	S	.	.			trans	-60.4	117.3	178.6	58.4	0	0	0	0	109.6	N435 Q443 Y448	N435-T446 WeakPolarHBondContact O-CG2 3.47Å; Q443-T446 WeakPolarHBondContact O-CB 3.32Å; Q443-T446 WeakPolarHBondContact O-CG2 3.3Å; Q443-T446 PolarHBondContact O-N 2.76Å; Q443-T446 PolarHBondContact O-OG1 2.82Å; T446-Y448 PolarHBondContact O-N 2.82Å
447	T	57.8	Low	61	Low	37 Å²	37	69.5 Å²	69.5	23%	0.227	35%	0.349	C	S	.	.			trans	-78	113.5	171.6	45.1	0	0	0	0	108.2	K274 N435 R445	K274-T447 HydrophobicContact CD-CG2 3.5Å; K274-T447 HydrophobicContact CG-CG2 4.03Å; K274-T447 VanDerWaalsContact NZ-CG2 3.27Å; N435-T447 WeakPolarHBondContact CB-OG1 3.41Å; N435-T447 PolarHBondContact N-O 3.03Å; N435-T447 PolarHBondContact ND2-OG1 2.75Å; R445-T447 PolarHBondContact O-N 3.24Å; R445-T447 VanDerWaalsContact O-N 3.17Å
448	Y	67.6	Low	61.2	Low	73 Å²	73	69 Å²	69	29%	0.286	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	141.3	160.6	57.9	-93.5	0	0	0	111.1	H273 I433 T446 F450	H273-Y448 HydrophobicContact CB-CD1 3.98Å; H273-Y448 HydrophobicContact CB-CD2 3.71Å; H273-Y448 HydrophobicContact CB-CE1 3.95Å; H273-Y448 HydrophobicContact CB-CE2 3.67Å; H273-Y448 HydrophobicContact CB-CG 3.9Å; H273-Y448 VanDerWaalsContact CB-O 3.31Å; H273-Y448 WeakPolarHBondContact CB-O 3.36Å; H273-Y448 AromaticContact CD2-CE1 3.63Å; H273-Y448 AromaticContact CE1-CE1 3.8Å; H273-Y448 AromaticContact CE1-CZ 3.65Å; H273-Y448 PolarHBondContact CE1-OH 3.14Å; H273-Y448 VanDerWaalsContact CE1-OH 3.26Å; H273-Y448 AromaticContact CG-CD1 3.91Å; H273-Y448 AromaticContact CG-CE1 3.44Å; H273-Y448 VanDerWaalsContact CG-CE1 3.44Å; H273-Y448 AromaticContact CG-CE2 3.79Å; H273-Y448 AromaticContact CG-CZ 3.4Å; H273-Y448 VanDerWaalsContact CG-CZ 3.4Å; H273-Y448 PolarHBondContact N-O 2.79Å; H273-Y448 VanDerWaalsContact N-O 3.08Å; H273-Y448 AromaticContact ND1-CE1 3.56Å; H273-Y448 AromaticContact ND1-CE2 3.69Å; H273-Y448 AromaticContact ND1-CZ 3.13Å; H273-Y448 PolarHBondContact ND1-OH 3.09Å; H273-Y448 AromaticContact NE2-CE1 3.88Å; I433-Y448 VanDerWaalsContact O-CA 3.25Å; I433-Y448 WeakPolarHBondContact O-CA 3.41Å; T446-Y448 PolarHBondContact O-N 2.82Å; Y448-F450 HydrophobicContact CD2-CD1 4.02Å; Y448-F450 HydrophobicContact CD2-CD2 4.2Å; Y448-F450 AromaticContact CD2-CE1 3.42Å; Y448-F450 HydrophobicContact CD2-CE1 3.42Å; Y448-F450 VanDerWaalsContact CD2-CE1 3.42Å; Y448-F450 AromaticContact CD2-CE2 3.62Å; Y448-F450 HydrophobicContact CD2-CE2 3.62Å; Y448-F450 HydrophobicContact CD2-CG 4.4Å; Y448-F450 AromaticContact CD2-CZ 3.2Å; Y448-F450 HydrophobicContact CD2-CZ 3.2Å; Y448-F450 HydrophobicContact CE2-CD2 4.28Å; Y448-F450 HydrophobicContact CE2-CE1 4.06Å; Y448-F450 AromaticContact CE2-CE2 3.45Å; Y448-F450 HydrophobicContact CE2-CE2 3.45Å; Y448-F450 VanDerWaalsContact CE2-CE2 3.45Å; Y448-F450 AromaticContact CE2-CZ 3.34Å; Y448-F450 HydrophobicContact CE2-CZ 3.34Å; Y448-F450 HydrophobicContact CG-CE1 4.02Å; Y448-F450 HydrophobicContact CG-CZ 4.07Å
449	T	70.8	Confident	61.9	Low	20 Å²	20	71.4 Å²	71.4	12%	0.123	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	128.2	162.6	-52.1	0	0	0	0	108.2	V270 L271 Q272 I433 Y451	V270-T449 HydrophobicContact CG1-CG2 3.93Å; L271-T449 WeakPolarHBondContact O-CA 3.07Å; Q272-T449 HydrophobicContact CG-CG2 3.66Å; I433-T449 PolarHBondContact N-O 2.8Å; I433-T449 PolarHBondContact O-N 3.01Å; T449-Y451 HydrophobicContact CG2-CD2 4.18Å; T449-Y451 HydrophobicContact CG2-CE1 4.45Å; T449-Y451 HydrophobicContact CG2-CE2 3.47Å; T449-Y451 VanDerWaalsContact CG2-CE2 3.47Å
450	F	78.2	Confident	63.1	Low	38 Å²	38	69.5 Å²	69.5	17%	0.167	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	144.3	172.1	-50.4	-37.7	0	0	0	110.3	V270 L271 R432 Y448	V270-F450 WeakPolarHBondContact CA-O 3.16Å; L271-F450 HydrophobicContact CB-CB 4.25Å; L271-F450 HydrophobicContact CB-CD2 4.36Å; L271-F450 HydrophobicContact CD1-CD2 4.43Å; L271-F450 PolarHBondContact N-O 3.01Å; L271-F450 PolarHBondContact O-N 3.19Å; R432-F450 HydrophobicContact CB-CD1 3.96Å; R432-F450 HydrophobicContact CB-CE1 4.23Å; R432-F450 HydrophobicContact CG-CD1 3.59Å; R432-F450 HydrophobicContact CG-CE1 3.93Å; R432-F450 HydrophobicContact CG-CG 4.5Å; Y448-F450 HydrophobicContact CD2-CD1 4.02Å; Y448-F450 HydrophobicContact CD2-CD2 4.2Å; Y448-F450 AromaticContact CD2-CE1 3.42Å; Y448-F450 HydrophobicContact CD2-CE1 3.42Å; Y448-F450 VanDerWaalsContact CD2-CE1 3.42Å; Y448-F450 AromaticContact CD2-CE2 3.62Å; Y448-F450 HydrophobicContact CD2-CE2 3.62Å; Y448-F450 HydrophobicContact CD2-CG 4.4Å; Y448-F450 AromaticContact CD2-CZ 3.2Å; Y448-F450 HydrophobicContact CD2-CZ 3.2Å; Y448-F450 HydrophobicContact CE2-CD2 4.28Å; Y448-F450 HydrophobicContact CE2-CE1 4.06Å; Y448-F450 AromaticContact CE2-CE2 3.45Å; Y448-F450 HydrophobicContact CE2-CE2 3.45Å; Y448-F450 VanDerWaalsContact CE2-CE2 3.45Å; Y448-F450 AromaticContact CE2-CZ 3.34Å; Y448-F450 HydrophobicContact CE2-CZ 3.34Å; Y448-F450 HydrophobicContact CG-CE1 4.02Å; Y448-F450 HydrophobicContact CG-CZ 4.07Å
451	Y	79.1	Confident	64.7	Low	0 Å²	0	61.1 Å²	61.1	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	94.6	175.5	-67.1	-86.6	0	0	0	107.3	V268 E269 V270 V301 L302 A430 L431 I433 T449	V268-Y451 HydrophobicContact CG1-CD1 3.81Å; V268-Y451 HydrophobicContact CG1-CG 4.24Å; E269-Y451 VanDerWaalsContact O-CA 3.3Å; E269-Y451 WeakPolarHBondContact O-CA 3.25Å; V270-Y451 HydrophobicContact CB-CD1 4.47Å; V270-Y451 HydrophobicContact CB-CE1 4.33Å; V270-Y451 HydrophobicContact CG1-CD1 4.23Å; V270-Y451 HydrophobicContact CG1-CE1 3.7Å; V270-Y451 HydrophobicContact CG2-CD1 3.78Å; V270-Y451 HydrophobicContact CG2-CE1 3.77Å; V301-Y451 HydrophobicContact CB-CE2 4.41Å; V301-Y451 PolarHBondContact N-OH 2.87Å; L302-Y451 HydrophobicContact CD1-CD1 3.8Å; L302-Y451 HydrophobicContact CD1-CE1 4.03Å; L302-Y451 HydrophobicContact CD2-CD1 3.68Å; L302-Y451 HydrophobicContact CD2-CE1 4.06Å; L302-Y451 HydrophobicContact CD2-CG 3.95Å; L302-Y451 HydrophobicContact CG-CD1 3.69Å; L302-Y451 HydrophobicContact CG-CE1 3.68Å; L302-Y451 HydrophobicContact CG-CG 4.44Å; A430-Y451 CarbonylContact C-O 3.52Å; A430-Y451 WeakPolarHBondContact CA-O 3.33Å; L431-Y451 HydrophobicContact CD2-CD2 4.16Å; L431-Y451 HydrophobicContact CG-CD2 4.12Å; L431-Y451 PolarHBondContact N-O 2.86Å; L431-Y451 PolarHBondContact O-N 3.38Å; I433-Y451 HydrophobicContact CD1-CD2 4.19Å; I433-Y451 HydrophobicContact CD1-CE2 3.63Å; I433-Y451 HydrophobicContact CG1-CD2 4.42Å; I433-Y451 HydrophobicContact CG1-CE2 4.2Å; T449-Y451 HydrophobicContact CG2-CD2 4.18Å; T449-Y451 HydrophobicContact CG2-CE1 4.45Å; T449-Y451 HydrophobicContact CG2-CE2 3.47Å; T449-Y451 VanDerWaalsContact CG2-CE2 3.47Å
452	N	78.9	Confident	65.9	Low	39 Å²	39	60.6 Å²	60.6	21%	0.209	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	118.8	177.2	-57.7	-20.9	0	0	0	108.4	V268 E269	V268-N452 VanDerWaalsContact CA-O 3.29Å; V268-N452 WeakPolarHBondContact CA-O 3.2Å; E269-N452 HydrophobicContact CB-CB 4.13Å; E269-N452 HydrophobicContact CG-CB 4.49Å; E269-N452 PolarHBondContact N-O 3.39Å; E269-N452 PolarHBondContact O-N 3.18Å; E269-N452 PolarHBondContact OE2-ND2 2.98Å
453	F	79.2	Confident	67.9	Low	2 Å²	2	58 Å²	58	1%	0.009	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	127	-179.8	-63.8	-84.6	0	0	0	110.4	V266 V268 L302 L369 L370 P428 W429 L431 P455	V266-F453 HydrophobicContact CG1-CD1 4.11Å; V268-F453 HydrophobicContact CG1-CD1 4.28Å; V268-F453 HydrophobicContact CG1-CE1 4.26Å; V268-F453 HydrophobicContact CG2-CD1 3.76Å; V268-F453 HydrophobicContact CG2-CE1 3.91Å; L302-F453 HydrophobicContact CD2-CE1 4.37Å; L302-F453 HydrophobicContact CD2-CZ 4.09Å; L369-F453 HydrophobicContact CD2-CD1 4.43Å; L369-F453 HydrophobicContact CD2-CE1 4.07Å; L370-F453 HydrophobicContact CD2-CZ 4.25Å; P428-F453 HydrophobicContact CB-CD2 3.91Å; P428-F453 HydrophobicContact CB-CE2 4.11Å; P428-F453 HydrophobicContact CB-CG 4.43Å; P428-F453 HydrophobicContact CG-CD2 4.37Å; P428-F453 HydrophobicContact CG-CG 4.43Å; P428-F453 WeakPolarHBondContact O-CB 3.37Å; W429-F453 PolarHBondContact O-N 2.84Å; L431-F453 HydrophobicContact CB-CE2 3.73Å; L431-F453 HydrophobicContact CB-CZ 4.22Å; F453-P455 WeakPolarHBondContact O-CD 3.42Å
454	L	74.4	Confident	69.5	Low	87 Å²	87	56.6 Å²	56.6	46%	0.455	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	80.1	169.6	-62.4	177	0	0	0	108.8	S267	S267-L454 PolarHBondContact N-O 2.87Å; S267-L454 PolarHBondContact O-N 2.89Å
455	P	67.6	Low	71.3	Confident	39 Å²	39	51.9 Å²	51.9	25%	0.253	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	130.1	-177.3	31.5	-37.2	0	0	0	112.1	V266 L427 F453	V266-P455 HydrophobicContact CG2-CB 4Å; L427-P455 HydrophobicContact CB-CG 4.45Å; L427-P455 HydrophobicContact CD1-CB 4.1Å; L427-P455 HydrophobicContact CD1-CG 3.66Å; L427-P455 HydrophobicContact CD2-CB 3.45Å; L427-P455 VanDerWaalsContact CD2-CB 3.45Å; L427-P455 HydrophobicContact CD2-CG 3.6Å; L427-P455 HydrophobicContact CG-CB 4.38Å; L427-P455 HydrophobicContact CG-CG 4.11Å; F453-P455 WeakPolarHBondContact O-CD 3.42Å
456	F	66.1	Low	73.4	Confident	96 Å²	96	44.5 Å²	44.5	42%	0.421	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	103.2	169.9	-176.5	-95.2	0	0	0	109.3	F264 M265 S458	F264-F456 WeakPolarHBondContact CA-O 3.44Å; M265-F456 HydrophobicContact CB-CB 4.34Å; M265-F456 HydrophobicContact CE-CB 3.78Å; M265-F456 HydrophobicContact CE-CD1 4.2Å; M265-F456 HydrophobicContact CE-CG 4.08Å; M265-F456 PolarHBondContact N-O 3.47Å; M265-F456 PolarHBondContact O-N 2.83Å; F456-S458 PolarHBondContact O-N 2.82Å
457	N	67.2	Low	75	Confident	64 Å²	64	46.6 Å²	46.6	34%	0.342	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	124.5	168.9	-178.3	11.5	0	0	0	109.2	F261 N263 L420	F261-N457 HydrophobicContact CD1-CB 3.87Å; F261-N457 VanDerWaalsContact CD1-CG 3.49Å; F261-N457 HydrophobicContact CE1-CB 3.48Å; F261-N457 VanDerWaalsContact CE1-CB 3.48Å; F261-N457 VanDerWaalsContact CE1-CG 3.41Å; F261-N457 HydrophobicContact CZ-CB 4.35Å; N263-N457 PolarHBondContact O-OD1 3.14Å; L420-N457 HydrophobicContact CD2-CB 4.47Å
458	S	65.2	Low	76.7	Confident	20 Å²	20	44.9 Å²	44.9	14%	0.14	23%	0.228	C	C	.	.			trans	-124.5	117.5	175.8	-170.3	0	0	0	0	110.4	N263 F456 L460	N263-S458 WeakPolarHBondContact CB-O 3.47Å; N263-S458 PolarHBondContact O-N 2.89Å; F456-S458 PolarHBondContact O-N 2.82Å; S458-L460 WeakPolarHBondContact CB-O 3.47Å; S458-L460 PolarHBondContact O-N 3.31Å; S458-L460 PolarHBondContact OG-N 2.9Å; S458-L460 PolarHBondContact OG-O 2.97Å
459	T	67.9	Low	77.8	Confident	94 Å²	94	41.8 Å²	41.8	58%	0.577	22%	0.217	S	C	*	.	S	Bend	trans	-64	-3.8	170	55.4	0	0	0	0	113.3
460	L	73	Confident	78.7	Confident	40 Å²	40	43.8 Å²	43.8	21%	0.209	23%	0.229	C	C	.	.	S	Bend	trans	-134	135.6	-176.4	-61.3	175.1	0	0	0	110	S458 P462 V499 F503	S458-L460 WeakPolarHBondContact CB-O 3.47Å; S458-L460 PolarHBondContact O-N 3.31Å; S458-L460 PolarHBondContact OG-N 2.9Å; S458-L460 PolarHBondContact OG-O 2.97Å; L460-P462 WeakPolarHBondContact O-CD 3.26Å; L460-V499 HydrophobicContact CD1-CB 4.35Å; L460-V499 HydrophobicContact CD1-CG1 3.9Å; L460-V499 HydrophobicContact CD1-CG2 3.85Å; L460-V499 HydrophobicContact CD2-CG1 4.06Å; L460-F503 HydrophobicContact CD2-CE2 3.49Å; L460-F503 VanDerWaalsContact CD2-CE2 3.49Å; L460-F503 HydrophobicContact CD2-CZ 3.78Å
461	I	76.6	Confident	79.5	Confident	12 Å²	12	42.7 Å²	42.7	6%	0.062	23%	0.226	C	C	.	.			trans	-72.5	119.5	173.1	-59.1	172	0	0	0	108.3	N263 S286 K289 W463 F466 N502	N263-I461 WeakPolarHBondContact OD1-CG1 3.41Å; S286-I461 VanDerWaalsContact OG-CD1 3.32Å; S286-I461 WeakPolarHBondContact OG-CD1 3.13Å; K289-I461 HydrophobicContact CB-CD1 4.14Å; K289-I461 HydrophobicContact CG-CD1 3.35Å; I461-W463 VanDerWaalsContact C-N 3.31Å; I461-W463 HydrophobicContact CB-CD2 4.48Å; I461-W463 HydrophobicContact CB-CZ2 4.33Å; I461-W463 HydrophobicContact CD1-CH2 4.17Å; I461-W463 HydrophobicContact CD1-CZ2 3.93Å; I461-W463 HydrophobicContact CG2-CD2 3.88Å; I461-W463 HydrophobicContact CG2-CE3 4.01Å; I461-W463 HydrophobicContact CG2-CG 4.43Å; I461-W463 HydrophobicContact CG2-CH2 4.24Å; I461-W463 HydrophobicContact CG2-CZ2 4.15Å; I461-W463 HydrophobicContact CG2-CZ3 4.19Å; I461-W463 PolarHBondContact O-N 2.97Å; I461-F466 HydrophobicContact CG2-CD2 3.88Å; I461-F466 HydrophobicContact CG2-CE2 3.72Å; I461-N502 PolarHBondContact O-ND2 3.33Å
462	P	76.8	Confident	80.1	Confident	49 Å²	49	43.5 Å²	43.5	32%	0.318	23%	0.23	S	C	.	.			trans	-79.2	79.2	179.1	32.9	-34.5	0	0	0	109.6	F284 L460 K464 R465	F284-P462 HydrophobicContact CD1-CG 4.17Å; L460-P462 WeakPolarHBondContact O-CD 3.26Å; P462-K464 PolarHBondContact O-N 3.42Å; P462-R465 HydrophobicContact CB-CG 4.03Å; P462-R465 HydrophobicContact CG-CB 4.32Å; P462-R465 HydrophobicContact CG-CG 4.16Å; P462-R465 WeakPolarHBondContact O-CB 3.44Å; P462-R465 PolarHBondContact O-N 3.3Å
463	W	85.7	Confident	80.6	Confident	10 Å²	10	47.6 Å²	47.6	4%	0.038	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-54.3	-27.6	-172.2	-68.1	115.2	0	0	0	114.6	K289 L291 I461 R465 F466 D467 N502 P516 L517	K289-W463 HydrophobicContact CB-CH2 4.42Å; K289-W463 HydrophobicContact CD-CH2 4.48Å; K289-W463 HydrophobicContact CG-CH2 3.98Å; K289-W463 HydrophobicContact CG-CZ2 4.37Å; L291-W463 HydrophobicContact CD1-CE3 4.49Å; L291-W463 HydrophobicContact CD1-CH2 3.86Å; L291-W463 HydrophobicContact CD1-CZ3 3.42Å; L291-W463 VanDerWaalsContact CD1-CZ3 3.42Å; I461-W463 VanDerWaalsContact C-N 3.31Å; I461-W463 HydrophobicContact CB-CD2 4.48Å; I461-W463 HydrophobicContact CB-CZ2 4.33Å; I461-W463 HydrophobicContact CD1-CH2 4.17Å; I461-W463 HydrophobicContact CD1-CZ2 3.93Å; I461-W463 HydrophobicContact CG2-CD2 3.88Å; I461-W463 HydrophobicContact CG2-CE3 4.01Å; I461-W463 HydrophobicContact CG2-CG 4.43Å; I461-W463 HydrophobicContact CG2-CH2 4.24Å; I461-W463 HydrophobicContact CG2-CZ2 4.15Å; I461-W463 HydrophobicContact CG2-CZ3 4.19Å; I461-W463 PolarHBondContact O-N 2.97Å; W463-R465 PolarHBondContact O-N 2.87Å; W463-R465 VanDerWaalsContact O-N 3.13Å; W463-F466 HydrophobicContact CE3-CB 4.35Å; W463-F466 CarbonylContact O-C 3.51Å; W463-F466 VanDerWaalsContact O-C 3.28Å; W463-F466 WeakPolarHBondContact O-CA 3.31Å; W463-F466 PolarHBondContact O-N 2.83Å; W463-D467 PolarHBondContact O-N 2.87Å; W463-D467 VanDerWaalsContact O-N 3.16Å; W463-N502 PolarHBondContact NE1-O 2.83Å; W463-P516 HydrophobicContact CH2-CB 3.38Å; W463-P516 HydrophobicContact CH2-CG 3.98Å; W463-P516 HydrophobicContact CZ2-CB 3.87Å; W463-P516 HydrophobicContact CZ3-CB 3.82Å; W463-L517 HydrophobicContact CE3-CD2 4.24Å; W463-L517 HydrophobicContact CZ3-CD2 3.99Å
464	K	83.6	Confident	81	Confident	124 Å²	124	50.4 Å²	50.4	54%	0.539	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-57.9	-21	171.6	-68.4	-178.9	174.2	178.3	0	114.1	P462 E498	P462-K464 PolarHBondContact O-N 3.42Å; K464-E498 WeakPolarHBondContact CE-OE1 2.98Å; K464-E498 IonicContact NZ-OE1 2.79Å; K464-E498 PolarHBondContact NZ-OE1 3.07Å
465	R	82.7	Confident	81.4	Confident	51 Å²	51	49.7 Å²	49.7	19%	0.192	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-95.6	-5.1	176.8	-52.4	-70.3	-168.7	163.5	-1.1	112.8	F284 S293 P462 W463 M811 D812	F284-R465 HydrophobicContact CD1-CB 3.57Å; F284-R465 HydrophobicContact CD1-CG 3.85Å; F284-R465 HydrophobicContact CD2-CB 3.94Å; F284-R465 HydrophobicContact CE1-CB 3.53Å; F284-R465 HydrophobicContact CE1-CG 3.39Å; F284-R465 HydrophobicContact CE2-CB 3.93Å; F284-R465 HydrophobicContact CE2-CG 4.44Å; F284-R465 HydrophobicContact CG-CB 3.79Å; F284-R465 HydrophobicContact CZ-CB 3.74Å; F284-R465 HydrophobicContact CZ-CG 3.76Å; S293-R465 PolarHBondContact OG-O 2.89Å; P462-R465 HydrophobicContact CB-CG 4.03Å; P462-R465 HydrophobicContact CG-CB 4.32Å; P462-R465 HydrophobicContact CG-CG 4.16Å; P462-R465 WeakPolarHBondContact O-CB 3.44Å; P462-R465 PolarHBondContact O-N 3.3Å; W463-R465 PolarHBondContact O-N 2.87Å; W463-R465 VanDerWaalsContact O-N 3.13Å; R465-M811 PolarHBondContact NH2-O 2.98Å; R465-D812 PolarHBondContact NH2-O 3.17Å
466	F	88.6	Confident	81.8	Confident	5 Å²	5	55 Å²	55	2%	0.022	27%	0.273	C	S	.	.	S	Bend	trans	-115	22.7	169.1	-64.4	-90.8	0	0	0	110.5	F284 L291 S293 T318 I461 W463 V468 L517	F284-F466 HydrophobicContact CB-CD2 4.49Å; F284-F466 HydrophobicContact CB-CE1 4.25Å; F284-F466 HydrophobicContact CB-CE2 3.69Å; F284-F466 HydrophobicContact CB-CZ 3.55Å; F284-F466 WeakPolarHBondContact O-CZ 3.44Å; L291-F466 HydrophobicContact CB-CD1 4.02Å; L291-F466 HydrophobicContact CB-CE1 3.57Å; L291-F466 HydrophobicContact CB-CZ 4.25Å; L291-F466 HydrophobicContact CD1-CD1 4.29Å; L291-F466 HydrophobicContact CD1-CE1 4.49Å; S293-F466 VanDerWaalsContact CB-CD1 3.47Å; T318-F466 HydrophobicContact CG2-CD1 4.16Å; I461-F466 HydrophobicContact CG2-CD2 3.88Å; I461-F466 HydrophobicContact CG2-CE2 3.72Å; W463-F466 HydrophobicContact CE3-CB 4.35Å; W463-F466 CarbonylContact O-C 3.51Å; W463-F466 VanDerWaalsContact O-C 3.28Å; W463-F466 WeakPolarHBondContact O-CA 3.31Å; W463-F466 PolarHBondContact O-N 2.83Å; F466-V468 PolarHBondContact O-N 2.92Å; F466-L517 HydrophobicContact CB-CD2 3.83Å; F466-L517 WeakPolarHBondContact O-CD2 3.37Å
467	D	88.8	Confident	82.1	Confident	79 Å²	79	55.4 Å²	55.4	42%	0.422	28%	0.28	S	S	.	.			trans	-73.9	99.4	-177.7	-171.6	-1.7	0	0	0	110.6	W463 S469	W463-D467 PolarHBondContact O-N 2.87Å; W463-D467 VanDerWaalsContact O-N 3.16Å; D467-S469 WeakPolarHBondContact OD1-CB 3.03Å; D467-S469 PolarHBondContact OD1-N 2.8Å; D467-S469 PolarHBondContact OD1-OG 2.92Å; D467-S469 PolarHBondContact OD2-OG 2.83Å
468	V	93.1	Very high	82.8	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.006	28%	0.28	C	S	.	.			trans	-97.8	14.1	174.5	-56.6	0	0	0	0	113	T318 Y327 I329 F466 T470 C471 L472 L517	T318-V468 HydrophobicContact CG2-CG1 3.94Å; Y327-V468 HydrophobicContact CD1-CB 4.05Å; Y327-V468 HydrophobicContact CD1-CG1 4.39Å; Y327-V468 HydrophobicContact CD1-CG2 4.22Å; Y327-V468 HydrophobicContact CD2-CB 4.37Å; Y327-V468 HydrophobicContact CD2-CG1 3.94Å; Y327-V468 HydrophobicContact CD2-CG2 4.38Å; Y327-V468 HydrophobicContact CE1-CG2 4.26Å; Y327-V468 HydrophobicContact CE2-CG2 4.41Å; Y327-V468 HydrophobicContact CG-CB 3.94Å; Y327-V468 HydrophobicContact CG-CG1 3.77Å; Y327-V468 HydrophobicContact CG-CG2 4.28Å; I329-V468 HydrophobicContact CD1-CB 4.24Å; I329-V468 HydrophobicContact CD1-CG1 4.12Å; F466-V468 PolarHBondContact O-N 2.92Å; V468-T470 PolarHBondContact O-N 2.74Å; V468-C471 WeakPolarHBondContact O-CB 3.48Å; V468-C471 PolarHBondContact O-N 2.88Å; V468-L472 HydrophobicContact CG2-CD1 4.02Å; V468-L472 HydrophobicContact CG2-CG 4.23Å; V468-L472 PolarHBondContact O-N 2.71Å; V468-L517 HydrophobicContact CG2-CB 3.83Å; V468-L517 HydrophobicContact CG2-CD1 4.21Å; V468-L517 HydrophobicContact CG2-CG 4.46Å
469	S	90.1	Very high	83.9	Confident	7 Å²	7	55 Å²	55	5%	0.049	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-57.1	-25.4	-175	59.7	0	0	0	0	114.1	D467 C471 L472 Y474	D467-S469 WeakPolarHBondContact OD1-CB 3.03Å; D467-S469 PolarHBondContact OD1-N 2.8Å; D467-S469 PolarHBondContact OD1-OG 2.92Å; D467-S469 PolarHBondContact OD2-OG 2.83Å; S469-C471 VanDerWaalsContact C-N 3.3Å; S469-C471 PolarHBondContact O-N 3.36Å; S469-L472 PolarHBondContact O-N 3.42Å; S469-Y474 WeakPolarHBondContact CA-OH 3.35Å; S469-Y474 VanDerWaalsContact CB-OH 3.31Å; S469-Y474 WeakPolarHBondContact CB-OH 3.41Å; S469-Y474 WeakPolarHBondContact O-CE2 3.35Å
470	T	91	Very high	85	Confident	62 Å²	62	51.9 Å²	51.9	38%	0.38	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-76.6	-15.5	177.4	58.8	0	0	0	0	113.6	A334 C336 V468	A334-T470 VanDerWaalsContact O-CB 3.24Å; A334-T470 WeakPolarHBondContact O-CB 3.42Å; A334-T470 WeakPolarHBondContact O-CG2 3.3Å; A334-T470 PolarHBondContact O-OG1 3.33Å; C336-T470 WeakPolarHBondContact CB-O 3Å; V468-T470 PolarHBondContact O-N 2.74Å
471	C	93.2	Very high	85.9	Confident	16 Å²	16	50 Å²	50	11%	0.108	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-95.2	-5.7	170.4	-75.2	0	0	0	0	114	Y327 C336 V339 V468 S469	Y327-C471 HydrophobicContact CD1-CB 3.84Å; C336-C471 HydrophobicContact CB-CB 3.81Å; C336-C471 WeakPolarHBondContact CB-SG 3.4Å; C336-C471 WeakPolarHBondContact SG-CA 3.39Å; C336-C471 WeakPolarHBondContact SG-CB 3.18Å; C336-C471 CovalentContact SG-SG 2.03Å; C336-C471 PolarHBondContact SG-SG 3.5Å; V339-C471 HydrophobicContact CG2-CB 3.72Å; V468-C471 WeakPolarHBondContact O-CB 3.48Å; V468-C471 PolarHBondContact O-N 2.88Å; S469-C471 VanDerWaalsContact C-N 3.3Å; S469-C471 PolarHBondContact O-N 3.36Å
472	L	92.2	Very high	86.7	Confident	16 Å²	16	49.7 Å²	49.7	8%	0.084	24%	0.24	C	C	.	.	S	Bend	trans	-96.2	144.8	-173.3	-70.3	176.3	0	0	0	112.3	Y327 V468 S469 Y474 L517 R518	Y327-L472 HydrophobicContact CE1-CD2 4.1Å; V468-L472 HydrophobicContact CG2-CD1 4.02Å; V468-L472 HydrophobicContact CG2-CG 4.23Å; V468-L472 PolarHBondContact O-N 2.71Å; S469-L472 PolarHBondContact O-N 3.42Å; L472-Y474 HydrophobicContact CB-CE2 3.81Å; L472-Y474 WeakPolarHBondContact O-CD2 3.46Å; L472-Y474 WeakPolarHBondContact O-CE2 3.27Å; L472-L517 WeakPolarHBondContact CD1-O 3.28Å; L472-R518 HydrophobicContact CD1-CG 4.42Å; L472-R518 HydrophobicContact CD2-CG 4.04Å
473	K	90.1	Very high	87.5	Confident	126 Å²	126	47.5 Å²	47.5	55%	0.548	23%	0.226	S	C	.	.			trans	-91.3	127.7	177.7	-67.6	168.4	-178.1	166.8	0	109.4	S538 N539 S541	K473-S538 CarbonylContact O-C 3.58Å; K473-S538 WeakPolarHBondContact O-CA 3.4Å; K473-S538 WeakPolarHBondContact O-CB 3.4Å; K473-N539 PolarHBondContact O-N 2.83Å; K473-S541 PolarHBondContact NZ-O 3.03Å
474	Y	87	Confident	87.9	Confident	61 Å²	61	47.7 Å²	47.7	24%	0.239	23%	0.227	C	C	.	.			trans	-120.3	140.4	177.3	-58.4	-79.7	0	0	0	110.5	S469 L472 S479 S520 Q536	S469-Y474 WeakPolarHBondContact CA-OH 3.35Å; S469-Y474 VanDerWaalsContact CB-OH 3.31Å; S469-Y474 WeakPolarHBondContact CB-OH 3.41Å; S469-Y474 WeakPolarHBondContact O-CE2 3.35Å; L472-Y474 HydrophobicContact CB-CE2 3.81Å; L472-Y474 WeakPolarHBondContact O-CD2 3.46Å; L472-Y474 WeakPolarHBondContact O-CE2 3.27Å; Y474-S479 WeakPolarHBondContact CA-OG 3.41Å; Y474-S520 PolarHBondContact OH-OG 3.06Å; Y474-S520 VanDerWaalsContact OH-OG 3.12Å; Y474-Q536 HydrophobicContact CD1-CB 4.41Å; Y474-Q536 HydrophobicContact CD1-CG 4.1Å; Y474-Q536 HydrophobicContact CE1-CB 4.36Å; Y474-Q536 VanDerWaalsContact CE1-CD 3.48Å; Y474-Q536 HydrophobicContact CE1-CG 3.63Å; Y474-Q536 VanDerWaalsContact CE1-NE2 3.29Å; Y474-Q536 PolarHBondContact OH-NE2 3.02Å; Y474-Q536 VanDerWaalsContact OH-NE2 3.16Å
475	D	84	Confident	88.5	Confident	72 Å²	72	41.8 Å²	41.8	39%	0.385	20%	0.201	S	C	.	.			trans	-90.2	130.8	167.5	-172.5	-72.6	0	0	0	109	N477 E478 S479 L557	D475-N477 PolarHBondContact O-N 3.4Å; D475-N477 VanDerWaalsContact O-N 3.12Å; D475-N477 WeakPolarHBondContact OD1-CA 3.42Å; D475-N477 PolarHBondContact OD1-N 3.14Å; D475-E478 HydrophobicContact CB-CB 4.08Å; D475-E478 PolarHBondContact OD1-N 2.89Å; D475-S479 PolarHBondContact N-OG 3.5Å; D475-S479 VanDerWaalsContact O-CB 3.25Å; D475-S479 WeakPolarHBondContact O-CB 3.08Å; D475-S479 PolarHBondContact O-N 2.83Å; D475-S479 VanDerWaalsContact O-N 3.1Å; D475-L557 HydrophobicContact CB-CD2 4.01Å
476	K	74.8	Confident	89	Confident	150 Å²	150	42.7 Å²	42.7	65%	0.652	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58	-28	-177.3	-73	-170.6	176	-173.2	0	113.3
477	N	73.2	Confident	89.1	Confident	105 Å²	105	42.5 Å²	42.5	56%	0.561	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-108.1	-36.2	-174.1	-61.8	-19.2	0	0	0	112.2	D475	D475-N477 PolarHBondContact O-N 3.4Å; D475-N477 VanDerWaalsContact O-N 3.12Å; D475-N477 WeakPolarHBondContact OD1-CA 3.42Å; D475-N477 PolarHBondContact OD1-N 3.14Å
478	E	81.7	Confident	89.3	Confident	74 Å²	74	41 Å²	41	35%	0.346	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.8	-20	-173.9	-58.2	-143	133.4	0	0	115.4	D475 L557 R561	D475-E478 HydrophobicContact CB-CB 4.08Å; D475-E478 PolarHBondContact OD1-N 2.89Å; E478-L557 HydrophobicContact CB-CD2 3.82Å; E478-L557 HydrophobicContact CB-CG 4.48Å; E478-R561 IonicContact OE1-CZ 3.91Å; E478-R561 IonicContact OE1-NH1 2.74Å; E478-R561 PolarHBondContact OE1-NH1 3Å; E478-R561 IonicContact OE2-NH1 3.61Å
479	S	88.4	Confident	89.2	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.208	C	C	.	.	S	Bend	trans	-75.8	-25.5	-178.3	-82.4	0	0	0	0	113.6	Y474 D475 Q536 V537 L557	Y474-S479 WeakPolarHBondContact CA-OG 3.41Å; D475-S479 PolarHBondContact N-OG 3.5Å; D475-S479 VanDerWaalsContact O-CB 3.25Å; D475-S479 WeakPolarHBondContact O-CB 3.08Å; D475-S479 PolarHBondContact O-N 2.83Å; D475-S479 VanDerWaalsContact O-N 3.1Å; S479-Q536 CarbonylContact O-C 3.52Å; S479-Q536 VanDerWaalsContact O-CA 3.26Å; S479-Q536 WeakPolarHBondContact O-CA 3.3Å; S479-V537 WeakPolarHBondContact CA-O 3.39Å; S479-V537 WeakPolarHBondContact CB-O 3.38Å; S479-V537 PolarHBondContact O-N 3.32Å; S479-V537 PolarHBondContact OG-O 2.92Å; S479-L557 WeakPolarHBondContact OG-CD2 3.36Å
480	Y	89.8	Confident	89.1	Confident	29 Å²	29	47.2 Å²	47.2	11%	0.114	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	125.6	-171.1	-63.9	-82	0	0	0	111.2	Q536 A597 L599	Y480-Q536 HydrophobicContact CD1-CB 3.72Å; Y480-Q536 HydrophobicContact CE1-CB 3.7Å; Y480-Q536 HydrophobicContact CE1-CG 4.44Å; Y480-Q536 PolarHBondContact OH-OE1 2.82Å; Y480-Q536 VanDerWaalsContact OH-OE1 3.06Å; Y480-A597 WeakPolarHBondContact CB-O 3.34Å; Y480-A597 PolarHBondContact O-N 3.35Å; Y480-L599 HydrophobicContact CD1-CD1 3.54Å; Y480-L599 HydrophobicContact CD2-CD1 3.73Å; Y480-L599 HydrophobicContact CE1-CD1 3.69Å; Y480-L599 HydrophobicContact CE2-CD1 3.88Å; Y480-L599 HydrophobicContact CG-CD1 3.57Å
481	M	91.9	Very high	89	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	156.6	-175.9	-78.9	168.6	-89.7	0	0	111.5	F534 F535 V537 R561 L564 L594 K595	M481-F534 WeakPolarHBondContact O-CA 3.43Å; M481-F535 HydrophobicContact CB-CE1 3.91Å; M481-F535 HydrophobicContact CB-CE2 3.95Å; M481-F535 HydrophobicContact CB-CZ 3.58Å; M481-F535 PolarHBondContact N-O 3.43Å; M481-F535 PolarHBondContact O-N 3.41Å; M481-F535 VanDerWaalsContact O-O 3.11Å; M481-F535 HydrophobicContact SD-CE2 4.48Å; M481-F535 HydrophobicContact SD-CZ 4.48Å; M481-V537 HydrophobicContact CE-CB 3.72Å; M481-V537 HydrophobicContact CE-CG2 3.58Å; M481-R561 HydrophobicContact SD-CB 4.49Å; M481-R561 HydrophobicContact SD-CG 4.04Å; M481-L564 HydrophobicContact SD-CD1 4.26Å; M481-L594 HydrophobicContact CB-CD1 4.23Å; M481-L594 HydrophobicContact CG-CD1 4.35Å; M481-L594 HydrophobicContact SD-CD1 4.12Å; M481-K595 CarbonylContact C-O 3.58Å; M481-K595 WeakPolarHBondContact CA-O 3.43Å
482	T	93.4	Very high	88.9	Confident	7 Å²	7	47.9 Å²	47.9	4%	0.043	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	149.4	168.5	61	0	0	0	0	111.1	M532 V533 F534 L594 K595 A597	T482-M532 HydrophobicContact CG2-CG 4.16Å; T482-M532 HydrophobicContact CG2-SD 4.01Å; T482-V533 CarbonylContact C-O 3.58Å; T482-V533 VanDerWaalsContact CA-O 3.28Å; T482-V533 WeakPolarHBondContact CA-O 3Å; T482-F534 HydrophobicContact CG2-CB 4.44Å; T482-F534 HydrophobicContact CG2-CD1 3.34Å; T482-F534 HydrophobicContact CG2-CD2 4.24Å; T482-F534 HydrophobicContact CG2-CE1 3.46Å; T482-F534 VanDerWaalsContact CG2-CE1 3.46Å; T482-F534 HydrophobicContact CG2-CE2 4.32Å; T482-F534 HydrophobicContact CG2-CG 3.75Å; T482-F534 HydrophobicContact CG2-CZ 3.96Å; T482-L594 VanDerWaalsContact O-CA 3.3Å; T482-L594 WeakPolarHBondContact O-CA 3.35Å; T482-K595 PolarHBondContact N-O 3.49Å; T482-K595 PolarHBondContact O-N 3.48Å; T482-K595 PolarHBondContact OG1-O 3.1Å; T482-A597 HydrophobicContact CG2-CB 3.88Å
483	I	94.5	Very high	88.7	Confident	2 Å²	2	53.6 Å²	53.6	1%	0.01	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	165	166.6	53.4	-179.9	0	0	0	108.9	I508 V533 F535 L568 I589 L594	I483-I508 HydrophobicContact CD1-CD1 3.71Å; I483-I508 HydrophobicContact CD1-CG1 4.19Å; I483-V533 HydrophobicContact CG1-CB 3.96Å; I483-V533 PolarHBondContact N-O 3.27Å; I483-V533 PolarHBondContact O-N 3.17Å; I483-F535 HydrophobicContact CB-CE1 4.28Å; I483-F535 HydrophobicContact CD1-CD1 4.42Å; I483-F535 HydrophobicContact CD1-CE1 4.02Å; I483-F535 HydrophobicContact CG1-CD1 4.25Å; I483-F535 HydrophobicContact CG1-CE1 3.8Å; I483-F535 HydrophobicContact CG2-CE1 3.86Å; I483-F535 HydrophobicContact CG2-CZ 4.23Å; I483-L568 HydrophobicContact CG2-CD1 3.97Å; I483-I589 HydrophobicContact CB-CG2 3.91Å; I483-I589 HydrophobicContact CD1-CD1 3.95Å; I483-I589 HydrophobicContact CD1-CG1 4.07Å; I483-I589 HydrophobicContact CD1-CG2 3.77Å; I483-I589 HydrophobicContact CG1-CG2 4.31Å; I483-I589 HydrophobicContact CG2-CG2 4.02Å; I483-L594 HydrophobicContact CG2-CB 4.4Å; I483-L594 HydrophobicContact CG2-CD1 3.73Å
484	H	94.4	Very high	88.5	Confident	14 Å²	14	52.1 Å²	52.1	7%	0.065	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	134.9	175.5	-58	57.3	0	0	0	109.9	D527 T531 M532 M590 S593	H484-D527 IonicContact CD2-OD2 3.33Å; H484-D527 PolarHBondContact CD2-OD2 2.05Å; H484-T531 WeakPolarHBondContact CA-O 3.48Å; H484-M532 WeakPolarHBondContact NE2-CE 3.3Å; H484-M590 PolarHBondContact O-N 2.04Å; H484-S593 PolarHBondContact N-OG 2.66Å; H484-S593 PolarHBondContact ND1-O 3.41Å
485	V	95.3	Very high	88.5	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	146.5	177	-60.2	0	0	0	0	112.2	A487 L492 L504 R530 T531 V533 V588 I589	V485-A487 PolarHBondContact O-N 3.34Å; V485-L492 HydrophobicContact CG2-CD1 4.27Å; V485-L504 HydrophobicContact CG1-CD2 4.32Å; V485-R530 WeakPolarHBondContact O-CA 3.27Å; V485-R530 WeakPolarHBondContact O-CB 3.23Å; V485-T531 PolarHBondContact N-O 2.8Å; V485-T531 PolarHBondContact O-N 2.96Å; V485-T531 VanDerWaalsContact O-N 3.16Å; V485-V533 HydrophobicContact CG1-CG2 4.02Å; V485-V533 HydrophobicContact CG2-CG2 3.83Å; V485-V588 WeakPolarHBondContact CA-O 3.41Å; V485-I589 HydrophobicContact CG1-CG1 4.17Å
486	N	93.3	Very high	88.6	Confident	70 Å²	70	48.1 Å²	48.1	37%	0.374	25%	0.25	S	C	.	.	S	Bend	trans	-72.5	31.3	-175.7	75	-28.1	0	0	0	115.7	L587 V588	N486-L587 WeakPolarHBondContact OD1-CA 3.48Å; N486-V588 HydrophobicContact CB-CB 4.22Å; N486-V588 PolarHBondContact N-O 3.16Å; N486-V588 WeakPolarHBondContact ND2-CG2 3.45Å; N486-V588 PolarHBondContact OD1-N 2.85Å
487	A	92.1	Very high	89.2	Confident	2 Å²	2	42.6 Å²	42.6	2%	0.017	23%	0.227	C	C	.	.	S	Bend	trans	-138	147.1	-179.1	0	0	0	0	0	111	V485 K491 L492 R530 T531 L587	V485-A487 PolarHBondContact O-N 3.34Å; A487-K491 HydrophobicContact CB-CB 4.44Å; A487-K491 HydrophobicContact CB-CD 4.12Å; A487-L492 HydrophobicContact CB-CD2 3.8Å; A487-L492 HydrophobicContact CB-CG 4.41Å; A487-R530 CarbonylContact O-C 3.55Å; A487-T531 WeakPolarHBondContact O-CB 3.49Å; A487-T531 PolarHBondContact O-N 2.87Å; A487-T531 PolarHBondContact O-OG1 3.44Å; A487-L587 HydrophobicContact CB-CD2 3.6Å
488	T	92	Very high	89.8	Confident	46 Å²	46	42.3 Å²	42.3	28%	0.282	22%	0.222	S	C	.	.			trans	-73.1	154.2	170.1	55.3	0	0	0	0	111.1	D490 K491 L492	T488-D490 PolarHBondContact O-N 2.98Å; T488-K491 WeakPolarHBondContact O-CA 3.34Å; T488-K491 WeakPolarHBondContact O-CB 3.34Å; T488-K491 PolarHBondContact O-N 3.02Å; T488-L492 PolarHBondContact O-N 3.08Å
489	V	90.2	Very high	90.1	Very high	19 Å²	19	40.1 Å²	40.1	12%	0.115	21%	0.214	C	C	.	.	H	α-helix	trans	-54.7	-40.8	179.7	169	0	0	0	0	111.7	K491 L492 Y493 P526 T531	V489-K491 VanDerWaalsContact C-N 3.29Å; V489-K491 PolarHBondContact O-N 2.96Å; V489-L492 WeakPolarHBondContact O-CB 3.33Å; V489-L492 PolarHBondContact O-N 2.93Å; V489-L492 VanDerWaalsContact O-N 3.1Å; V489-Y493 HydrophobicContact CG1-CD2 3.5Å; V489-Y493 HydrophobicContact CG1-CE2 3.39Å; V489-Y493 WeakPolarHBondContact O-CD2 3.43Å; V489-Y493 PolarHBondContact O-N 3.05Å; V489-P526 HydrophobicContact CG2-CB 3.9Å; V489-T531 HydrophobicContact CG2-CG2 3.66Å; V489-T531 WeakPolarHBondContact CG2-OG1 3.25Å; V489-T531 PolarHBondContact N-OG1 2.89Å; V489-T531 VanDerWaalsContact N-OG1 3.14Å
490	D	88.5	Confident	90.2	Very high	120 Å²	120	40.1 Å²	40.1	64%	0.642	21%	0.214	S	C	*	.	H	α-helix	trans	-62.3	-34.7	177.1	-47.2	-56.1	0	0	0	112.8	T488 L492 S494	T488-D490 PolarHBondContact O-N 2.98Å; D490-L492 VanDerWaalsContact C-N 3.32Å; D490-S494 VanDerWaalsContact O-CB 3.28Å; D490-S494 WeakPolarHBondContact O-CB 3.35Å; D490-S494 PolarHBondContact O-N 2.85Å; D490-S494 PolarHBondContact O-OG 2.93Å
491	K	89.5	Confident	90.3	Very high	92 Å²	92	40.3 Å²	40.3	40%	0.4	22%	0.216	S	C	.	.	H	α-helix	trans	-71.1	-29.1	177.1	-162.3	-177.1	-172.7	-168.7	0	111.9	A487 T488 V489 S494 T495 L585	A487-K491 HydrophobicContact CB-CB 4.44Å; A487-K491 HydrophobicContact CB-CD 4.12Å; T488-K491 WeakPolarHBondContact O-CA 3.34Å; T488-K491 WeakPolarHBondContact O-CB 3.34Å; T488-K491 PolarHBondContact O-N 3.02Å; V489-K491 VanDerWaalsContact C-N 3.29Å; V489-K491 PolarHBondContact O-N 2.96Å; K491-S494 WeakPolarHBondContact CA-OG 3.43Å; K491-S494 PolarHBondContact O-OG 3.01Å; K491-T495 WeakPolarHBondContact O-CB 3.33Å; K491-T495 PolarHBondContact O-N 2.85Å; K491-T495 PolarHBondContact O-OG1 2.96Å; K491-L585 HydrophobicContact CD-CD1 4.12Å; K491-L585 HydrophobicContact CG-CD1 4.46Å
492	L	90.4	Very high	90.2	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-75.1	-48.2	172.8	-55	-175.1	0	0	0	111.1	V485 A487 T488 V489 D490 T495 G496 I497 V500 F524 T531 L585 L587	V485-L492 HydrophobicContact CG2-CD1 4.27Å; A487-L492 HydrophobicContact CB-CD2 3.8Å; A487-L492 HydrophobicContact CB-CG 4.41Å; T488-L492 PolarHBondContact O-N 3.08Å; V489-L492 WeakPolarHBondContact O-CB 3.33Å; V489-L492 PolarHBondContact O-N 2.93Å; V489-L492 VanDerWaalsContact O-N 3.1Å; D490-L492 VanDerWaalsContact C-N 3.32Å; L492-T495 PolarHBondContact O-N 3.02Å; L492-T495 VanDerWaalsContact O-N 3.17Å; L492-G496 PolarHBondContact O-N 3Å; L492-I497 HydrophobicContact CB-CD1 3.73Å; L492-V500 HydrophobicContact CB-CG2 4.3Å; L492-V500 HydrophobicContact CD1-CG1 4.41Å; L492-V500 HydrophobicContact CD2-CG1 4.07Å; L492-V500 HydrophobicContact CD2-CG2 4.16Å; L492-F524 HydrophobicContact CD1-CD1 3.56Å; L492-F524 HydrophobicContact CD1-CE1 3.96Å; L492-F524 HydrophobicContact CD1-CG 4.48Å; L492-T531 HydrophobicContact CD1-CG2 3.85Å; L492-L585 HydrophobicContact CD2-CD2 4.4Å; L492-L587 HydrophobicContact CD2-CD1 3.96Å; L492-L587 HydrophobicContact CD2-CD2 3.64Å; L492-L587 HydrophobicContact CD2-CG 4.45Å
493	Y	88.4	Confident	90.1	Very high	136 Å²	136	43.4 Å²	43.4	53%	0.533	23%	0.23	S	C	.	.	H	α-helix	trans	-61.8	-44.6	177.7	-82.8	-65.5	0	0	0	112.8	V489 T495 G496 I497	V489-Y493 HydrophobicContact CG1-CD2 3.5Å; V489-Y493 HydrophobicContact CG1-CE2 3.39Å; V489-Y493 WeakPolarHBondContact O-CD2 3.43Å; V489-Y493 PolarHBondContact O-N 3.05Å; Y493-T495 PolarHBondContact O-N 3.28Å; Y493-G496 PolarHBondContact O-N 3.26Å; Y493-I497 HydrophobicContact CD1-CB 3.93Å; Y493-I497 HydrophobicContact CD1-CG1 4.37Å; Y493-I497 HydrophobicContact CD1-CG2 4.24Å; Y493-I497 HydrophobicContact CE1-CB 4.05Å; Y493-I497 HydrophobicContact CE1-CG1 4.15Å; Y493-I497 HydrophobicContact CE1-CG2 4.09Å
494	S	86.4	Confident	90.1	Very high	96 Å²	96	43.3 Å²	43.3	67%	0.671	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-16.1	176.7	54.7	0	0	0	0	114.3	D490 K491	D490-S494 VanDerWaalsContact O-CB 3.28Å; D490-S494 WeakPolarHBondContact O-CB 3.35Å; D490-S494 PolarHBondContact O-N 2.85Å; D490-S494 PolarHBondContact O-OG 2.93Å; K491-S494 WeakPolarHBondContact CA-OG 3.43Å; K491-S494 PolarHBondContact O-OG 3.01Å
495	T	85.4	Confident	90.1	Very high	19 Å²	19	43.7 Å²	43.7	12%	0.117	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-10.6	170.8	-62.6	0	0	0	0	112.5	K491 L492 Y493 V500 V577 R579 L585	K491-T495 WeakPolarHBondContact O-CB 3.33Å; K491-T495 PolarHBondContact O-N 2.85Å; K491-T495 PolarHBondContact O-OG1 2.96Å; L492-T495 PolarHBondContact O-N 3.02Å; L492-T495 VanDerWaalsContact O-N 3.17Å; Y493-T495 PolarHBondContact O-N 3.28Å; T495-V500 HydrophobicContact CG2-CG2 4.11Å; T495-V577 HydrophobicContact CG2-CG1 3.98Å; T495-R579 HydrophobicContact CG2-CG 3.91Å; T495-L585 HydrophobicContact CG2-CB 4.38Å; T495-L585 HydrophobicContact CG2-CD2 3.94Å; T495-L585 WeakPolarHBondContact OG1-CD2 3.43Å
496	G	87.2	Confident	90	Very high	29 Å²	29	45.4 Å²	45.4	30%	0.299	24%	0.241	S	C	.	.			trans	87.5	105.6	-169.7	0	0	0	0	0	110.6	L492 Y493 E498 V499 V500	L492-G496 PolarHBondContact O-N 3Å; Y493-G496 PolarHBondContact O-N 3.26Å; G496-E498 VanDerWaalsContact C-N 3.26Å; G496-E498 PolarHBondContact O-N 2.8Å; G496-V499 WeakPolarHBondContact O-CA 3.29Å; G496-V499 WeakPolarHBondContact O-CB 3.07Å; G496-V499 PolarHBondContact O-N 3.11Å; G496-V500 PolarHBondContact O-N 3.38Å
497	I	86.7	Confident	90.1	Very high	34 Å²	34	43.4 Å²	43.4	17%	0.174	23%	0.232	C	C	.	.	H	α-helix	trans	-62.5	-32.5	-171.7	-160.5	62.9	0	0	0	113.1	L492 Y493 V499 V500 E501 F524	L492-I497 HydrophobicContact CB-CD1 3.73Å; Y493-I497 HydrophobicContact CD1-CB 3.93Å; Y493-I497 HydrophobicContact CD1-CG1 4.37Å; Y493-I497 HydrophobicContact CD1-CG2 4.24Å; Y493-I497 HydrophobicContact CE1-CB 4.05Å; Y493-I497 HydrophobicContact CE1-CG1 4.15Å; Y493-I497 HydrophobicContact CE1-CG2 4.09Å; I497-V499 VanDerWaalsContact C-N 3.33Å; I497-V499 PolarHBondContact O-N 3.01Å; I497-V500 HydrophobicContact CD1-CB 4.47Å; I497-V500 WeakPolarHBondContact O-CB 3.33Å; I497-V500 PolarHBondContact O-N 3.25Å; I497-E501 PolarHBondContact O-N 3.08Å; I497-F524 HydrophobicContact CD1-CD1 4.1Å; I497-F524 HydrophobicContact CD1-CD2 3.67Å; I497-F524 HydrophobicContact CD1-CE1 4.09Å; I497-F524 HydrophobicContact CD1-CE2 3.65Å; I497-F524 HydrophobicContact CD1-CG 3.91Å; I497-F524 HydrophobicContact CD1-CZ 3.86Å; I497-F524 HydrophobicContact CG1-CD2 3.84Å; I497-F524 HydrophobicContact CG1-CE2 3.67Å; I497-F524 HydrophobicContact CG1-CZ 4.26Å
498	E	85.7	Confident	90.2	Very high	100 Å²	100	43.5 Å²	43.5	47%	0.467	23%	0.232	S	C	.	.	H	α-helix	trans	-64.2	-37.7	173.7	-55.9	-167	148.1	0	0	111.9	K464 G496 E501 N502	K464-E498 WeakPolarHBondContact CE-OE1 2.98Å; K464-E498 IonicContact NZ-OE1 2.79Å; K464-E498 PolarHBondContact NZ-OE1 3.07Å; G496-E498 VanDerWaalsContact C-N 3.26Å; G496-E498 PolarHBondContact O-N 2.8Å; E498-E501 PolarHBondContact O-N 3.09Å; E498-N502 WeakPolarHBondContact O-CB 3.08Å; E498-N502 PolarHBondContact O-N 3.39Å; E498-N502 PolarHBondContact O-ND2 3.31Å; E498-N502 PolarHBondContact O-OD1 3.35Å
499	V	87.7	Confident	90.4	Very high	28 Å²	28	41.3 Å²	41.3	17%	0.17	22%	0.219	C	C	.	.	H	α-helix	trans	-63.5	-46.6	175.8	-165.3	0	0	0	0	109.3	L460 G496 I497 E501 N502 F503 V577	L460-V499 HydrophobicContact CD1-CB 4.35Å; L460-V499 HydrophobicContact CD1-CG1 3.9Å; L460-V499 HydrophobicContact CD1-CG2 3.85Å; L460-V499 HydrophobicContact CD2-CG1 4.06Å; G496-V499 WeakPolarHBondContact O-CA 3.29Å; G496-V499 WeakPolarHBondContact O-CB 3.07Å; G496-V499 PolarHBondContact O-N 3.11Å; I497-V499 VanDerWaalsContact C-N 3.33Å; I497-V499 PolarHBondContact O-N 3.01Å; V499-E501 PolarHBondContact O-N 2.58Å; V499-N502 WeakPolarHBondContact O-CB 3.37Å; V499-N502 PolarHBondContact O-N 2.72Å; V499-N502 VanDerWaalsContact O-N 3.14Å; V499-F503 HydrophobicContact CG1-CD2 4.22Å; V499-F503 HydrophobicContact CG1-CE2 3.96Å; V499-F503 VanDerWaalsContact O-CD2 3.25Å; V499-F503 WeakPolarHBondContact O-CD2 3.26Å; V499-F503 PolarHBondContact O-N 2.03Å; V499-V577 HydrophobicContact CB-CG1 4.45Å; V499-V577 HydrophobicContact CG1-CG1 3.81Å
500	V	91	Very high	90.6	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-57.6	-48.5	175.6	169.7	0	0	0	0	111.5	L492 T495 G496 I497 N502 F503 L504 F524 V577 L587	L492-V500 HydrophobicContact CB-CG2 4.3Å; L492-V500 HydrophobicContact CD1-CG1 4.41Å; L492-V500 HydrophobicContact CD2-CG1 4.07Å; L492-V500 HydrophobicContact CD2-CG2 4.16Å; T495-V500 HydrophobicContact CG2-CG2 4.11Å; G496-V500 PolarHBondContact O-N 3.38Å; I497-V500 HydrophobicContact CD1-CB 4.47Å; I497-V500 WeakPolarHBondContact O-CB 3.33Å; I497-V500 PolarHBondContact O-N 3.25Å; V500-N502 VanDerWaalsContact C-N 3.3Å; V500-N502 PolarHBondContact O-N 2.85Å; V500-F503 PolarHBondContact O-N 2.76Å; V500-L504 HydrophobicContact CG1-CD1 3.62Å; V500-L504 HydrophobicContact CG1-CG 4.23Å; V500-L504 WeakPolarHBondContact O-CB 3.36Å; V500-L504 WeakPolarHBondContact O-CG 3.09Å; V500-L504 PolarHBondContact O-N 3.38Å; V500-F524 HydrophobicContact CG1-CE1 3.95Å; V500-F524 HydrophobicContact CG1-CZ 4.14Å; V500-V577 HydrophobicContact CG2-CG1 4.44Å; V500-L587 HydrophobicContact CG1-CD1 3.88Å; V500-L587 HydrophobicContact CG2-CD1 4.47Å
501	E	91.9	Very high	90.8	Very high	33 Å²	33	39.9 Å²	39.9	15%	0.154	22%	0.222	C	C	.	.	H	α-helix	trans	-56.4	-41.3	173.6	-83.4	-165.6	-134.4	0	0	112.9	I497 E498 V499 F503 L504 R505 F522 F524	I497-E501 PolarHBondContact O-N 3.08Å; E498-E501 PolarHBondContact O-N 3.09Å; V499-E501 PolarHBondContact O-N 2.58Å; E501-F503 VanDerWaalsContact C-N 3.32Å; E501-F503 PolarHBondContact O-N 3.38Å; E501-L504 PolarHBondContact O-N 2.89Å; E501-R505 WeakPolarHBondContact O-CB 3.28Å; E501-R505 PolarHBondContact O-N 2.86Å; E501-R505 IonicContact OE2-CZ 3.85Å; E501-R505 IonicContact OE2-NH1 2.77Å; E501-R505 IonicContact OE2-NH2 3.67Å; E501-R505 PolarHBondContact OE2-NH2 2.93Å; E501-F522 HydrophobicContact CB-CD2 4.43Å; E501-F522 HydrophobicContact CG-CB 3.71Å; E501-F522 HydrophobicContact CG-CD2 3.99Å; E501-F522 HydrophobicContact CG-CG 3.87Å; E501-F524 HydrophobicContact CG-CE2 3.89Å; E501-F524 HydrophobicContact CG-CZ 3.9Å
502	N	89.8	Confident	91.1	Very high	18 Å²	18	35.5 Å²	35.5	10%	0.096	20%	0.203	C	C	.	.	H	α-helix	trans	-62.4	-40.4	-175.5	-65.2	-14	0	0	0	112	I461 W463 E498 V499 V500 T506	I461-N502 PolarHBondContact O-ND2 3.33Å; W463-N502 PolarHBondContact NE1-O 2.83Å; E498-N502 WeakPolarHBondContact O-CB 3.08Å; E498-N502 PolarHBondContact O-N 3.39Å; E498-N502 PolarHBondContact O-ND2 3.31Å; E498-N502 PolarHBondContact O-OD1 3.35Å; V499-N502 WeakPolarHBondContact O-CB 3.37Å; V499-N502 PolarHBondContact O-N 2.72Å; V499-N502 VanDerWaalsContact O-N 3.14Å; V500-N502 VanDerWaalsContact C-N 3.3Å; V500-N502 PolarHBondContact O-N 2.85Å; N502-T506 PolarHBondContact O-N 2.87Å; N502-T506 PolarHBondContact O-OG1 2.84Å
503	F	92.2	Very high	91.2	Very high	54 Å²	54	36.5 Å²	36.5	24%	0.237	21%	0.213	C	C	.	.	H	α-helix	trans	-82.3	-39.2	178	-68.9	-79.9	0	0	0	112.5	L460 V499 V500 E501 R505 T506 S507 V575 V577 P578	L460-F503 HydrophobicContact CD2-CE2 3.49Å; L460-F503 VanDerWaalsContact CD2-CE2 3.49Å; L460-F503 HydrophobicContact CD2-CZ 3.78Å; V499-F503 HydrophobicContact CG1-CD2 4.22Å; V499-F503 HydrophobicContact CG1-CE2 3.96Å; V499-F503 VanDerWaalsContact O-CD2 3.25Å; V499-F503 WeakPolarHBondContact O-CD2 3.26Å; V499-F503 PolarHBondContact O-N 2.03Å; V500-F503 PolarHBondContact O-N 2.76Å; E501-F503 VanDerWaalsContact C-N 3.32Å; E501-F503 PolarHBondContact O-N 3.38Å; F503-R505 PolarHBondContact O-N 3.35Å; F503-T506 PolarHBondContact O-N 3.15Å; F503-S507 PolarHBondContact O-N 2.83Å; F503-S507 PolarHBondContact O-OG 3.33Å; F503-V575 HydrophobicContact CB-CG1 3.73Å; F503-V577 HydrophobicContact CB-CG2 4.07Å; F503-V577 HydrophobicContact CD2-CB 4.44Å; F503-V577 HydrophobicContact CD2-CG1 4.02Å; F503-V577 HydrophobicContact CD2-CG2 4.47Å; F503-V577 HydrophobicContact CG-CG2 4.47Å; F503-P578 HydrophobicContact CE1-CG 4.3Å; F503-P578 VanDerWaalsContact CE2-CD 3.41Å; F503-P578 HydrophobicContact CE2-CG 3.77Å; F503-P578 HydrophobicContact CZ-CG 3.51Å
504	L	94.6	Very high	91.5	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-59.9	-46.2	174	-72.4	176.8	0	0	0	111.7	V485 V500 E501 T506 S507 I508 F522 F524 V533 V575 L587 I589	V485-L504 HydrophobicContact CG1-CD2 4.32Å; V500-L504 HydrophobicContact CG1-CD1 3.62Å; V500-L504 HydrophobicContact CG1-CG 4.23Å; V500-L504 WeakPolarHBondContact O-CB 3.36Å; V500-L504 WeakPolarHBondContact O-CG 3.09Å; V500-L504 PolarHBondContact O-N 3.38Å; E501-L504 PolarHBondContact O-N 2.89Å; L504-T506 VanDerWaalsContact C-N 3.32Å; L504-T506 PolarHBondContact O-N 2.74Å; L504-S507 PolarHBondContact O-N 2.84Å; L504-I508 HydrophobicContact CB-CD1 4.41Å; L504-I508 WeakPolarHBondContact O-CB 3.36Å; L504-I508 WeakPolarHBondContact O-CD1 2.97Å; L504-I508 WeakPolarHBondContact O-CG1 3.15Å; L504-I508 PolarHBondContact O-N 2.78Å; L504-F522 HydrophobicContact CB-CE1 4.02Å; L504-F522 HydrophobicContact CB-CZ 4.41Å; L504-F524 HydrophobicContact CD1-CE1 3.82Å; L504-F524 HydrophobicContact CD1-CZ 4.21Å; L504-V533 HydrophobicContact CD1-CG1 4.31Å; L504-V533 HydrophobicContact CD1-CG2 4.49Å; L504-V575 HydrophobicContact CD2-CG1 4.35Å; L504-V575 HydrophobicContact CD2-CG2 4.35Å; L504-L587 HydrophobicContact CD2-CD1 4.43Å; L504-I589 HydrophobicContact CD2-CD1 4.13Å; L504-I589 HydrophobicContact CD2-CG1 4.13Å
505	R	94.4	Very high	91.8	Very high	22 Å²	22	26.9 Å²	26.9	8%	0.083	17%	0.165	C	C	.	.	H	α-helix	trans	-54	-48.1	173.8	-177.1	179.6	-79.8	99.1	-7.9	111.7	E501 F503 A509 P516 V519 F522	E501-R505 WeakPolarHBondContact O-CB 3.28Å; E501-R505 PolarHBondContact O-N 2.86Å; E501-R505 IonicContact OE2-CZ 3.85Å; E501-R505 IonicContact OE2-NH1 2.77Å; E501-R505 IonicContact OE2-NH2 3.67Å; E501-R505 PolarHBondContact OE2-NH2 2.93Å; F503-R505 PolarHBondContact O-N 3.35Å; R505-A509 WeakPolarHBondContact O-CB 3.22Å; R505-A509 PolarHBondContact O-N 3.32Å; R505-P516 WeakPolarHBondContact CD-O 3.5Å; R505-P516 HydrophobicContact CG-CB 4.41Å; R505-P516 WeakPolarHBondContact CG-O 3.45Å; R505-V519 HydrophobicContact CG-CB 4.15Å; R505-V519 HydrophobicContact CG-CG1 4.47Å; R505-V519 PolarHBondContact NE-O 2.04Å; R505-F522 HydrophobicContact CB-CE2 3.78Å; R505-F522 HydrophobicContact CB-CZ 3.94Å; R505-F522 HydrophobicContact CG-CE2 4.29Å
506	T	93.1	Very high	92.2	Very high	36 Å²	36	26.7 Å²	26.7	22%	0.221	16%	0.164	C	C	.	.	H	α-helix	trans	-64.2	-46.3	-179.3	-57.8	0	0	0	0	111.9	N502 F503 L504 A510	N502-T506 PolarHBondContact O-N 2.87Å; N502-T506 PolarHBondContact O-OG1 2.84Å; F503-T506 PolarHBondContact O-N 3.15Å; L504-T506 VanDerWaalsContact C-N 3.32Å; L504-T506 PolarHBondContact O-N 2.74Å; T506-A510 WeakPolarHBondContact O-CB 3.4Å; T506-A510 PolarHBondContact O-N 3.07Å
507	S	94.3	Very high	92.6	Very high	27 Å²	27	25.8 Å²	25.8	19%	0.189	15%	0.153	C	C	.	.	H	α-helix	trans	-70.2	-42.1	-179	-67.4	0	0	0	0	113.1	F503 L504 A510 V511	F503-S507 PolarHBondContact O-N 2.83Å; F503-S507 PolarHBondContact O-OG 3.33Å; L504-S507 PolarHBondContact O-N 2.84Å; S507-A510 PolarHBondContact O-N 3.15Å; S507-V511 WeakPolarHBondContact O-CG2 3.33Å; S507-V511 PolarHBondContact O-N 2.88Å
508	I	95.6	Very high	92.9	Very high	4 Å²	4	24.3 Å²	24.3	2%	0.021	15%	0.145	C	C	.	.	H	α-helix	trans	-62.3	-45	175.9	-67.3	164.9	0	0	0	110.1	I483 L504 A510 V511 A512 V519 F522 F535 L564 I589	I483-I508 HydrophobicContact CD1-CD1 3.71Å; I483-I508 HydrophobicContact CD1-CG1 4.19Å; L504-I508 HydrophobicContact CB-CD1 4.41Å; L504-I508 WeakPolarHBondContact O-CB 3.36Å; L504-I508 WeakPolarHBondContact O-CD1 2.97Å; L504-I508 WeakPolarHBondContact O-CG1 3.15Å; L504-I508 PolarHBondContact O-N 2.78Å; I508-A510 PolarHBondContact O-N 2.88Å; I508-V511 PolarHBondContact O-N 2.78Å; I508-A512 WeakPolarHBondContact O-CB 3.45Å; I508-A512 PolarHBondContact O-N 2.8Å; I508-V519 HydrophobicContact CB-CG1 4.3Å; I508-V519 HydrophobicContact CG2-CG1 3.91Å; I508-V519 HydrophobicContact CG2-CG2 4.24Å; I508-F522 HydrophobicContact CD1-CE1 3.78Å; I508-F522 HydrophobicContact CD1-CZ 4.07Å; I508-F535 HydrophobicContact CD1-CD1 4.3Å; I508-F535 HydrophobicContact CD1-CD2 4.35Å; I508-F535 HydrophobicContact CD1-CE1 4.44Å; I508-F535 HydrophobicContact CD1-CE2 4.45Å; I508-F535 HydrophobicContact CD1-CG 4.27Å; I508-F535 HydrophobicContact CG2-CD2 4.11Å; I508-F535 HydrophobicContact CG2-CE2 3.69Å; I508-F535 HydrophobicContact CG2-CZ 4.29Å; I508-L564 HydrophobicContact CG2-CD1 4.48Å; I508-L564 HydrophobicContact CG2-CD2 3.99Å; I508-I589 HydrophobicContact CG1-CD1 4.11Å
509	A	95.1	Very high	93.3	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-62.8	-42	177.8	0	0	0	0	0	112.6	R505 A512 G513 V514 P516 V519	R505-A509 WeakPolarHBondContact O-CB 3.22Å; R505-A509 PolarHBondContact O-N 3.32Å; A509-A512 PolarHBondContact O-N 2.94Å; A509-G513 WeakPolarHBondContact O-CA 3.49Å; A509-G513 PolarHBondContact O-N 2.82Å; A509-V514 HydrophobicContact CB-CG2 4.46Å; A509-V514 PolarHBondContact O-N 3.04Å; A509-P516 HydrophobicContact CB-CB 4.09Å; A509-P516 HydrophobicContact CB-CG 4Å; A509-V519 HydrophobicContact CB-CG2 3.89Å
510	A	93.7	Very high	93.4	Very high	77 Å²	77	18.5 Å²	18.5	64%	0.636	12%	0.117	S	C	*	.	H	α-helix	trans	-63.4	-41.6	176	0	0	0	0	0	112.8	T506 S507 I508 G513	T506-A510 WeakPolarHBondContact O-CB 3.4Å; T506-A510 PolarHBondContact O-N 3.07Å; S507-A510 PolarHBondContact O-N 3.15Å; I508-A510 PolarHBondContact O-N 2.88Å; A510-G513 PolarHBondContact O-N 3.41Å
511	V	94.6	Very high	93.2	Very high	33 Å²	33	23.4 Å²	23.4	20%	0.2	14%	0.135	C	C	.	.	H	α-helix	trans	-69.9	-41.4	177.8	173.9	0	0	0	0	111.8	S507 I508 G513 L564 T567 V573	S507-V511 WeakPolarHBondContact O-CG2 3.33Å; S507-V511 PolarHBondContact O-N 2.88Å; I508-V511 PolarHBondContact O-N 2.78Å; V511-G513 PolarHBondContact O-N 3.02Å; V511-L564 HydrophobicContact CB-CD2 4.18Å; V511-L564 HydrophobicContact CG1-CD2 3.97Å; V511-T567 HydrophobicContact CG1-CG2 3.71Å; V511-V573 HydrophobicContact CG2-CG1 4.04Å; V511-V573 HydrophobicContact CG2-CG2 4.08Å
512	A	94.2	Very high	93.2	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-63.9	-31.4	171.1	0	0	0	0	0	112.3	I508 A509 V514 K555 A560 L564	I508-A512 WeakPolarHBondContact O-CB 3.45Å; I508-A512 PolarHBondContact O-N 2.8Å; A509-A512 PolarHBondContact O-N 2.94Å; A512-V514 HydrophobicContact CB-CG1 4.3Å; A512-V514 HydrophobicContact CB-CG2 3.94Å; A512-K555 WeakPolarHBondContact O-CD 3.1Å; A512-K555 PolarHBondContact O-NZ 3.1Å; A512-A560 HydrophobicContact CB-CB 4.3Å; A512-L564 HydrophobicContact CB-CD1 4.05Å; A512-L564 HydrophobicContact CB-CD2 4.18Å; A512-L564 HydrophobicContact CB-CG 3.83Å
513	G	93.1	Very high	93.3	Very high	20 Å²	20	28 Å²	28	21%	0.206	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.3	53.6	-165.3	0	0	0	0	0	111.5	A509 A510 V511 K555	A509-G513 WeakPolarHBondContact O-CA 3.49Å; A509-G513 PolarHBondContact O-N 2.82Å; A510-G513 PolarHBondContact O-N 3.41Å; V511-G513 PolarHBondContact O-N 3.02Å; G513-K555 VanDerWaalsContact O-CD 3.26Å; G513-K555 WeakPolarHBondContact O-CD 3.12Å; G513-K555 WeakPolarHBondContact O-CE 3.16Å
514	V	93.9	Very high	93.2	Very high	16 Å²	16	26.6 Å²	26.6	10%	0.097	15%	0.151	C	C	.	.	S	Bend	trans	-127.2	163	169.6	-59	0	0	0	0	109.5	A509 A512 R518 V519 K555 A560	A509-V514 HydrophobicContact CB-CG2 4.46Å; A509-V514 PolarHBondContact O-N 3.04Å; A512-V514 HydrophobicContact CB-CG1 4.3Å; A512-V514 HydrophobicContact CB-CG2 3.94Å; V514-R518 HydrophobicContact CG2-CB 4.24Å; V514-V519 HydrophobicContact CG2-CG2 4.14Å; V514-K555 HydrophobicContact CG1-CB 4.3Å; V514-A560 HydrophobicContact CG1-CB 3.65Å
515	S	93.6	Very high	93.1	Very high	14 Å²	14	31.2 Å²	31.2	10%	0.098	17%	0.173	C	C	.	.			trans	-57.7	136.9	172.4	176.5	0	0	0	0	111.1	D320 L517 R518	D320-S515 WeakPolarHBondContact OD2-CB 3.25Å; D320-S515 PolarHBondContact OD2-OG 3.13Å; S515-L517 PolarHBondContact O-N 3.17Å; S515-L517 VanDerWaalsContact O-N 3.09Å; S515-L517 PolarHBondContact OG-N 3.1Å; S515-R518 WeakPolarHBondContact O-CB 3.34Å; S515-R518 PolarHBondContact O-N 3.02Å
516	P	93.9	Very high	92.8	Very high	16 Å²	16	34.7 Å²	34.7	10%	0.104	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-55.5	-25.9	175.1	-27.3	35.7	0	0	0	114.5	K289 W463 R505 A509 R518 V519	K289-P516 HydrophobicContact CD-CG 4.26Å; W463-P516 HydrophobicContact CH2-CB 3.38Å; W463-P516 HydrophobicContact CH2-CG 3.98Å; W463-P516 HydrophobicContact CZ2-CB 3.87Å; W463-P516 HydrophobicContact CZ3-CB 3.82Å; R505-P516 WeakPolarHBondContact CD-O 3.5Å; R505-P516 HydrophobicContact CG-CB 4.41Å; R505-P516 WeakPolarHBondContact CG-O 3.45Å; A509-P516 HydrophobicContact CB-CB 4.09Å; A509-P516 HydrophobicContact CB-CG 4Å; P516-R518 PolarHBondContact O-N 3.08Å; P516-V519 PolarHBondContact O-N 3.34Å
517	L	94.5	Very high	92.6	Very high	10 Å²	10	36.1 Å²	36.1	5%	0.052	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-59	-30.7	173	-61.1	-174.1	0	0	0	112.6	L291 T318 D320 Y327 W463 F466 V468 L472 S515 V519	L291-L517 HydrophobicContact CD1-CD2 4.04Å; L291-L517 HydrophobicContact CD1-CG 4.43Å; L291-L517 HydrophobicContact CD2-CD1 4.31Å; T318-L517 HydrophobicContact CG2-CD1 4.09Å; D320-L517 HydrophobicContact CB-CD1 3.82Å; Y327-L517 HydrophobicContact CD2-CD1 4.31Å; Y327-L517 HydrophobicContact CE2-CD1 3.83Å; W463-L517 HydrophobicContact CE3-CD2 4.24Å; W463-L517 HydrophobicContact CZ3-CD2 3.99Å; F466-L517 HydrophobicContact CB-CD2 3.83Å; F466-L517 WeakPolarHBondContact O-CD2 3.37Å; V468-L517 HydrophobicContact CG2-CB 3.83Å; V468-L517 HydrophobicContact CG2-CD1 4.21Å; V468-L517 HydrophobicContact CG2-CG 4.46Å; L472-L517 WeakPolarHBondContact CD1-O 3.28Å; S515-L517 PolarHBondContact O-N 3.17Å; S515-L517 VanDerWaalsContact O-N 3.09Å; S515-L517 PolarHBondContact OG-N 3.1Å; L517-V519 VanDerWaalsContact C-N 3.26Å; L517-V519 PolarHBondContact O-N 2.87Å
518	R	93.7	Very high	92.2	Very high	2 Å²	2	37.9 Å²	37.9	1%	0.008	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-77	-9	-178.3	-72.9	-173.1	50.7	-162.8	-14.1	114.1	L472 V514 S515 P516 V537 S538 N539 E554 K555	L472-R518 HydrophobicContact CD1-CG 4.42Å; L472-R518 HydrophobicContact CD2-CG 4.04Å; V514-R518 HydrophobicContact CG2-CB 4.24Å; S515-R518 WeakPolarHBondContact O-CB 3.34Å; S515-R518 PolarHBondContact O-N 3.02Å; P516-R518 PolarHBondContact O-N 3.08Å; R518-V537 WeakPolarHBondContact O-CA 3.36Å; R518-S538 VanDerWaalsContact CA-OG 3.3Å; R518-S538 WeakPolarHBondContact CA-OG 3.36Å; R518-S538 WeakPolarHBondContact CB-OG 3.46Å; R518-S538 WeakPolarHBondContact CG-OG 3.47Å; R518-S538 PolarHBondContact NE-O 2.84Å; R518-S538 PolarHBondContact NE-OG 2.81Å; R518-S538 PolarHBondContact NH2-O 3.32Å; R518-S538 PolarHBondContact O-N 2.98Å; R518-S538 PolarHBondContact O-OG 2.9Å; R518-S538 VanDerWaalsContact O-OG 3.1Å; R518-N539 PolarHBondContact NE-O 2.81Å; R518-E554 WeakPolarHBondContact CD-OE1 3.46Å; R518-E554 IonicContact CZ-OE1 3.8Å; R518-E554 IonicContact NE-OE1 2.73Å; R518-E554 IonicContact NH1-OE1 3.73Å; R518-E554 PolarHBondContact NH1-OE1 2.96Å; R518-K555 PolarHBondContact NH1-O 3.06Å; R518-K555 PolarHBondContact NH2-O 3.36Å
519	V	93.7	Very high	91.8	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	119.3	179.1	-174.2	0	0	0	0	109.9	R505 I508 A509 V514 P516 L517 F522 F535 Q536 V537	R505-V519 HydrophobicContact CG-CB 4.15Å; R505-V519 HydrophobicContact CG-CG1 4.47Å; R505-V519 PolarHBondContact NE-O 2.04Å; I508-V519 HydrophobicContact CB-CG1 4.3Å; I508-V519 HydrophobicContact CG2-CG1 3.91Å; I508-V519 HydrophobicContact CG2-CG2 4.24Å; A509-V519 HydrophobicContact CB-CG2 3.89Å; V514-V519 HydrophobicContact CG2-CG2 4.14Å; P516-V519 PolarHBondContact O-N 3.34Å; L517-V519 VanDerWaalsContact C-N 3.26Å; L517-V519 PolarHBondContact O-N 2.87Å; V519-F522 HydrophobicContact CG1-CE2 4.21Å; V519-F522 HydrophobicContact CG1-CZ 3.8Å; V519-F535 HydrophobicContact CG1-CD2 4.18Å; V519-Q536 WeakPolarHBondContact CA-O 3.04Å; V519-V537 HydrophobicContact CG2-CG2 4.37Å
520	S	91.1	Very high	91.7	Very high	7 Å²	7	50 Å²	50	5%	0.049	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	179.6	-166.4	53.8	0	0	0	0	113.2	Y474 F522 Q536	Y474-S520 PolarHBondContact OH-OG 3.06Å; Y474-S520 VanDerWaalsContact OH-OG 3.12Å; S520-F522 PolarHBondContact O-N 2.93Å; S520-Q536 PolarHBondContact N-O 3.28Å; S520-Q536 PolarHBondContact O-N 2.92Å; S520-Q536 WeakPolarHBondContact OG-CG 3.43Å; S520-Q536 PolarHBondContact OG-NE2 3.27Å
521	R	87.1	Confident	91.6	Very high	103 Å²	103	46.4 Å²	46.4	39%	0.389	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	47.2	62.8	175.8	-55.6	-63	176.1	117.5	-3.3	113.8	Q536 N611	R521-Q536 HydrophobicContact CB-CG 3.99Å; R521-Q536 VanDerWaalsContact CG-CD 3.47Å; R521-Q536 HydrophobicContact CG-CG 4.12Å; R521-N611 PolarHBondContact NH1-OD1 2.95Å; R521-N611 PolarHBondContact NH2-OD1 3.05Å; R521-N611 VanDerWaalsContact NH2-OD1 3.08Å
522	F	90.9	Very high	91.5	Very high	23 Å²	23	46.8 Å²	46.8	10%	0.101	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	141	172.7	-72.9	-87.1	0	0	0	111.5	E501 L504 R505 I508 V519 S520 F524 V533 F534 F535	E501-F522 HydrophobicContact CB-CD2 4.43Å; E501-F522 HydrophobicContact CG-CB 3.71Å; E501-F522 HydrophobicContact CG-CD2 3.99Å; E501-F522 HydrophobicContact CG-CG 3.87Å; L504-F522 HydrophobicContact CB-CE1 4.02Å; L504-F522 HydrophobicContact CB-CZ 4.41Å; R505-F522 HydrophobicContact CB-CE2 3.78Å; R505-F522 HydrophobicContact CB-CZ 3.94Å; R505-F522 HydrophobicContact CG-CE2 4.29Å; I508-F522 HydrophobicContact CD1-CE1 3.78Å; I508-F522 HydrophobicContact CD1-CZ 4.07Å; V519-F522 HydrophobicContact CG1-CE2 4.21Å; V519-F522 HydrophobicContact CG1-CZ 3.8Å; S520-F522 PolarHBondContact O-N 2.93Å; F522-F524 HydrophobicContact CB-CE2 3.85Å; F522-F524 HydrophobicContact CB-CZ 4.11Å; F522-F524 HydrophobicContact CD1-CZ 4.44Å; F522-V533 HydrophobicContact CD1-CG1 3.77Å; F522-V533 HydrophobicContact CE1-CG1 4.34Å; F522-F534 CarbonylContact C-O 3.58Å; F522-F534 VanDerWaalsContact CA-O 3.29Å; F522-F534 WeakPolarHBondContact CA-O 3.05Å; F522-F535 HydrophobicContact CD1-CB 3.98Å; F522-F535 HydrophobicContact CE1-CB 3.79Å; F522-F535 HydrophobicContact CE1-CG 4.43Å; F522-F535 HydrophobicContact CZ-CB 4.21Å
523	M	91.2	Very high	91.5	Very high	124 Å²	124	46.8 Å²	46.8	61%	0.611	25%	0.253	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-142.7	142.4	169	-167.5	-170.4	-61.3	0	0	109.4	V533 F534	M523-V533 CarbonylContact O-C 3.56Å; M523-V533 WeakPolarHBondContact O-CA 3.07Å; M523-F534 HydrophobicContact CB-CB 4.14Å; M523-F534 PolarHBondContact N-O 3.07Å; M523-F534 PolarHBondContact O-N 2.84Å
524	F	91.8	Very high	91.5	Very high	24 Å²	24	48.4 Å²	48.4	11%	0.105	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	116.6	-170.1	-60.4	-92.5	0	0	0	110	L492 I497 V500 E501 L504 F522 T531 V533	L492-F524 HydrophobicContact CD1-CD1 3.56Å; L492-F524 HydrophobicContact CD1-CE1 3.96Å; L492-F524 HydrophobicContact CD1-CG 4.48Å; I497-F524 HydrophobicContact CD1-CD1 4.1Å; I497-F524 HydrophobicContact CD1-CD2 3.67Å; I497-F524 HydrophobicContact CD1-CE1 4.09Å; I497-F524 HydrophobicContact CD1-CE2 3.65Å; I497-F524 HydrophobicContact CD1-CG 3.91Å; I497-F524 HydrophobicContact CD1-CZ 3.86Å; I497-F524 HydrophobicContact CG1-CD2 3.84Å; I497-F524 HydrophobicContact CG1-CE2 3.67Å; I497-F524 HydrophobicContact CG1-CZ 4.26Å; V500-F524 HydrophobicContact CG1-CE1 3.95Å; V500-F524 HydrophobicContact CG1-CZ 4.14Å; E501-F524 HydrophobicContact CG-CE2 3.89Å; E501-F524 HydrophobicContact CG-CZ 3.9Å; L504-F524 HydrophobicContact CD1-CE1 3.82Å; L504-F524 HydrophobicContact CD1-CZ 4.21Å; F522-F524 HydrophobicContact CB-CE2 3.85Å; F522-F524 HydrophobicContact CB-CZ 4.11Å; F522-F524 HydrophobicContact CD1-CZ 4.44Å; F524-T531 HydrophobicContact CB-CG2 3.9Å; F524-T531 HydrophobicContact CD1-CG2 4.03Å; F524-T531 HydrophobicContact CG-CG2 4.49Å; F524-V533 HydrophobicContact CD1-CB 4.44Å; F524-V533 HydrophobicContact CD1-CG1 4.05Å; F524-V533 HydrophobicContact CD1-CG2 3.81Å; F524-V533 HydrophobicContact CE1-CB 4.47Å; F524-V533 HydrophobicContact CE1-CG1 3.74Å; F524-V533 HydrophobicContact CE1-CG2 3.93Å; F524-V533 HydrophobicContact CZ-CG1 4.26Å
525	Q	90.7	Very high	91.5	Very high	98 Å²	98	47.8 Å²	47.8	46%	0.458	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	135.4	-179.3	-172.3	177.3	-0.4	0	0	110.3	T531 M532 F534	Q525-T531 WeakPolarHBondContact O-CA 3.19Å; Q525-M532 HydrophobicContact CB-CB 4.49Å; Q525-M532 PolarHBondContact N-O 2.88Å; Q525-M532 PolarHBondContact O-N 3.08Å; Q525-F534 HydrophobicContact CB-CE2 4Å; Q525-F534 VanDerWaalsContact OE1-CE2 3.31Å
526	P	89.6	Confident	91.4	Very high	95 Å²	95	47.6 Å²	47.6	62%	0.617	25%	0.248	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-70	133.4	-179.2	27.9	-33.9	0	0	0	111.7	V489	V489-P526 HydrophobicContact CG2-CB 3.9Å
527	D	87.3	Confident	91.4	Very high	66 Å²	66	46.9 Å²	46.9	35%	0.353	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	71.8	174.9	177	43.6	0	0	0	108.9	H484 N529 R530	H484-D527 IonicContact CD2-OD2 3.33Å; H484-D527 PolarHBondContact CD2-OD2 2.05Å; D527-N529 PolarHBondContact O-N 3.36Å; D527-N529 VanDerWaalsContact O-N 3.11Å; D527-R530 CarbonylContact C-O 3.56Å; D527-R530 HydrophobicContact CB-CB 4.33Å; D527-R530 PolarHBondContact N-O 2.69Å; D527-R530 WeakPolarHBondContact O-CA 3.5Å; D527-R530 WeakPolarHBondContact O-CB 3.28Å; D527-R530 PolarHBondContact O-N 3.32Å
528	G	86.5	Confident	91.4	Very high	63 Å²	63	46.4 Å²	46.4	65%	0.649	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.5	-115	-172.8	0	0	0	0	0	112.2	R530	G528-R530 PolarHBondContact O-N 3.4Å
529	N	87.9	Confident	91.3	Very high	146 Å²	146	49.1 Å²	49.1	78%	0.781	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	5.9	177.8	-68.7	-5.2	0	0	0	113.6	D527	D527-N529 PolarHBondContact O-N 3.36Å; D527-N529 VanDerWaalsContact O-N 3.11Å
530	R	91.8	Very high	91.3	Very high	114 Å²	114	50.9 Å²	50.9	43%	0.43	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	173	-179.2	-60.2	174.2	-177.4	172.9	-0.7	110.1	V485 A487 D527 G528	V485-R530 WeakPolarHBondContact O-CA 3.27Å; V485-R530 WeakPolarHBondContact O-CB 3.23Å; A487-R530 CarbonylContact O-C 3.55Å; D527-R530 CarbonylContact C-O 3.56Å; D527-R530 HydrophobicContact CB-CB 4.33Å; D527-R530 PolarHBondContact N-O 2.69Å; D527-R530 WeakPolarHBondContact O-CA 3.5Å; D527-R530 WeakPolarHBondContact O-CB 3.28Å; D527-R530 PolarHBondContact O-N 3.32Å; G528-R530 PolarHBondContact O-N 3.4Å
531	T	92.4	Very high	91.3	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	128.2	169	-58.9	0	0	0	0	109	H484 V485 A487 V489 L492 F524 Q525 V533	H484-T531 WeakPolarHBondContact CA-O 3.48Å; V485-T531 PolarHBondContact N-O 2.8Å; V485-T531 PolarHBondContact O-N 2.96Å; V485-T531 VanDerWaalsContact O-N 3.16Å; A487-T531 WeakPolarHBondContact O-CB 3.49Å; A487-T531 PolarHBondContact O-N 2.87Å; A487-T531 PolarHBondContact O-OG1 3.44Å; V489-T531 HydrophobicContact CG2-CG2 3.66Å; V489-T531 WeakPolarHBondContact CG2-OG1 3.25Å; V489-T531 PolarHBondContact N-OG1 2.89Å; V489-T531 VanDerWaalsContact N-OG1 3.14Å; L492-T531 HydrophobicContact CD1-CG2 3.85Å; F524-T531 HydrophobicContact CB-CG2 3.9Å; F524-T531 HydrophobicContact CD1-CG2 4.03Å; F524-T531 HydrophobicContact CG-CG2 4.49Å; Q525-T531 WeakPolarHBondContact O-CA 3.19Å; T531-V533 HydrophobicContact CG2-CG2 4.17Å
532	M	93.1	Very high	91.4	Very high	42 Å²	42	49.1 Å²	49.1	21%	0.207	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	122.1	164.3	-169	-177	-62	0	0	108	T482 H484 Q525 F534	T482-M532 HydrophobicContact CG2-CG 4.16Å; T482-M532 HydrophobicContact CG2-SD 4.01Å; H484-M532 WeakPolarHBondContact NE2-CE 3.3Å; Q525-M532 HydrophobicContact CB-CB 4.49Å; Q525-M532 PolarHBondContact N-O 2.88Å; Q525-M532 PolarHBondContact O-N 3.08Å; M532-F534 HydrophobicContact CG-CE2 4.06Å; M532-F534 HydrophobicContact CG-CZ 4.49Å; M532-F534 HydrophobicContact SD-CE2 3.8Å; M532-F534 HydrophobicContact SD-CZ 3.69Å
533	V	93.7	Very high	91.5	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	112.6	179.5	-171.5	0	0	0	0	108.3	T482 I483 V485 L504 F522 M523 F524 T531	T482-V533 CarbonylContact C-O 3.58Å; T482-V533 VanDerWaalsContact CA-O 3.28Å; T482-V533 WeakPolarHBondContact CA-O 3Å; I483-V533 HydrophobicContact CG1-CB 3.96Å; I483-V533 PolarHBondContact N-O 3.27Å; I483-V533 PolarHBondContact O-N 3.17Å; V485-V533 HydrophobicContact CG1-CG2 4.02Å; V485-V533 HydrophobicContact CG2-CG2 3.83Å; L504-V533 HydrophobicContact CD1-CG1 4.31Å; L504-V533 HydrophobicContact CD1-CG2 4.49Å; F522-V533 HydrophobicContact CD1-CG1 3.77Å; F522-V533 HydrophobicContact CE1-CG1 4.34Å; M523-V533 CarbonylContact O-C 3.56Å; M523-V533 WeakPolarHBondContact O-CA 3.07Å; F524-V533 HydrophobicContact CD1-CB 4.44Å; F524-V533 HydrophobicContact CD1-CG1 4.05Å; F524-V533 HydrophobicContact CD1-CG2 3.81Å; F524-V533 HydrophobicContact CE1-CB 4.47Å; F524-V533 HydrophobicContact CE1-CG1 3.74Å; F524-V533 HydrophobicContact CE1-CG2 3.93Å; F524-V533 HydrophobicContact CZ-CG1 4.26Å; T531-V533 HydrophobicContact CG2-CG2 4.17Å
534	F	93.2	Very high	91.6	Very high	54 Å²	54	51.4 Å²	51.4	24%	0.237	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	145	168.6	-59.6	-108.8	0	0	0	109	M481 T482 F522 M523 Q525 M532 A597	M481-F534 WeakPolarHBondContact O-CA 3.43Å; T482-F534 HydrophobicContact CG2-CB 4.44Å; T482-F534 HydrophobicContact CG2-CD1 3.34Å; T482-F534 HydrophobicContact CG2-CD2 4.24Å; T482-F534 HydrophobicContact CG2-CE1 3.46Å; T482-F534 VanDerWaalsContact CG2-CE1 3.46Å; T482-F534 HydrophobicContact CG2-CE2 4.32Å; T482-F534 HydrophobicContact CG2-CG 3.75Å; T482-F534 HydrophobicContact CG2-CZ 3.96Å; F522-F534 CarbonylContact C-O 3.58Å; F522-F534 VanDerWaalsContact CA-O 3.29Å; F522-F534 WeakPolarHBondContact CA-O 3.05Å; M523-F534 HydrophobicContact CB-CB 4.14Å; M523-F534 PolarHBondContact N-O 3.07Å; M523-F534 PolarHBondContact O-N 2.84Å; Q525-F534 HydrophobicContact CB-CE2 4Å; Q525-F534 VanDerWaalsContact OE1-CE2 3.31Å; M532-F534 HydrophobicContact CG-CE2 4.06Å; M532-F534 HydrophobicContact CG-CZ 4.49Å; M532-F534 HydrophobicContact SD-CE2 3.8Å; M532-F534 HydrophobicContact SD-CZ 3.69Å; F534-A597 HydrophobicContact CD1-CB 3.98Å; F534-A597 HydrophobicContact CE1-CB 4.36Å
535	F	93.3	Very high	91.7	Very high	3 Å²	3	50.8 Å²	50.8	1%	0.013	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	160.9	173	60.9	-77.4	0	0	0	109.7	M481 I483 I508 V519 F522 V537 L594	M481-F535 HydrophobicContact CB-CE1 3.91Å; M481-F535 HydrophobicContact CB-CE2 3.95Å; M481-F535 HydrophobicContact CB-CZ 3.58Å; M481-F535 PolarHBondContact N-O 3.43Å; M481-F535 PolarHBondContact O-N 3.41Å; M481-F535 VanDerWaalsContact O-O 3.11Å; M481-F535 HydrophobicContact SD-CE2 4.48Å; M481-F535 HydrophobicContact SD-CZ 4.48Å; I483-F535 HydrophobicContact CB-CE1 4.28Å; I483-F535 HydrophobicContact CD1-CD1 4.42Å; I483-F535 HydrophobicContact CD1-CE1 4.02Å; I483-F535 HydrophobicContact CG1-CD1 4.25Å; I483-F535 HydrophobicContact CG1-CE1 3.8Å; I483-F535 HydrophobicContact CG2-CE1 3.86Å; I483-F535 HydrophobicContact CG2-CZ 4.23Å; I508-F535 HydrophobicContact CD1-CD1 4.3Å; I508-F535 HydrophobicContact CD1-CD2 4.35Å; I508-F535 HydrophobicContact CD1-CE1 4.44Å; I508-F535 HydrophobicContact CD1-CE2 4.45Å; I508-F535 HydrophobicContact CD1-CG 4.27Å; I508-F535 HydrophobicContact CG2-CD2 4.11Å; I508-F535 HydrophobicContact CG2-CE2 3.69Å; I508-F535 HydrophobicContact CG2-CZ 4.29Å; V519-F535 HydrophobicContact CG1-CD2 4.18Å; F522-F535 HydrophobicContact CD1-CB 3.98Å; F522-F535 HydrophobicContact CE1-CB 3.79Å; F522-F535 HydrophobicContact CE1-CG 4.43Å; F522-F535 HydrophobicContact CZ-CB 4.21Å; F535-V537 HydrophobicContact CD2-CG2 3.86Å; F535-V537 HydrophobicContact CE2-CG2 3.7Å; F535-L594 HydrophobicContact CZ-CD1 4.13Å
536	Q	92	Very high	91.9	Very high	10 Å²	10	47 Å²	47	5%	0.047	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	137.6	172.4	74.6	-176.9	16.5	0	0	111.6	Y474 S479 Y480 V519 S520 R521	Y474-Q536 HydrophobicContact CD1-CB 4.41Å; Y474-Q536 HydrophobicContact CD1-CG 4.1Å; Y474-Q536 HydrophobicContact CE1-CB 4.36Å; Y474-Q536 VanDerWaalsContact CE1-CD 3.48Å; Y474-Q536 HydrophobicContact CE1-CG 3.63Å; Y474-Q536 VanDerWaalsContact CE1-NE2 3.29Å; Y474-Q536 PolarHBondContact OH-NE2 3.02Å; Y474-Q536 VanDerWaalsContact OH-NE2 3.16Å; S479-Q536 CarbonylContact O-C 3.52Å; S479-Q536 VanDerWaalsContact O-CA 3.26Å; S479-Q536 WeakPolarHBondContact O-CA 3.3Å; Y480-Q536 HydrophobicContact CD1-CB 3.72Å; Y480-Q536 HydrophobicContact CE1-CB 3.7Å; Y480-Q536 HydrophobicContact CE1-CG 4.44Å; Y480-Q536 PolarHBondContact OH-OE1 2.82Å; Y480-Q536 VanDerWaalsContact OH-OE1 3.06Å; V519-Q536 WeakPolarHBondContact CA-O 3.04Å; S520-Q536 PolarHBondContact N-O 3.28Å; S520-Q536 PolarHBondContact O-N 2.92Å; S520-Q536 WeakPolarHBondContact OG-CG 3.43Å; S520-Q536 PolarHBondContact OG-NE2 3.27Å; R521-Q536 HydrophobicContact CB-CG 3.99Å; R521-Q536 VanDerWaalsContact CG-CD 3.47Å; R521-Q536 HydrophobicContact CG-CG 4.12Å
537	V	94.3	Very high	92.1	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.006	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	123.1	171.2	-175.3	0	0	0	0	108.5	S479 M481 R518 V519 F535 L557 L564	S479-V537 WeakPolarHBondContact CA-O 3.39Å; S479-V537 WeakPolarHBondContact CB-O 3.38Å; S479-V537 PolarHBondContact O-N 3.32Å; S479-V537 PolarHBondContact OG-O 2.92Å; M481-V537 HydrophobicContact CE-CB 3.72Å; M481-V537 HydrophobicContact CE-CG2 3.58Å; R518-V537 WeakPolarHBondContact O-CA 3.36Å; V519-V537 HydrophobicContact CG2-CG2 4.37Å; F535-V537 HydrophobicContact CD2-CG2 3.86Å; F535-V537 HydrophobicContact CE2-CG2 3.7Å; V537-L557 HydrophobicContact CB-CD1 4.07Å; V537-L557 HydrophobicContact CG1-CD1 4.02Å; V537-L557 VanDerWaalsContact O-CD1 3.31Å; V537-L557 WeakPolarHBondContact O-CD1 3.35Å; V537-L564 HydrophobicContact CG2-CD1 4.42Å
538	S	93.3	Very high	92.4	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	26%	0.258	C	S	.	.			trans	-75.5	157.7	176.8	50.3	0	0	0	0	112.8	K473 R518	K473-S538 CarbonylContact O-C 3.58Å; K473-S538 WeakPolarHBondContact O-CA 3.4Å; K473-S538 WeakPolarHBondContact O-CB 3.4Å; R518-S538 VanDerWaalsContact CA-OG 3.3Å; R518-S538 WeakPolarHBondContact CA-OG 3.36Å; R518-S538 WeakPolarHBondContact CB-OG 3.46Å; R518-S538 WeakPolarHBondContact CG-OG 3.47Å; R518-S538 PolarHBondContact NE-O 2.84Å; R518-S538 PolarHBondContact NE-OG 2.81Å; R518-S538 PolarHBondContact NH2-O 3.32Å; R518-S538 PolarHBondContact O-N 2.98Å; R518-S538 PolarHBondContact O-OG 2.9Å; R518-S538 VanDerWaalsContact O-OG 3.1Å
539	N	93.2	Very high	92.5	Very high	59 Å²	59	46.3 Å²	46.3	32%	0.316	24%	0.244	S	C	.	.			trans	-78	176.7	164.4	-156	-6.9	0	0	0	110.8	K473 R518 L557	K473-N539 PolarHBondContact O-N 2.83Å; R518-N539 PolarHBondContact NE-O 2.81Å; N539-L557 HydrophobicContact CB-CB 4.01Å; N539-L557 HydrophobicContact CB-CD2 4.49Å; N539-L557 PolarHBondContact OD1-N 3.27Å; N539-L557 VanDerWaalsContact OD1-N 3.16Å
540	T	92.1	Very high	92.6	Very high	36 Å²	36	43.9 Å²	43.9	22%	0.221	23%	0.227	C	C	.	.			trans	-60.9	156.2	178.3	70.8	0	0	0	0	112.5	G542 E554 K555 D556	T540-G542 PolarHBondContact O-N 3.43Å; T540-G542 PolarHBondContact OG1-N 3.32Å; T540-E554 HydrophobicContact CG2-CB 3.74Å; T540-K555 WeakPolarHBondContact CG2-O 3.2Å; T540-D556 HydrophobicContact CG2-CB 4.37Å
541	S	91	Very high	92.6	Very high	11 Å²	11	41.9 Å²	41.9	8%	0.077	22%	0.221	C	C	.	.			trans	-61.8	-32.5	165.1	65.3	0	0	0	0	112.1	K473 V543 E554	K473-S541 PolarHBondContact NZ-O 3.03Å; S541-V543 VanDerWaalsContact C-N 3.3Å; S541-V543 WeakPolarHBondContact OG-CB 3.14Å; S541-V543 PolarHBondContact OG-N 2.73Å; S541-E554 VanDerWaalsContact CB-OE2 3.27Å; S541-E554 WeakPolarHBondContact CB-OE2 3.46Å; S541-E554 PolarHBondContact N-OE2 3.2Å; S541-E554 PolarHBondContact OG-OE2 3.27Å
542	G	90.6	Very high	92.5	Very high	63 Å²	63	47.2 Å²	47.2	65%	0.649	25%	0.246	S	C	*	.	S	Bend	trans	81.2	7.9	-167	0	0	0	0	0	113.7	T540	T540-G542 PolarHBondContact O-N 3.43Å; T540-G542 PolarHBondContact OG1-N 3.32Å
543	V	93	Very high	92.4	Very high	43 Å²	43	48.9 Å²	48.9	26%	0.261	27%	0.267	S	S	.	.			trans	-103.1	134.2	-179.8	-178.9	0	0	0	0	109.3	L325 V339 S541 G545	L325-V543 HydrophobicContact CD2-CB 3.87Å; L325-V543 HydrophobicContact CD2-CG1 3.8Å; V339-V543 HydrophobicContact CG1-CG2 4.38Å; S541-V543 VanDerWaalsContact C-N 3.3Å; S541-V543 WeakPolarHBondContact OG-CB 3.14Å; S541-V543 PolarHBondContact OG-N 2.73Å; V543-G545 PolarHBondContact O-N 3.03Å
544	I	93.4	Very high	92.4	Very high	151 Å²	151	51 Å²	51	77%	0.774	28%	0.276	S	S	*	.			trans	-79.1	110.8	171.6	-57.1	176.7	0	0	0	107.6
545	G	93.7	Very high	92.3	Very high	11 Å²	11	52.2 Å²	52.2	11%	0.113	28%	0.282	C	S	.	.			trans	-68.4	161.3	178.6	0	0	0	0	0	113.8	G324 V543	G324-G545 CarbonylContact O-C 3.57Å; G324-G545 WeakPolarHBondContact O-CA 3.41Å; V543-G545 PolarHBondContact O-N 3.03Å
546	T	94.4	Very high	92.3	Very high	19 Å²	19	55.9 Å²	55.9	12%	0.117	30%	0.301	C	S	.	.			trans	-65.7	135.3	174.3	-75.5	0	0	0	0	110.5	G324 P341 I342 L344 L360 T548 F551	G324-T546 VanDerWaalsContact CA-O 3.31Å; G324-T546 WeakPolarHBondContact CA-O 3.4Å; G324-T546 PolarHBondContact O-N 2.89Å; P341-T546 WeakPolarHBondContact CB-OG1 3.38Å; I342-T546 PolarHBondContact N-OG1 3.03Å; I342-T546 WeakPolarHBondContact O-CB 3.44Å; I342-T546 PolarHBondContact O-OG1 2.81Å; L344-T546 HydrophobicContact CD2-CG2 3.76Å; L360-T546 HydrophobicContact CB-CG2 3.95Å; L360-T546 HydrophobicContact CD2-CG2 4.29Å; T546-T548 PolarHBondContact O-N 2.73Å; T546-F551 WeakPolarHBondContact O-CD2 3.26Å
547	R	93.4	Very high	92.4	Very high	127 Å²	127	55.6 Å²	55.6	48%	0.479	30%	0.3	S	S	.	.			trans	-64.9	109.5	174.7	-175	179.6	-177.8	172.7	-5	110.8	Q357 Y359 L360	Q357-R547 VanDerWaalsContact OE1-CZ 3.26Å; Y359-R547 CarbonylContact C-O 3.56Å; Y359-R547 VanDerWaalsContact CA-O 3.29Å; Y359-R547 WeakPolarHBondContact CA-O 3.5Å; Y359-R547 WeakPolarHBondContact CB-O 3.44Å; L360-R547 PolarHBondContact N-O 2.96Å
548	T	93.5	Very high	92.4	Very high	6 Å²	6	58.2 Å²	58.2	4%	0.037	32%	0.322	C	S	.	.	B	Isolated β-bridge	trans	-98.2	-178.5	171.2	62.7	0	0	0	0	111.2	F321 L360 T546 F551	F321-T548 HydrophobicContact CB-CG2 4.05Å; F321-T548 HydrophobicContact CD1-CG2 3.69Å; F321-T548 HydrophobicContact CE1-CG2 4.49Å; F321-T548 HydrophobicContact CG-CG2 4.12Å; F321-T548 VanDerWaalsContact O-CB 3.25Å; F321-T548 WeakPolarHBondContact O-CB 3.14Å; F321-T548 VanDerWaalsContact O-CG2 3.3Å; F321-T548 WeakPolarHBondContact O-CG2 3.41Å; F321-T548 PolarHBondContact O-OG1 2.92Å; L360-T548 VanDerWaalsContact O-CA 3.22Å; L360-T548 WeakPolarHBondContact O-CA 3.11Å; L360-T548 WeakPolarHBondContact O-CB 3.38Å; T546-T548 PolarHBondContact O-N 2.73Å; T548-F551 WeakPolarHBondContact OG1-CA 3.33Å; T548-F551 PolarHBondContact OG1-N 3.44Å
549	E	89.1	Confident	92.4	Very high	76 Å²	76	60 Å²	60	36%	0.355	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-37.9	176.5	-175.9	169.7	-161.6	0	0	113.9	K355 Y359	K355-E549 VanDerWaalsContact NZ-CG 3.33Å; K355-E549 IonicContact NZ-OE1 3.45Å; K355-E549 PolarHBondContact NZ-OE1 2.92Å; Y359-E549 HydrophobicContact CD2-CB 3.83Å; Y359-E549 HydrophobicContact CE2-CB 3.69Å; Y359-E549 HydrophobicContact CE2-CG 3.98Å
550	F	90.1	Very high	92.4	Very high	96 Å²	96	57.2 Å²	57.2	42%	0.421	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.9	22.5	-174.4	-61.8	-82.2	0	0	0	112.3	Q552	F550-Q552 PolarHBondContact O-N 3.17Å
551	F	91.8	Very high	92.5	Very high	72 Å²	72	58.3 Å²	58.3	32%	0.316	32%	0.322	S	S	.	.			trans	-52.2	123.2	-172.2	179	-98	0	0	0	113	S323 T546 T548 A553	S323-F551 WeakPolarHBondContact O-CE2 3.49Å; T546-F551 WeakPolarHBondContact O-CD2 3.26Å; T548-F551 WeakPolarHBondContact OG1-CA 3.33Å; T548-F551 PolarHBondContact OG1-N 3.44Å; F551-A553 HydrophobicContact CE1-CB 4.33Å
552	Q	90.6	Very high	92.6	Very high	112 Å²	112	63.9 Å²	63.9	52%	0.523	35%	0.345	S	S	.	.			trans	-121.6	119.7	172.5	-74.4	168.5	79.2	0	0	108.9	D322 F550 E554	D322-Q552 PolarHBondContact O-N 3.24Å; F550-Q552 PolarHBondContact O-N 3.17Å; Q552-E554 PolarHBondContact O-N 3.33Å
553	A	91.1	Very high	92.8	Very high	77 Å²	77	62 Å²	62	64%	0.636	32%	0.323	S	S	*	.	P	Polyproline II helix	trans	-60.4	138.5	175	0	0	0	0	0	110.6	F551 K555	F551-A553 HydrophobicContact CE1-CB 4.33Å; A553-K555 PolarHBondContact O-N 2.97Å
554	E	92.7	Very high	92.8	Very high	43 Å²	43	60 Å²	60	20%	0.201	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-59.3	120.1	-179.1	-71.7	-150.6	78.7	0	0	112.2	L325 R518 T540 S541 Q552	L325-E554 HydrophobicContact CD1-CG 4.23Å; R518-E554 WeakPolarHBondContact CD-OE1 3.46Å; R518-E554 IonicContact CZ-OE1 3.8Å; R518-E554 IonicContact NE-OE1 2.73Å; R518-E554 IonicContact NH1-OE1 3.73Å; R518-E554 PolarHBondContact NH1-OE1 2.96Å; T540-E554 HydrophobicContact CG2-CB 3.74Å; S541-E554 VanDerWaalsContact CB-OE2 3.27Å; S541-E554 WeakPolarHBondContact CB-OE2 3.46Å; S541-E554 PolarHBondContact N-OE2 3.2Å; S541-E554 PolarHBondContact OG-OE2 3.27Å; Q552-E554 PolarHBondContact O-N 3.33Å
555	K	92.5	Very high	92.8	Very high	81 Å²	81	56 Å²	56	35%	0.352	29%	0.291	S	S	.	.	P	Polyproline II helix	trans	-70	139.9	165.8	-59.1	-173.7	-167.2	174.8	0	110.5	A512 G513 V514 R518 T540 A553 A559	A512-K555 WeakPolarHBondContact O-CD 3.1Å; A512-K555 PolarHBondContact O-NZ 3.1Å; G513-K555 VanDerWaalsContact O-CD 3.26Å; G513-K555 WeakPolarHBondContact O-CD 3.12Å; G513-K555 WeakPolarHBondContact O-CE 3.16Å; V514-K555 HydrophobicContact CG1-CB 4.3Å; R518-K555 PolarHBondContact NH1-O 3.06Å; R518-K555 PolarHBondContact NH2-O 3.36Å; T540-K555 WeakPolarHBondContact CG2-O 3.2Å; A553-K555 PolarHBondContact O-N 2.97Å; K555-A559 HydrophobicContact CB-CB 4.29Å
556	D	93.2	Very high	92.8	Very high	79 Å²	79	58.8 Å²	58.8	42%	0.422	30%	0.301	S	S	.	.	P	Polyproline II helix	trans	-65.7	166	168	65.8	63	0	0	0	112.4	T540 A558 A559 A560	T540-D556 HydrophobicContact CG2-CB 4.37Å; D556-A558 VanDerWaalsContact C-N 3.29Å; D556-A558 PolarHBondContact O-N 3.4Å; D556-A558 WeakPolarHBondContact OD1-CA 3.42Å; D556-A558 WeakPolarHBondContact OD1-CB 3.37Å; D556-A558 PolarHBondContact OD1-N 3.26Å; D556-A559 PolarHBondContact O-N 2.96Å; D556-A559 WeakPolarHBondContact OD1-CB 3.5Å; D556-A559 PolarHBondContact OD1-N 2.71Å; D556-A560 WeakPolarHBondContact O-CB 3.13Å; D556-A560 PolarHBondContact O-N 2.84Å
557	L	93.6	Very high	92.8	Very high	4 Å²	4	59.6 Å²	59.6	2%	0.021	31%	0.306	C	S	.	.	H	α-helix	trans	-60.9	-36.9	-178	-177.7	56.7	0	0	0	112.6	D475 E478 S479 V537 N539 A560 R561	D475-L557 HydrophobicContact CB-CD2 4.01Å; E478-L557 HydrophobicContact CB-CD2 3.82Å; E478-L557 HydrophobicContact CB-CG 4.48Å; S479-L557 WeakPolarHBondContact OG-CD2 3.36Å; V537-L557 HydrophobicContact CB-CD1 4.07Å; V537-L557 HydrophobicContact CG1-CD1 4.02Å; V537-L557 VanDerWaalsContact O-CD1 3.31Å; V537-L557 WeakPolarHBondContact O-CD1 3.35Å; N539-L557 HydrophobicContact CB-CB 4.01Å; N539-L557 HydrophobicContact CB-CD2 4.49Å; N539-L557 PolarHBondContact OD1-N 3.27Å; N539-L557 VanDerWaalsContact OD1-N 3.16Å; L557-A560 PolarHBondContact O-N 2.9Å; L557-R561 WeakPolarHBondContact O-CB 3.45Å; L557-R561 PolarHBondContact O-N 3.23Å
558	A	93.2	Very high	92.8	Very high	57 Å²	57	53.8 Å²	53.8	47%	0.471	28%	0.284	S	S	.	.	H	α-helix	trans	-69.7	-42.1	-179.3	0	0	0	0	0	111.4	D556 K562	D556-A558 VanDerWaalsContact C-N 3.29Å; D556-A558 PolarHBondContact O-N 3.4Å; D556-A558 WeakPolarHBondContact OD1-CA 3.42Å; D556-A558 WeakPolarHBondContact OD1-CB 3.37Å; D556-A558 PolarHBondContact OD1-N 3.26Å; A558-K562 WeakPolarHBondContact O-CB 3.5Å; A558-K562 PolarHBondContact O-N 2.84Å
559	A	94.1	Very high	92.7	Very high	38 Å²	38	58.3 Å²	58.3	31%	0.314	31%	0.305	S	S	.	.	H	α-helix	trans	-66.3	-39	174.2	0	0	0	0	0	112.3	K555 D556 A563	K555-A559 HydrophobicContact CB-CB 4.29Å; D556-A559 PolarHBondContact O-N 2.96Å; D556-A559 WeakPolarHBondContact OD1-CB 3.5Å; D556-A559 PolarHBondContact OD1-N 2.71Å; A559-A563 WeakPolarHBondContact O-CB 3.44Å; A559-A563 PolarHBondContact O-N 2.85Å
560	A	94.1	Very high	92.8	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-65.7	-47.8	174.8	0	0	0	0	0	112.2	A512 V514 D556 L557 A563 L564	A512-A560 HydrophobicContact CB-CB 4.3Å; V514-A560 HydrophobicContact CG1-CB 3.65Å; D556-A560 WeakPolarHBondContact O-CB 3.13Å; D556-A560 PolarHBondContact O-N 2.84Å; L557-A560 PolarHBondContact O-N 2.9Å; A560-A563 PolarHBondContact O-N 3.28Å; A560-L564 WeakPolarHBondContact O-CG 3.41Å; A560-L564 PolarHBondContact O-N 3.31Å
561	R	92.6	Very high	93	Very high	58 Å²	58	64.5 Å²	64.5	22%	0.219	33%	0.328	C	S	.	.	H	α-helix	trans	-64.3	-38.1	175.7	-178.9	163.9	161	-120.5	3	111.6	E478 M481 L557 L564 N565 D596	E478-R561 IonicContact OE1-CZ 3.91Å; E478-R561 IonicContact OE1-NH1 2.74Å; E478-R561 PolarHBondContact OE1-NH1 3Å; E478-R561 IonicContact OE2-NH1 3.61Å; M481-R561 HydrophobicContact SD-CB 4.49Å; M481-R561 HydrophobicContact SD-CG 4.04Å; L557-R561 WeakPolarHBondContact O-CB 3.45Å; L557-R561 PolarHBondContact O-N 3.23Å; R561-L564 PolarHBondContact O-N 2.86Å; R561-N565 VanDerWaalsContact O-CB 3.26Å; R561-N565 WeakPolarHBondContact O-CB 3.48Å; R561-N565 PolarHBondContact O-N 2.92Å; R561-D596 IonicContact CZ-OD1 3.87Å; R561-D596 VanDerWaalsContact CZ-OD1 3.27Å; R561-D596 IonicContact CZ-OD2 3.27Å; R561-D596 IonicContact NE-OD1 3.79Å; R561-D596 PolarHBondContact NE-OD1 3.13Å; R561-D596 IonicContact NH2-OD1 3.84Å; R561-D596 PolarHBondContact NH2-OD1 3.17Å; R561-D596 IonicContact NH2-OD2 2.93Å; R561-D596 PolarHBondContact NH2-OD2 2.96Å
562	K	93.9	Very high	93	Very high	129 Å²	129	64.7 Å²	64.7	56%	0.561	33%	0.332	S	S	*	.	H	α-helix	trans	-62.5	-45	172	-179.8	174.4	173.7	177.4	0	112.2	A558 N565 E566	A558-K562 WeakPolarHBondContact O-CB 3.5Å; A558-K562 PolarHBondContact O-N 2.84Å; K562-N565 PolarHBondContact O-N 3.38Å; K562-E566 WeakPolarHBondContact CE-OE1 3.42Å; K562-E566 HydrophobicContact CG-CG 4.39Å; K562-E566 IonicContact NZ-OE1 2.78Å; K562-E566 WeakPolarHBondContact O-CB 3.43Å; K562-E566 WeakPolarHBondContact O-CG 3.39Å; K562-E566 PolarHBondContact O-N 3.07Å
563	A	94.2	Very high	93.1	Very high	22 Å²	22	60.2 Å²	60.2	18%	0.182	31%	0.312	C	S	.	.	H	α-helix	trans	-63.1	-44.7	177.1	0	0	0	0	0	112.1	A559 A560 N565 E566 T567	A559-A563 WeakPolarHBondContact O-CB 3.44Å; A559-A563 PolarHBondContact O-N 2.85Å; A560-A563 PolarHBondContact O-N 3.28Å; A563-N565 PolarHBondContact O-N 3.15Å; A563-E566 PolarHBondContact O-N 2.92Å; A563-T567 PolarHBondContact O-N 3.32Å; A563-T567 PolarHBondContact O-OG1 2.98Å; A563-T567 VanDerWaalsContact O-OG1 3.13Å
564	L	93.8	Very high	93.3	Very high	3 Å²	3	61.4 Å²	61.4	2%	0.016	31%	0.311	C	S	.	.	H	α-helix	trans	-56.5	-48.7	172.3	-75.2	165.2	0	0	0	111.9	M481 I508 V511 A512 V537 A560 R561 T567 L568 L594	M481-L564 HydrophobicContact SD-CD1 4.26Å; I508-L564 HydrophobicContact CG2-CD1 4.48Å; I508-L564 HydrophobicContact CG2-CD2 3.99Å; V511-L564 HydrophobicContact CB-CD2 4.18Å; V511-L564 HydrophobicContact CG1-CD2 3.97Å; A512-L564 HydrophobicContact CB-CD1 4.05Å; A512-L564 HydrophobicContact CB-CD2 4.18Å; A512-L564 HydrophobicContact CB-CG 3.83Å; V537-L564 HydrophobicContact CG2-CD1 4.42Å; A560-L564 WeakPolarHBondContact O-CG 3.41Å; A560-L564 PolarHBondContact O-N 3.31Å; R561-L564 PolarHBondContact O-N 2.86Å; L564-T567 PolarHBondContact O-N 3.09Å; L564-L568 WeakPolarHBondContact O-CB 3.39Å; L564-L568 WeakPolarHBondContact O-CG 3.41Å; L564-L568 PolarHBondContact O-N 2.85Å; L564-L594 HydrophobicContact CB-CD2 3.96Å
565	N	93.6	Very high	93.3	Very high	66 Å²	66	59.4 Å²	59.4	35%	0.353	30%	0.302	S	S	.	.	H	α-helix	trans	-66.2	-46.2	-178.2	-163	13.3	0	0	0	111.7	R561 K562 A563 T567 L568 Q569 L594	R561-N565 VanDerWaalsContact O-CB 3.26Å; R561-N565 WeakPolarHBondContact O-CB 3.48Å; R561-N565 PolarHBondContact O-N 2.92Å; K562-N565 PolarHBondContact O-N 3.38Å; A563-N565 PolarHBondContact O-N 3.15Å; N565-T567 PolarHBondContact O-N 3.08Å; N565-L568 PolarHBondContact O-N 2.87Å; N565-Q569 VanDerWaalsContact CG-NE2 3.27Å; N565-Q569 PolarHBondContact ND2-NE2 3.07Å; N565-Q569 VanDerWaalsContact O-CB 3.24Å; N565-Q569 WeakPolarHBondContact O-CB 3.48Å; N565-Q569 WeakPolarHBondContact O-CG 3.45Å; N565-Q569 PolarHBondContact O-N 3.32Å; N565-Q569 PolarHBondContact OD1-NE2 3.17Å; N565-L594 HydrophobicContact CB-CD2 3.87Å
566	E	94	Very high	93.2	Very high	70 Å²	70	64 Å²	64	33%	0.327	32%	0.318	S	S	.	.	H	α-helix	trans	-63.5	-36	177.5	-78.6	-168.9	-151.8	0	0	113.2	K562 A563 R570	K562-E566 WeakPolarHBondContact CE-OE1 3.42Å; K562-E566 HydrophobicContact CG-CG 4.39Å; K562-E566 IonicContact NZ-OE1 2.78Å; K562-E566 WeakPolarHBondContact O-CB 3.43Å; K562-E566 WeakPolarHBondContact O-CG 3.39Å; K562-E566 PolarHBondContact O-N 3.07Å; A563-E566 PolarHBondContact O-N 2.92Å; E566-R570 WeakPolarHBondContact O-CD 3.35Å; E566-R570 VanDerWaalsContact O-CG 3.24Å; E566-R570 WeakPolarHBondContact O-CG 3.39Å; E566-R570 IonicContact OE2-CZ 2.71Å; E566-R570 IonicContact OE2-NH1 2.87Å; E566-R570 IonicContact OE2-NH2 3.95Å; E566-R570 PolarHBondContact OE2-NH2 3.1Å
567	T	93.3	Very high	93	Very high	35 Å²	35	60.3 Å²	60.3	22%	0.215	30%	0.297	C	S	.	.	H	α-helix	trans	-71.4	-50.4	174.5	-58	0	0	0	0	111.3	V511 A563 L564 N565 Q569 R570 Q571 V573	V511-T567 HydrophobicContact CG1-CG2 3.71Å; A563-T567 PolarHBondContact O-N 3.32Å; A563-T567 PolarHBondContact O-OG1 2.98Å; A563-T567 VanDerWaalsContact O-OG1 3.13Å; L564-T567 PolarHBondContact O-N 3.09Å; N565-T567 PolarHBondContact O-N 3.08Å; T567-Q569 VanDerWaalsContact C-N 3.25Å; T567-Q569 PolarHBondContact O-N 2.72Å; T567-R570 PolarHBondContact O-N 3.33Å; T567-Q571 HydrophobicContact CG2-CG 4.22Å; T567-Q571 PolarHBondContact O-N 3Å; T567-V573 HydrophobicContact CG2-CG2 3.92Å
568	L	93	Very high	92.5	Very high	6 Å²	6	62.8 Å²	62.8	3%	0.031	31%	0.314	C	S	.	.	H	α-helix	trans	-72.5	-15.2	-177	-66.4	172.5	0	0	0	113.3	I483 L564 N565 V573 I589 C591 H592 L594	I483-L568 HydrophobicContact CG2-CD1 3.97Å; L564-L568 WeakPolarHBondContact O-CB 3.39Å; L564-L568 WeakPolarHBondContact O-CG 3.41Å; L564-L568 PolarHBondContact O-N 2.85Å; N565-L568 PolarHBondContact O-N 2.87Å; L568-V573 HydrophobicContact CD2-CB 4.36Å; L568-V573 HydrophobicContact CD2-CG2 3.82Å; L568-I589 HydrophobicContact CD1-CG2 4.27Å; L568-I589 HydrophobicContact CD2-CB 4.42Å; L568-I589 HydrophobicContact CD2-CG2 3.73Å; L568-C591 CarbonylContact O-C 3.45Å; L568-C591 WeakPolarHBondContact O-CA 3.21Å; L568-C591 WeakPolarHBondContact O-CB 3.32Å; L568-H592 PolarHBondContact O-N 2.63Å; L568-L594 HydrophobicContact CD1-CB 3.95Å; L568-L594 HydrophobicContact CD1-CD1 4.32Å; L568-L594 HydrophobicContact CD1-CD2 4.47Å; L568-L594 HydrophobicContact CD1-CG 4.48Å
569	Q	92.1	Very high	91.7	Very high	101 Å²	101	63.1 Å²	63.1	47%	0.472	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-18	166.3	-77.2	178.3	18.2	0	0	113.9	N565 T567 H592	N565-Q569 VanDerWaalsContact CG-NE2 3.27Å; N565-Q569 PolarHBondContact ND2-NE2 3.07Å; N565-Q569 VanDerWaalsContact O-CB 3.24Å; N565-Q569 WeakPolarHBondContact O-CB 3.48Å; N565-Q569 WeakPolarHBondContact O-CG 3.45Å; N565-Q569 PolarHBondContact O-N 3.32Å; N565-Q569 PolarHBondContact OD1-NE2 3.17Å; T567-Q569 VanDerWaalsContact C-N 3.25Å; T567-Q569 PolarHBondContact O-N 2.72Å; Q569-H592 PolarHBondContact O-CE1 3.32Å
570	R	92.4	Very high	90.3	Very high	183 Å²	183	71 Å²	71	69%	0.691	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.3	-35.4	-175.7	-69.3	174.6	-167.1	155.5	15.6	113.1	E566 T567	E566-R570 WeakPolarHBondContact O-CD 3.35Å; E566-R570 VanDerWaalsContact O-CG 3.24Å; E566-R570 WeakPolarHBondContact O-CG 3.39Å; E566-R570 IonicContact OE2-CZ 2.71Å; E566-R570 IonicContact OE2-NH1 2.87Å; E566-R570 IonicContact OE2-NH2 3.95Å; E566-R570 PolarHBondContact OE2-NH2 3.1Å; T567-R570 PolarHBondContact O-N 3.33Å
571	Q	92.5	Very high	88.8	Confident	119 Å²	119	79.7 Å²	79.7	56%	0.556	37%	0.37	S	S	*	.			trans	-155.7	156.4	-173.5	64.1	-174.6	27.5	0	0	113	T567	T567-Q571 HydrophobicContact CG2-CG 4.22Å; T567-Q571 PolarHBondContact O-N 3Å
572	D	92.7	Very high	87.7	Confident	76 Å²	76	83 Å²	83	41%	0.406	39%	0.388	S	S	.	.			trans	-62.9	146.7	161.6	-80.1	-5	0	0	0	110.6	V588 M590 C591	D572-V588 HydrophobicContact CB-CG1 3.58Å; D572-V588 WeakPolarHBondContact OD2-CG1 3.18Å; D572-M590 WeakPolarHBondContact OD1-CA 3.49Å; D572-C591 WeakPolarHBondContact OD1-CB 3.19Å; D572-C591 PolarHBondContact OD1-N 3.21Å; D572-C591 PolarHBondContact OD1-SG 3.19Å
573	V	93.5	Very high	87	Confident	17 Å²	17	85 Å²	85	10%	0.103	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	114.6	173.2	175.2	0	0	0	0	109.7	V511 T567 L568 V575 I589	V511-V573 HydrophobicContact CG2-CG1 4.04Å; V511-V573 HydrophobicContact CG2-CG2 4.08Å; T567-V573 HydrophobicContact CG2-CG2 3.92Å; L568-V573 HydrophobicContact CD2-CB 4.36Å; L568-V573 HydrophobicContact CD2-CG2 3.82Å; V573-V575 HydrophobicContact CG1-CG2 4.45Å; V573-I589 HydrophobicContact CB-CB 4.23Å; V573-I589 HydrophobicContact CG1-CD1 4.42Å; V573-I589 PolarHBondContact N-O 2.79Å; V573-I589 PolarHBondContact O-N 3.3Å
574	T	93.7	Very high	86.6	Confident	102 Å²	102	86.1 Å²	86.1	63%	0.626	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.7	134.8	178.6	51.3	0	0	0	0	111.3	V588	T574-V588 HydrophobicContact CG2-CG2 4.31Å
575	V	93	Very high	86.3	Confident	2 Å²	2	86.2 Å²	86.2	1%	0.012	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	104	-177.5	-176.8	0	0	0	0	108.1	F503 L504 V573 V577 L587 I589	F503-V575 HydrophobicContact CB-CG1 3.73Å; L504-V575 HydrophobicContact CD2-CG1 4.35Å; L504-V575 HydrophobicContact CD2-CG2 4.35Å; V573-V575 HydrophobicContact CG1-CG2 4.45Å; V575-V577 HydrophobicContact CG1-CG2 4.29Å; V575-V577 PolarHBondContact O-N 2.94Å; V575-L587 HydrophobicContact CB-CB 4.18Å; V575-L587 PolarHBondContact N-O 3.09Å; V575-L587 PolarHBondContact O-N 3.49Å; V575-I589 HydrophobicContact CG2-CD1 3.86Å; V575-I589 HydrophobicContact CG2-CG1 4.05Å
576	R	91.6	Very high	86.2	Confident	178 Å²	178	88.2 Å²	88.2	67%	0.672	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.1	106.7	-178.2	-177.1	176.4	176.4	171.8	-0.3	109.7	P578 D584	R576-P578 WeakPolarHBondContact O-CD 3.42Å; R576-D584 HydrophobicContact CG-CB 3.97Å; R576-D584 IonicContact CZ-OD2 3.39Å; R576-D584 IonicContact NE-OD2 3.97Å; R576-D584 PolarHBondContact NE-OD2 3.47Å; R576-D584 IonicContact NH2-OD2 2.87Å; R576-D584 PolarHBondContact NH2-OD2 2.69Å
577	V	89.1	Confident	86.1	Confident	0 Å²	0	84.9 Å²	84.9	0%	0	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	104.1	179.6	-174.8	0	0	0	0	109.3	T495 V499 V500 F503 V575 D584 L585 L587	T495-V577 HydrophobicContact CG2-CG1 3.98Å; V499-V577 HydrophobicContact CB-CG1 4.45Å; V499-V577 HydrophobicContact CG1-CG1 3.81Å; V500-V577 HydrophobicContact CG2-CG1 4.44Å; F503-V577 HydrophobicContact CB-CG2 4.07Å; F503-V577 HydrophobicContact CD2-CB 4.44Å; F503-V577 HydrophobicContact CD2-CG1 4.02Å; F503-V577 HydrophobicContact CD2-CG2 4.47Å; F503-V577 HydrophobicContact CG-CG2 4.47Å; V575-V577 HydrophobicContact CG1-CG2 4.29Å; V575-V577 PolarHBondContact O-N 2.94Å; V577-D584 CarbonylContact O-C 3.28Å; V577-D584 WeakPolarHBondContact O-CA 3.42Å; V577-L585 HydrophobicContact CB-CB 4.2Å; V577-L585 WeakPolarHBondContact CB-O 3.19Å; V577-L585 PolarHBondContact N-O 2.83Å; V577-L585 PolarHBondContact O-N 3.04Å; V577-L587 HydrophobicContact CG2-CD1 3.78Å; V577-L587 HydrophobicContact CG2-CG 4.05Å
578	P	83	Confident	86.2	Confident	56 Å²	56	84.1 Å²	84.1	36%	0.364	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	141	-177.9	26.6	-35.5	0	0	0	112.7	F503 R576 D584	F503-P578 HydrophobicContact CE1-CG 4.3Å; F503-P578 VanDerWaalsContact CE2-CD 3.41Å; F503-P578 HydrophobicContact CE2-CG 3.77Å; F503-P578 HydrophobicContact CZ-CG 3.51Å; R576-P578 WeakPolarHBondContact O-CD 3.42Å; P578-D584 VanDerWaalsContact CA-OD1 3.24Å; P578-D584 WeakPolarHBondContact CA-OD1 3.46Å
579	R	74.9	Confident	86.3	Confident	65 Å²	65	84 Å²	84	25%	0.245	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	133.1	178.5	-68.3	-169.5	-68.6	-177.7	3.3	111	T495 L581 Q582 E583 D584	T495-R579 HydrophobicContact CG2-CG 3.91Å; R579-L581 PolarHBondContact O-N 2.74Å; R579-Q582 HydrophobicContact CB-CB 4.11Å; R579-Q582 VanDerWaalsContact O-O 3.13Å; R579-E583 PolarHBondContact NE-O 2.03Å; R579-E583 PolarHBondContact NH2-O 2.93Å; R579-D584 PolarHBondContact N-OD1 2.64Å
580	R	64.9	Low	86.2	Confident	202 Å²	202	81.1 Å²	81.1	76%	0.762	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	123.7	176.2	-68.1	-174.7	177.1	-168.6	-2.2	109	Q582	R580-Q582 VanDerWaalsContact C-N 3.25Å; R580-Q582 PolarHBondContact O-N 2.76Å
581	L	62.1	Low	86.2	Confident	184 Å²	184	74.8 Å²	74.8	96%	0.963	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.8	18.4	177.4	-50.5	172.8	0	0	0	115.8	R579	R579-L581 PolarHBondContact O-N 2.74Å
582	Q	70.5	Confident	86.1	Confident	128 Å²	128	75.4 Å²	75.4	60%	0.598	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141.9	163.2	175.1	-68.5	-171.2	-2.3	0	0	111	R579 R580	R579-Q582 HydrophobicContact CB-CB 4.11Å; R579-Q582 VanDerWaalsContact O-O 3.13Å; R580-Q582 VanDerWaalsContact C-N 3.25Å; R580-Q582 PolarHBondContact O-N 2.76Å
583	E	79.6	Confident	86	Confident	169 Å²	169	72.2 Å²	72.2	79%	0.79	35%	0.348	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-57.3	139.7	170.1	-64.4	-176.6	163.9	0	0	111.4	R579	R579-E583 PolarHBondContact NE-O 2.03Å; R579-E583 PolarHBondContact NH2-O 2.93Å
584	D	85.2	Confident	85.9	Confident	46 Å²	46	72.5 Å²	72.5	25%	0.246	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	137.6	-178.2	-57.6	-27.9	0	0	0	111.5	R576 V577 P578 R579 I586	R576-D584 HydrophobicContact CG-CB 3.97Å; R576-D584 IonicContact CZ-OD2 3.39Å; R576-D584 IonicContact NE-OD2 3.97Å; R576-D584 PolarHBondContact NE-OD2 3.47Å; R576-D584 IonicContact NH2-OD2 2.87Å; R576-D584 PolarHBondContact NH2-OD2 2.69Å; V577-D584 CarbonylContact O-C 3.28Å; V577-D584 WeakPolarHBondContact O-CA 3.42Å; P578-D584 VanDerWaalsContact CA-OD1 3.24Å; P578-D584 WeakPolarHBondContact CA-OD1 3.46Å; R579-D584 PolarHBondContact N-OD1 2.64Å; D584-I586 PolarHBondContact O-N 2.98Å; D584-I586 VanDerWaalsContact O-N 3.1Å
585	L	87.9	Confident	85.6	Confident	5 Å²	5	73.2 Å²	73.2	3%	0.026	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	103.9	174.4	176.8	63	0	0	0	109.1	K491 L492 T495 V577 L587	K491-L585 HydrophobicContact CD-CD1 4.12Å; K491-L585 HydrophobicContact CG-CD1 4.46Å; L492-L585 HydrophobicContact CD2-CD2 4.4Å; T495-L585 HydrophobicContact CG2-CB 4.38Å; T495-L585 HydrophobicContact CG2-CD2 3.94Å; T495-L585 WeakPolarHBondContact OG1-CD2 3.43Å; V577-L585 HydrophobicContact CB-CB 4.2Å; V577-L585 WeakPolarHBondContact CB-O 3.19Å; V577-L585 PolarHBondContact N-O 2.83Å; V577-L585 PolarHBondContact O-N 3.04Å; L585-L587 HydrophobicContact CD1-CD2 4.3Å; L585-L587 HydrophobicContact CD2-CD2 3.75Å; L585-L587 HydrophobicContact CD2-CG 4.13Å; L585-L587 HydrophobicContact CG-CD2 3.85Å; L585-L587 HydrophobicContact CG-CG 4.06Å; L585-L587 PolarHBondContact O-N 2.94Å; L585-L587 VanDerWaalsContact O-N 3.15Å
586	I	91.6	Very high	84.9	Confident	108 Å²	108	77.1 Å²	77.1	55%	0.554	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.5	101.7	168.2	-56.3	175	0	0	0	108	D584 V588	D584-I586 PolarHBondContact O-N 2.98Å; D584-I586 VanDerWaalsContact O-N 3.1Å; I586-V588 HydrophobicContact CG2-CG2 4.35Å
587	L	92.4	Very high	83.8	Confident	0 Å²	0	69.1 Å²	69.1	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	148.3	164	-64.6	-178.7	0	0	0	109.4	N486 A487 L492 V500 L504 V575 V577 L585	N486-L587 WeakPolarHBondContact OD1-CA 3.48Å; A487-L587 HydrophobicContact CB-CD2 3.6Å; L492-L587 HydrophobicContact CD2-CD1 3.96Å; L492-L587 HydrophobicContact CD2-CD2 3.64Å; L492-L587 HydrophobicContact CD2-CG 4.45Å; V500-L587 HydrophobicContact CG1-CD1 3.88Å; V500-L587 HydrophobicContact CG2-CD1 4.47Å; L504-L587 HydrophobicContact CD2-CD1 4.43Å; V575-L587 HydrophobicContact CB-CB 4.18Å; V575-L587 PolarHBondContact N-O 3.09Å; V575-L587 PolarHBondContact O-N 3.49Å; V577-L587 HydrophobicContact CG2-CD1 3.78Å; V577-L587 HydrophobicContact CG2-CG 4.05Å; L585-L587 HydrophobicContact CD1-CD2 4.3Å; L585-L587 HydrophobicContact CD2-CD2 3.75Å; L585-L587 HydrophobicContact CD2-CG 4.13Å; L585-L587 HydrophobicContact CG-CD2 3.85Å; L585-L587 HydrophobicContact CG-CG 4.06Å; L585-L587 PolarHBondContact O-N 2.94Å; L585-L587 VanDerWaalsContact O-N 3.15Å
588	V	94.3	Very high	82.3	Confident	19 Å²	19	72.1 Å²	72.1	12%	0.115	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	115.8	174.3	-176	0	0	0	0	107.6	V485 N486 D572 T574 I586 M590	V485-V588 WeakPolarHBondContact CA-O 3.41Å; N486-V588 HydrophobicContact CB-CB 4.22Å; N486-V588 PolarHBondContact N-O 3.16Å; N486-V588 WeakPolarHBondContact ND2-CG2 3.45Å; N486-V588 PolarHBondContact OD1-N 2.85Å; D572-V588 HydrophobicContact CB-CG1 3.58Å; D572-V588 WeakPolarHBondContact OD2-CG1 3.18Å; T574-V588 HydrophobicContact CG2-CG2 4.31Å; I586-V588 HydrophobicContact CG2-CG2 4.35Å; V588-M590 PolarHBondContact O-N 3.38Å
589	I	94.7	Very high	80.8	Confident	4 Å²	4	74.4 Å²	74.4	2%	0.021	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	115.7	166.4	-55.7	172.3	0	0	0	106.1	I483 V485 L504 I508 L568 V573 V575	I483-I589 HydrophobicContact CB-CG2 3.91Å; I483-I589 HydrophobicContact CD1-CD1 3.95Å; I483-I589 HydrophobicContact CD1-CG1 4.07Å; I483-I589 HydrophobicContact CD1-CG2 3.77Å; I483-I589 HydrophobicContact CG1-CG2 4.31Å; I483-I589 HydrophobicContact CG2-CG2 4.02Å; V485-I589 HydrophobicContact CG1-CG1 4.17Å; L504-I589 HydrophobicContact CD2-CD1 4.13Å; L504-I589 HydrophobicContact CD2-CG1 4.13Å; I508-I589 HydrophobicContact CG1-CD1 4.11Å; L568-I589 HydrophobicContact CD1-CG2 4.27Å; L568-I589 HydrophobicContact CD2-CB 4.42Å; L568-I589 HydrophobicContact CD2-CG2 3.73Å; V573-I589 HydrophobicContact CB-CB 4.23Å; V573-I589 HydrophobicContact CG1-CD1 4.42Å; V573-I589 PolarHBondContact N-O 2.79Å; V573-I589 PolarHBondContact O-N 3.3Å; V575-I589 HydrophobicContact CG2-CD1 3.86Å; V575-I589 HydrophobicContact CG2-CG1 4.05Å
590	M	91	Very high	79.4	Confident	41 Å²	41	75.2 Å²	75.2	20%	0.202	37%	0.374	C	S	.	.			trans	-75.5	145	-168.4	-62.1	-169.4	67	0	0	112.4	H484 D572 V588 S593	H484-M590 PolarHBondContact O-N 2.04Å; D572-M590 WeakPolarHBondContact OD1-CA 3.49Å; V588-M590 PolarHBondContact O-N 3.38Å; M590-S593 WeakPolarHBondContact O-CB 3.47Å; M590-S593 PolarHBondContact O-N 2.75Å; M590-S593 PolarHBondContact O-OG 2.87Å
591	C	92.2	Very high	78.6	Confident	49 Å²	49	69.8 Å²	69.8	33%	0.331	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	149.7	169.7	65.9	0	0	0	0	111.5	L568 D572 S593	L568-C591 CarbonylContact O-C 3.45Å; L568-C591 WeakPolarHBondContact O-CA 3.21Å; L568-C591 WeakPolarHBondContact O-CB 3.32Å; D572-C591 WeakPolarHBondContact OD1-CB 3.19Å; D572-C591 PolarHBondContact OD1-N 3.21Å; D572-C591 PolarHBondContact OD1-SG 3.19Å; C591-S593 PolarHBondContact O-N 2.92Å
592	H	90.3	Very high	77.6	Confident	133 Å²	133	69.4 Å²	69.4	62%	0.616	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.1	13.8	-174.2	-48.4	-72.1	0	0	0	115.5	L568 Q569	L568-H592 PolarHBondContact O-N 2.63Å; Q569-H592 PolarHBondContact O-CE1 3.32Å
593	S	90.5	Very high	75.7	Confident	9 Å²	9	66 Å²	66	6%	0.063	36%	0.358	C	S	.	.			trans	-89.2	-10.3	-176	78.6	0	0	0	0	115	H484 M590 C591 K595	H484-S593 PolarHBondContact N-OG 2.66Å; H484-S593 PolarHBondContact ND1-O 3.41Å; M590-S593 WeakPolarHBondContact O-CB 3.47Å; M590-S593 PolarHBondContact O-N 2.75Å; M590-S593 PolarHBondContact O-OG 2.87Å; C591-S593 PolarHBondContact O-N 2.92Å; S593-K595 PolarHBondContact O-N 3.21Å
594	L	90.9	Very high	73.3	Confident	23 Å²	23	62.2 Å²	62.2	12%	0.12	36%	0.364	C	S	.	.			trans	-69.6	123.2	177.5	-173.2	70.8	0	0	0	110.6	M481 T482 I483 F535 L564 N565 L568	M481-L594 HydrophobicContact CB-CD1 4.23Å; M481-L594 HydrophobicContact CG-CD1 4.35Å; M481-L594 HydrophobicContact SD-CD1 4.12Å; T482-L594 VanDerWaalsContact O-CA 3.3Å; T482-L594 WeakPolarHBondContact O-CA 3.35Å; I483-L594 HydrophobicContact CG2-CB 4.4Å; I483-L594 HydrophobicContact CG2-CD1 3.73Å; F535-L594 HydrophobicContact CZ-CD1 4.13Å; L564-L594 HydrophobicContact CB-CD2 3.96Å; N565-L594 HydrophobicContact CB-CD2 3.87Å; L568-L594 HydrophobicContact CD1-CB 3.95Å; L568-L594 HydrophobicContact CD1-CD1 4.32Å; L568-L594 HydrophobicContact CD1-CD2 4.47Å; L568-L594 HydrophobicContact CD1-CG 4.48Å
595	K	87.6	Confident	71	Confident	117 Å²	117	68.1 Å²	68.1	51%	0.509	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	150	173.6	-56.1	174.4	-175.1	170.7	0	110.1	M481 T482 S593	M481-K595 CarbonylContact C-O 3.58Å; M481-K595 WeakPolarHBondContact CA-O 3.43Å; T482-K595 PolarHBondContact N-O 3.49Å; T482-K595 PolarHBondContact O-N 3.48Å; T482-K595 PolarHBondContact OG1-O 3.1Å; S593-K595 PolarHBondContact O-N 3.21Å
596	D	79.9	Confident	68.7	Low	83 Å²	83	76.3 Å²	76.3	44%	0.444	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	136.2	174.3	-52.9	-44.8	0	0	0	110.4	R561 C598	R561-D596 IonicContact CZ-OD1 3.87Å; R561-D596 VanDerWaalsContact CZ-OD1 3.27Å; R561-D596 IonicContact CZ-OD2 3.27Å; R561-D596 IonicContact NE-OD1 3.79Å; R561-D596 PolarHBondContact NE-OD1 3.13Å; R561-D596 IonicContact NH2-OD1 3.84Å; R561-D596 PolarHBondContact NH2-OD1 3.17Å; R561-D596 IonicContact NH2-OD2 2.93Å; R561-D596 PolarHBondContact NH2-OD2 2.96Å; D596-C598 PolarHBondContact O-N 2.78Å
597	A	68.3	Low	66.2	Low	10 Å²	10	75.8 Å²	75.8	8%	0.083	43%	0.43	C	S	.	.			trans	-95.5	84.4	-179.3	0	0	0	0	0	110.1	Y480 T482 F534 L599	Y480-A597 WeakPolarHBondContact CB-O 3.34Å; Y480-A597 PolarHBondContact O-N 3.35Å; T482-A597 HydrophobicContact CG2-CB 3.88Å; F534-A597 HydrophobicContact CD1-CB 3.98Å; F534-A597 HydrophobicContact CE1-CB 4.36Å; A597-L599 VanDerWaalsContact C-N 3.35Å; A597-L599 PolarHBondContact O-N 3Å
598	C	57.7	Low	63.7	Low	63 Å²	63	81.2 Å²	81.2	43%	0.426	46%	0.463	S	S	.	.			trans	-69	85.7	178.8	-177.5	0	0	0	0	112	D596 L600 C601	D596-C598 PolarHBondContact O-N 2.78Å; C598-L600 PolarHBondContact O-N 2.79Å; C598-L600 VanDerWaalsContact O-N 3.16Å; C598-C601 HydrophobicContact CB-CB 3.67Å; C598-C601 WeakPolarHBondContact CB-SG 3Å; C598-C601 WeakPolarHBondContact O-CB 3.4Å; C598-C601 PolarHBondContact O-N 2.61Å; C598-C601 WeakPolarHBondContact SG-CB 3.12Å; C598-C601 PolarHBondContact SG-N 3.14Å; C598-C601 CovalentContact SG-SG 2.03Å; C598-C601 PolarHBondContact SG-SG 2.93Å
599	L	51.5	Low	61.2	Low	104 Å²	104	85.8 Å²	85.8	55%	0.545	49%	0.485	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-27.9	175.6	-87	156.7	0	0	0	113.5	Y480 A597	Y480-L599 HydrophobicContact CD1-CD1 3.54Å; Y480-L599 HydrophobicContact CD2-CD1 3.73Å; Y480-L599 HydrophobicContact CE1-CD1 3.69Å; Y480-L599 HydrophobicContact CE2-CD1 3.88Å; Y480-L599 HydrophobicContact CG-CD1 3.57Å; A597-L599 VanDerWaalsContact C-N 3.35Å; A597-L599 PolarHBondContact O-N 3Å
600	L	44.7	Very low	58.5	Low	83 Å²	83	89.9 Å²	89.9	44%	0.435	51%	0.51	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	0.4	178.7	-72.4	163.3	0	0	0	114	C598 H602	C598-L600 PolarHBondContact O-N 2.79Å; C598-L600 VanDerWaalsContact O-N 3.16Å; L600-H602 PolarHBondContact O-N 3.15Å
601	C	47.2	Very low	56.1	Low	87 Å²	87	92 Å²	92	59%	0.588	52%	0.523	S	S	*	.	S	Bend	trans	-84.2	10	178.3	-70.6	0	0	0	0	113.4	C598	C598-C601 HydrophobicContact CB-CB 3.67Å; C598-C601 WeakPolarHBondContact CB-SG 3Å; C598-C601 WeakPolarHBondContact O-CB 3.4Å; C598-C601 PolarHBondContact O-N 2.61Å; C598-C601 WeakPolarHBondContact SG-CB 3.12Å; C598-C601 PolarHBondContact SG-N 3.14Å; C598-C601 CovalentContact SG-SG 2.03Å; C598-C601 PolarHBondContact SG-SG 2.93Å
602	H	41.6	Very low	53.7	Low	177 Å²	177	99.6 Å²	99.6	82%	0.819	55%	0.546	S	S	*	.	S	Bend	trans	-131.7	87.9	173.5	-86.5	20.6	0	0	0	110.8	L600	L600-H602 PolarHBondContact O-N 3.15Å
603	G	31.9	Very low	51.6	Low	56 Å²	56	101.7 Å²	101.7	58%	0.577	56%	0.558	S	S	*	*			trans	86.5	124	173	0	0	0	0	0	114	E605	G603-E605 PolarHBondContact O-N 3.38Å
604	G	27.9	Very low	49.8	Very low	89 Å²	89	103.3 Å²	103.3	92%	0.918	58%	0.576	S	S	*	*	S	Bend	trans	-87.2	85.5	179.4	0	0	0	0	0	112.7
605	E	36.5	Very low	48.3	Very low	170 Å²	170	110 Å²	110	79%	0.794	60%	0.601	S	S	*	*	S	Bend	trans	-145.7	162.6	160.1	-120.3	173.2	-172.1	0	0	108.9	G603 T607	G603-E605 PolarHBondContact O-N 3.38Å; E605-T607 VanDerWaalsContact C-N 3.33Å; E605-T607 PolarHBondContact O-N 3.05Å
606	E	39.9	Very low	47.8	Very low	178 Å²	178	109.1 Å²	109.1	83%	0.832	61%	0.606	S	S	*	*			trans	-71.7	87.3	-178.1	-68.2	-161.6	122.6	0	0	111.3	V608	E606-V608 PolarHBondContact O-N 3.28Å
607	T	38.6	Very low	47.7	Very low	96 Å²	96	108.1 Å²	108.1	59%	0.589	62%	0.615	S	S	*	*			trans	-68	81.8	170.3	45	0	0	0	0	110.1	E605 I609	E605-T607 VanDerWaalsContact C-N 3.33Å; E605-T607 PolarHBondContact O-N 3.05Å; T607-I609 PolarHBondContact O-N 2.95Å
608	V	40.2	Very low	48.2	Very low	114 Å²	114	110.5 Å²	110.5	69%	0.691	64%	0.64	S	S	*	*			trans	-43	134.6	161.2	178.8	0	0	0	0	107.9	E606 V610	E606-V608 PolarHBondContact O-N 3.28Å; V608-V610 PolarHBondContact O-N 3.26Å
609	I	41.5	Very low	49.3	Very low	115 Å²	115	109.6 Å²	109.6	59%	0.59	64%	0.635	S	S	*	*			trans	-70.9	83.8	177.3	-58.6	172.7	0	0	0	107.8	T607 N611	T607-I609 PolarHBondContact O-N 2.95Å; I609-N611 PolarHBondContact O-N 2.92Å
610	V	39.2	Very low	50.9	Low	90 Å²	90	110 Å²	110	55%	0.545	64%	0.635	S	S	.	*			trans	-66.9	103.9	174.6	-178.9	0	0	0	0	107.2	V608 Y612	V608-V610 PolarHBondContact O-N 3.26Å; V610-Y612 WeakPolarHBondContact O-CD2 3.12Å; V610-Y612 PolarHBondContact O-N 3.33Å
611	N	41.1	Very low	52.9	Low	86 Å²	86	108.7 Å²	108.7	46%	0.46	64%	0.636	S	S	.	*			trans	-56.5	111.1	156	-78.5	-42.4	0	0	0	106.3	R521 I609 M613	R521-N611 PolarHBondContact NH1-OD1 2.95Å; R521-N611 PolarHBondContact NH2-OD1 3.05Å; R521-N611 VanDerWaalsContact NH2-OD1 3.08Å; I609-N611 PolarHBondContact O-N 2.92Å; N611-M613 PolarHBondContact O-N 2.84Å
612	Y	41.2	Very low	54.9	Low	209 Å²	209	106.3 Å²	106.3	82%	0.82	63%	0.627	S	S	*	*			trans	-69.6	69.1	-179.2	-83.2	-89.1	0	0	0	111.4	V610 G614	V610-Y612 WeakPolarHBondContact O-CD2 3.12Å; V610-Y612 PolarHBondContact O-N 3.33Å; Y612-G614 PolarHBondContact O-N 2.89Å
613	M	46.5	Very low	57.2	Low	176 Å²	176	101.4 Å²	101.4	87%	0.867	61%	0.606	S	S	*	*			trans	-82.4	41.8	161.5	-70.1	-175.7	162.4	0	0	110.1	N611	N611-M613 PolarHBondContact O-N 2.84Å
614	G	52.5	Low	60.1	Low	44 Å²	44	100.8 Å²	100.8	45%	0.454	60%	0.599	S	S	.	*	S	Bend	trans	-130.6	139.3	-175.8	0	0	0	0	0	110.7	Y612 T616	Y612-G614 PolarHBondContact O-N 2.89Å; G614-T616 PolarHBondContact O-N 3.02Å
615	Y	59.1	Low	63.2	Low	162 Å²	162	101.7 Å²	101.7	64%	0.635	58%	0.582	S	S	*	*			trans	-54	128.2	171	-69	-76	0	0	0	110.3	S619 L623	Y615-S619 WeakPolarHBondContact CA-OG 3.47Å; Y615-S619 WeakPolarHBondContact CB-OG 3.09Å; Y615-L623 HydrophobicContact CD1-CD1 4.32Å; Y615-L623 HydrophobicContact CE1-CD1 4.16Å
616	T	75.9	Confident	65.9	Low	100 Å²	100	96.4 Å²	96.4	61%	0.613	56%	0.564	S	S	*	*			trans	-58.8	151.5	171.2	68.6	0	0	0	0	109.8	G614 G618 S619 M620	G614-T616 PolarHBondContact O-N 3.02Å; T616-G618 PolarHBondContact O-N 3.02Å; T616-G618 VanDerWaalsContact O-N 3.11Å; T616-S619 PolarHBondContact N-OG 2.82Å; T616-S619 CarbonylContact O-C 3.59Å; T616-S619 WeakPolarHBondContact O-CA 3.46Å; T616-S619 PolarHBondContact O-N 3.37Å; T616-S619 PolarHBondContact O-OG 2.76Å; T616-S619 PolarHBondContact OG1-N 3.31Å; T616-S619 PolarHBondContact OG1-OG 3.16Å; T616-M620 PolarHBondContact O-N 2.96Å
617	G	78.5	Confident	68.5	Low	61 Å²	61	93.9 Å²	93.9	63%	0.629	55%	0.554	S	S	*	*	H	α-helix	trans	-53.2	-36.7	179.8	0	0	0	0	0	113.5	M620 A621	G617-M620 PolarHBondContact O-N 3.22Å; G617-A621 WeakPolarHBondContact O-CB 3.39Å; G617-A621 PolarHBondContact O-N 2.82Å
618	G	79.6	Confident	71.2	Confident	60 Å²	60	95.2 Å²	95.2	62%	0.619	56%	0.556	S	S	*	*	H	α-helix	trans	-65.3	-39.5	172.9	0	0	0	0	0	113.8	T616 A621 G622	T616-G618 PolarHBondContact O-N 3.02Å; T616-G618 VanDerWaalsContact O-N 3.11Å; G618-A621 PolarHBondContact O-N 2.94Å; G618-G622 PolarHBondContact O-N 2.85Å
619	S	80	Confident	73.8	Confident	44 Å²	44	95.2 Å²	95.2	31%	0.308	55%	0.552	S	S	.	*	H	α-helix	trans	-72.9	-32.9	174.8	66.7	0	0	0	0	113.2	Y615 T616 G622 L623	Y615-S619 WeakPolarHBondContact CA-OG 3.47Å; Y615-S619 WeakPolarHBondContact CB-OG 3.09Å; T616-S619 PolarHBondContact N-OG 2.82Å; T616-S619 CarbonylContact O-C 3.59Å; T616-S619 WeakPolarHBondContact O-CA 3.46Å; T616-S619 PolarHBondContact O-N 3.37Å; T616-S619 PolarHBondContact O-OG 2.76Å; T616-S619 PolarHBondContact OG1-N 3.31Å; T616-S619 PolarHBondContact OG1-OG 3.16Å; S619-G622 PolarHBondContact O-N 2.85Å; S619-L623 WeakPolarHBondContact O-CB 3.48Å; S619-L623 PolarHBondContact O-N 2.92Å
620	M	84.2	Confident	76.4	Confident	114 Å²	114	94.6 Å²	94.6	56%	0.562	55%	0.549	S	S	*	.	H	α-helix	trans	-65.1	-42.7	169.2	-73.2	-163	173.4	0	0	111.8	T616 G617 L623 G624	T616-M620 PolarHBondContact O-N 2.96Å; G617-M620 PolarHBondContact O-N 3.22Å; M620-L623 PolarHBondContact O-N 2.86Å; M620-G624 PolarHBondContact O-N 3.09Å
621	A	87.8	Confident	79.1	Confident	54 Å²	54	92.4 Å²	92.4	45%	0.446	55%	0.545	S	S	.	.	H	α-helix	trans	-62.4	-42.6	174	0	0	0	0	0	111.6	G617 G618 L623 G624 I625	G617-A621 WeakPolarHBondContact O-CB 3.39Å; G617-A621 PolarHBondContact O-N 2.82Å; G618-A621 PolarHBondContact O-N 2.94Å; A621-L623 PolarHBondContact O-N 2.96Å; A621-G624 PolarHBondContact O-N 2.85Å; A621-I625 WeakPolarHBondContact O-CB 3.48Å; A621-I625 VanDerWaalsContact O-CG1 3.28Å; A621-I625 WeakPolarHBondContact O-CG1 3.08Å; A621-I625 PolarHBondContact O-N 2.69Å
622	G	89.4	Confident	81.6	Confident	38 Å²	38	91.4 Å²	91.4	39%	0.392	55%	0.545	S	S	.	.	H	α-helix	trans	-60.6	-41.4	173.4	0	0	0	0	0	113.3	G618 S619 S626	G618-G622 PolarHBondContact O-N 2.85Å; S619-G622 PolarHBondContact O-N 2.85Å; G622-S626 WeakPolarHBondContact O-CB 3.4Å; G622-S626 PolarHBondContact O-N 2.86Å; G622-S626 PolarHBondContact O-OG 2.86Å
623	L	90.1	Very high	84.2	Confident	74 Å²	74	87.5 Å²	87.5	39%	0.387	53%	0.532	S	S	.	.	H	α-helix	trans	-64	-43.6	172.6	-104.8	167	0	0	0	112.1	Y615 S619 M620 A621 S626 M627	Y615-L623 HydrophobicContact CD1-CD1 4.32Å; Y615-L623 HydrophobicContact CE1-CD1 4.16Å; S619-L623 WeakPolarHBondContact O-CB 3.48Å; S619-L623 PolarHBondContact O-N 2.92Å; M620-L623 PolarHBondContact O-N 2.86Å; A621-L623 PolarHBondContact O-N 2.96Å; L623-S626 PolarHBondContact O-N 3.01Å; L623-S626 PolarHBondContact O-OG 3.23Å; L623-S626 VanDerWaalsContact O-OG 3.08Å; L623-M627 VanDerWaalsContact O-CB 3.27Å; L623-M627 WeakPolarHBondContact O-CB 3.4Å; L623-M627 VanDerWaalsContact O-CG 3.3Å; L623-M627 WeakPolarHBondContact O-CG 3.29Å; L623-M627 PolarHBondContact O-N 2.9Å
624	G	92.2	Very high	86.5	Confident	42 Å²	42	84.3 Å²	84.3	43%	0.433	51%	0.514	S	S	.	.	H	α-helix	trans	-62.8	-45.2	177.1	0	0	0	0	0	112.7	M620 A621 L628	M620-G624 PolarHBondContact O-N 3.09Å; A621-G624 PolarHBondContact O-N 2.85Å; G624-L628 WeakPolarHBondContact O-CB 3.15Å; G624-L628 PolarHBondContact O-N 3.32Å
625	I	94.1	Very high	88.5	Confident	109 Å²	109	84.2 Å²	84.2	56%	0.559	51%	0.513	S	S	*	.	H	α-helix	trans	-65.3	-44.1	176.9	-67.2	164.4	0	0	0	110.7	A621 L628 L629	A621-I625 WeakPolarHBondContact O-CB 3.48Å; A621-I625 VanDerWaalsContact O-CG1 3.28Å; A621-I625 WeakPolarHBondContact O-CG1 3.08Å; A621-I625 PolarHBondContact O-N 2.69Å; I625-L628 PolarHBondContact O-N 3.25Å; I625-L629 HydrophobicContact CG2-CD1 4.07Å; I625-L629 WeakPolarHBondContact O-CG 3.12Å; I625-L629 PolarHBondContact O-N 2.81Å
626	S	91.6	Very high	90.2	Very high	59 Å²	59	82.4 Å²	82.4	41%	0.413	51%	0.513	S	S	.	.	H	α-helix	trans	-67	-40.9	179.3	69.9	0	0	0	0	112.1	G622 L623 L628 L629 L630	G622-S626 WeakPolarHBondContact O-CB 3.4Å; G622-S626 PolarHBondContact O-N 2.86Å; G622-S626 PolarHBondContact O-OG 2.86Å; L623-S626 PolarHBondContact O-N 3.01Å; L623-S626 PolarHBondContact O-OG 3.23Å; L623-S626 VanDerWaalsContact O-OG 3.08Å; S626-L628 PolarHBondContact O-N 3.27Å; S626-L629 PolarHBondContact O-N 3.42Å; S626-L630 VanDerWaalsContact O-CB 3.31Å; S626-L630 WeakPolarHBondContact O-CB 2.9Å; S626-L630 PolarHBondContact O-N 3.44Å
627	M	94.9	Very high	91	Very high	125 Å²	125	81.6 Å²	81.6	62%	0.616	51%	0.505	S	S	*	.	H	α-helix	trans	-59.4	-42.5	171.2	-81.2	-75.1	-179.9	0	0	112.4	L623 L630 G631	L623-M627 VanDerWaalsContact O-CB 3.27Å; L623-M627 WeakPolarHBondContact O-CB 3.4Å; L623-M627 VanDerWaalsContact O-CG 3.3Å; L623-M627 WeakPolarHBondContact O-CG 3.29Å; L623-M627 PolarHBondContact O-N 2.9Å; M627-L630 PolarHBondContact O-N 3.38Å; M627-G631 PolarHBondContact O-N 2.88Å
628	L	95.1	Very high	91.6	Very high	123 Å²	123	83.4 Å²	83.4	64%	0.644	50%	0.499	S	S	*	.	H	α-helix	trans	-64.7	-44.2	177.9	-171	156.8	0	0	0	111.3	G624 I625 S626 S632	G624-L628 WeakPolarHBondContact O-CB 3.15Å; G624-L628 PolarHBondContact O-N 3.32Å; I625-L628 PolarHBondContact O-N 3.25Å; S626-L628 PolarHBondContact O-N 3.27Å; L628-S632 WeakPolarHBondContact O-CB 3.12Å; L628-S632 PolarHBondContact O-N 2.88Å
629	L	95.7	Very high	92.3	Very high	115 Å²	115	82.3 Å²	82.3	60%	0.602	49%	0.488	S	S	*	.	H	α-helix	trans	-64.4	-45.1	176	-70.1	171.7	0	0	0	112	I625 S626 S632 F633	I625-L629 HydrophobicContact CG2-CD1 4.07Å; I625-L629 WeakPolarHBondContact O-CG 3.12Å; I625-L629 PolarHBondContact O-N 2.81Å; S626-L629 PolarHBondContact O-N 3.42Å; L629-S632 PolarHBondContact O-N 3.13Å; L629-F633 WeakPolarHBondContact O-CB 3.18Å; L629-F633 PolarHBondContact O-N 3.2Å
630	L	95.3	Very high	92.7	Very high	101 Å²	101	85.6 Å²	85.6	53%	0.529	50%	0.497	S	S	.	.	H	α-helix	trans	-65	-46	179.1	-153.2	94.4	0	0	0	111.2	S626 M627 F633 F634	S626-L630 VanDerWaalsContact O-CB 3.31Å; S626-L630 WeakPolarHBondContact O-CB 2.9Å; S626-L630 PolarHBondContact O-N 3.44Å; M627-L630 PolarHBondContact O-N 3.38Å; L630-F633 PolarHBondContact O-N 3.11Å; L630-F634 HydrophobicContact CD2-CD2 4.26Å; L630-F634 HydrophobicContact CD2-CE2 3.93Å; L630-F634 HydrophobicContact CG-CD2 4.07Å; L630-F634 HydrophobicContact CG-CE2 3.92Å; L630-F634 VanDerWaalsContact O-CD2 3.3Å; L630-F634 WeakPolarHBondContact O-CD2 3.49Å; L630-F634 PolarHBondContact O-N 3.12Å
631	G	95.7	Very high	92.8	Very high	45 Å²	45	87 Å²	87	46%	0.464	50%	0.497	S	S	.	.	H	α-helix	trans	-63.8	-37.8	176.4	0	0	0	0	0	112.9	M627 G635	M627-G631 PolarHBondContact O-N 2.88Å; G631-G635 WeakPolarHBondContact O-CA 3.23Å; G631-G635 PolarHBondContact O-N 3.19Å
632	S	94.6	Very high	92.9	Very high	65 Å²	65	88.9 Å²	88.9	46%	0.455	50%	0.499	S	S	.	.	H	α-helix	trans	-64.8	-43.2	172.5	-175.5	0	0	0	0	111.9	L628 L629 G635 L636	L628-S632 WeakPolarHBondContact O-CB 3.12Å; L628-S632 PolarHBondContact O-N 2.88Å; L629-S632 PolarHBondContact O-N 3.13Å; S632-G635 PolarHBondContact O-N 3.46Å; S632-L636 WeakPolarHBondContact O-CB 3.27Å; S632-L636 WeakPolarHBondContact O-CG 3.43Å; S632-L636 PolarHBondContact O-N 2.6Å
633	F	95.5	Very high	92.7	Very high	127 Å²	127	93.9 Å²	93.9	56%	0.557	51%	0.506	S	S	*	.	H	α-helix	trans	-63.3	-49.1	176.8	-179.1	-105	0	0	0	112.5	L629 L630 G635 L636 I637	L629-F633 WeakPolarHBondContact O-CB 3.18Å; L629-F633 PolarHBondContact O-N 3.2Å; L630-F633 PolarHBondContact O-N 3.11Å; F633-G635 VanDerWaalsContact C-N 3.35Å; F633-G635 PolarHBondContact O-N 2.93Å; F633-L636 PolarHBondContact O-N 2.89Å; F633-I637 HydrophobicContact CD1-CD1 3.9Å; F633-I637 HydrophobicContact CE1-CD1 3.46Å; F633-I637 VanDerWaalsContact CE1-CD1 3.46Å; F633-I637 HydrophobicContact CE2-CD1 4.26Å; F633-I637 HydrophobicContact CG-CD1 4.48Å; F633-I637 HydrophobicContact CZ-CD1 3.67Å; F633-I637 WeakPolarHBondContact O-CG1 3.22Å; F633-I637 PolarHBondContact O-N 3.42Å
634	F	95	Very high	92.1	Very high	109 Å²	109	93.6 Å²	93.6	48%	0.478	50%	0.501	S	S	.	.	H	α-helix	trans	-64.6	-38.3	174.1	-79.7	-68.6	0	0	0	112.2	L630 L636 I637 I638	L630-F634 HydrophobicContact CD2-CD2 4.26Å; L630-F634 HydrophobicContact CD2-CE2 3.93Å; L630-F634 HydrophobicContact CG-CD2 4.07Å; L630-F634 HydrophobicContact CG-CE2 3.92Å; L630-F634 VanDerWaalsContact O-CD2 3.3Å; L630-F634 WeakPolarHBondContact O-CD2 3.49Å; L630-F634 PolarHBondContact O-N 3.12Å; F634-L636 PolarHBondContact O-N 2.87Å; F634-I637 PolarHBondContact O-N 3.23Å; F634-I638 WeakPolarHBondContact O-CB 3.21Å; F634-I638 VanDerWaalsContact O-CG1 3.26Å; F634-I638 WeakPolarHBondContact O-CG1 3.31Å; F634-I638 PolarHBondContact O-N 2.92Å
635	G	95.1	Very high	91.1	Very high	42 Å²	42	100.3 Å²	100.3	43%	0.433	51%	0.514	S	S	.	.	H	α-helix	trans	-60.8	-41.1	174.6	0	0	0	0	0	112.9	G631 S632 F633 G639	G631-G635 WeakPolarHBondContact O-CA 3.23Å; G631-G635 PolarHBondContact O-N 3.19Å; S632-G635 PolarHBondContact O-N 3.46Å; F633-G635 VanDerWaalsContact C-N 3.35Å; F633-G635 PolarHBondContact O-N 2.93Å; G635-G639 WeakPolarHBondContact O-CA 3.34Å; G635-G639 PolarHBondContact O-N 2.93Å
636	L	94.5	Very high	90.1	Very high	123 Å²	123	103.6 Å²	103.6	64%	0.644	53%	0.526	S	S	*	.	H	α-helix	trans	-66.4	-42.2	173.5	-78.5	169.8	0	0	0	112.2	S632 F633 F634 F640	S632-L636 WeakPolarHBondContact O-CB 3.27Å; S632-L636 WeakPolarHBondContact O-CG 3.43Å; S632-L636 PolarHBondContact O-N 2.6Å; F633-L636 PolarHBondContact O-N 2.89Å; F634-L636 PolarHBondContact O-N 2.87Å; L636-F640 WeakPolarHBondContact O-CB 3.42Å; L636-F640 PolarHBondContact O-N 3.17Å
637	I	92.2	Very high	89.2	Confident	84 Å²	84	108.6 Å²	108.6	43%	0.431	54%	0.536	S	S	.	.	H	α-helix	trans	-63.1	-48.6	176.4	-70.8	170.8	0	0	0	110.9	F633 F634 F640 Y641	F633-I637 HydrophobicContact CD1-CD1 3.9Å; F633-I637 HydrophobicContact CE1-CD1 3.46Å; F633-I637 VanDerWaalsContact CE1-CD1 3.46Å; F633-I637 HydrophobicContact CE2-CD1 4.26Å; F633-I637 HydrophobicContact CG-CD1 4.48Å; F633-I637 HydrophobicContact CZ-CD1 3.67Å; F633-I637 WeakPolarHBondContact O-CG1 3.22Å; F633-I637 PolarHBondContact O-N 3.42Å; F634-I637 PolarHBondContact O-N 3.23Å; I637-F640 PolarHBondContact O-N 2.86Å; I637-Y641 VanDerWaalsContact O-CB 3.31Å; I637-Y641 WeakPolarHBondContact O-CB 3.37Å; I637-Y641 PolarHBondContact O-N 2.04Å
638	I	92	Very high	87.2	Confident	98 Å²	98	105.9 Å²	105.9	50%	0.503	54%	0.541	S	S	.	.	H	α-helix	trans	-66.2	-45.4	180	-66.9	165.7	0	0	0	110.4	F634 F640 Y641 L642	F634-I638 WeakPolarHBondContact O-CB 3.21Å; F634-I638 VanDerWaalsContact O-CG1 3.26Å; F634-I638 WeakPolarHBondContact O-CG1 3.31Å; F634-I638 PolarHBondContact O-N 2.92Å; I638-F640 PolarHBondContact O-N 3.22Å; I638-Y641 PolarHBondContact O-N 2.77Å; I638-L642 HydrophobicContact CG2-CD1 3.93Å; I638-L642 HydrophobicContact CG2-CG 4.38Å; I638-L642 WeakPolarHBondContact O-CB 3.39Å; I638-L642 WeakPolarHBondContact O-CG 3.48Å; I638-L642 PolarHBondContact O-N 3.43Å
639	G	92.7	Very high	85	Confident	38 Å²	38	104.3 Å²	104.3	39%	0.392	53%	0.532	S	S	.	.	H	α-helix	trans	-60.2	-44.9	176.5	0	0	0	0	0	112.5	G635 L642 W643	G635-G639 WeakPolarHBondContact O-CA 3.34Å; G635-G639 PolarHBondContact O-N 2.93Å; G639-L642 PolarHBondContact O-N 2.88Å; G639-W643 VanDerWaalsContact O-CB 3.27Å; G639-W643 WeakPolarHBondContact O-CB 3.34Å; G639-W643 PolarHBondContact O-N 2.98Å
640	F	89.3	Confident	82.4	Confident	112 Å²	112	103.5 Å²	103.5	49%	0.491	54%	0.542	S	S	.	.	H	α-helix	trans	-64.2	-40.7	174.3	-174.4	-100.3	0	0	0	111.8	L636 I637 I638 W643 K644	L636-F640 WeakPolarHBondContact O-CB 3.42Å; L636-F640 PolarHBondContact O-N 3.17Å; I637-F640 PolarHBondContact O-N 2.86Å; I638-F640 PolarHBondContact O-N 3.22Å; F640-W643 AromaticContact CD2-CE3 3.98Å; F640-W643 HydrophobicContact CD2-CE3 3.98Å; F640-W643 HydrophobicContact CD2-CZ3 4.22Å; F640-W643 HydrophobicContact CE2-CE3 4.15Å; F640-W643 HydrophobicContact CE2-CZ3 4.04Å; F640-W643 PolarHBondContact O-N 2.82Å; F640-K644 HydrophobicContact CE1-CD 3.95Å; F640-K644 HydrophobicContact CZ-CD 4.36Å; F640-K644 WeakPolarHBondContact O-CB 3.34Å; F640-K644 PolarHBondContact O-N 3.24Å
641	Y	86.3	Confident	80.2	Confident	145 Å²	145	104.5 Å²	104.5	57%	0.569	54%	0.539	S	S	*	.	H	α-helix	trans	-63.7	-44.1	176.9	-167.3	-87.9	0	0	0	112	I637 I638 K644 R645	I637-Y641 VanDerWaalsContact O-CB 3.31Å; I637-Y641 WeakPolarHBondContact O-CB 3.37Å; I637-Y641 PolarHBondContact O-N 2.04Å; I638-Y641 PolarHBondContact O-N 2.77Å; Y641-K644 PolarHBondContact O-N 2.79Å; Y641-R645 WeakPolarHBondContact O-CB 3.42Å; Y641-R645 PolarHBondContact O-N 2.99Å
642	L	89.1	Confident	77.4	Confident	93 Å²	93	111.5 Å²	111.5	49%	0.487	56%	0.56	S	S	.	*	H	α-helix	trans	-66.2	-44.1	176	-69.1	173	0	0	0	112.1	I638 G639 K644 R645 H646	I638-L642 HydrophobicContact CG2-CD1 3.93Å; I638-L642 HydrophobicContact CG2-CG 4.38Å; I638-L642 WeakPolarHBondContact O-CB 3.39Å; I638-L642 WeakPolarHBondContact O-CG 3.48Å; I638-L642 PolarHBondContact O-N 3.43Å; G639-L642 PolarHBondContact O-N 2.88Å; L642-K644 VanDerWaalsContact C-N 3.31Å; L642-K644 PolarHBondContact O-N 2.85Å; L642-R645 WeakPolarHBondContact O-CB 3.1Å; L642-R645 PolarHBondContact O-N 2.87Å; L642-H646 PolarHBondContact O-N 3.1Å
643	W	85	Confident	74.8	Confident	142 Å²	142	114.3 Å²	114.3	54%	0.538	57%	0.569	S	S	.	*	H	α-helix	trans	-60.6	-40.1	175.2	-176.3	57.8	0	0	0	112.1	G639 F640 H646	G639-W643 VanDerWaalsContact O-CB 3.27Å; G639-W643 WeakPolarHBondContact O-CB 3.34Å; G639-W643 PolarHBondContact O-N 2.98Å; F640-W643 AromaticContact CD2-CE3 3.98Å; F640-W643 HydrophobicContact CD2-CE3 3.98Å; F640-W643 HydrophobicContact CD2-CZ3 4.22Å; F640-W643 HydrophobicContact CE2-CE3 4.15Å; F640-W643 HydrophobicContact CE2-CZ3 4.04Å; F640-W643 PolarHBondContact O-N 2.82Å; W643-H646 PolarHBondContact O-N 3.03Å
644	K	77.8	Confident	71.8	Confident	68 Å²	68	111.4 Å²	111.4	30%	0.296	57%	0.574	S	S	.	*	H	α-helix	trans	-73.4	-34.4	177.4	-153.4	177.5	-160.9	-169.9	0	112.4	F640 Y641 L642 H646 R647 Y651	F640-K644 HydrophobicContact CE1-CD 3.95Å; F640-K644 HydrophobicContact CZ-CD 4.36Å; F640-K644 WeakPolarHBondContact O-CB 3.34Å; F640-K644 PolarHBondContact O-N 3.24Å; Y641-K644 PolarHBondContact O-N 2.79Å; L642-K644 VanDerWaalsContact C-N 3.31Å; L642-K644 PolarHBondContact O-N 2.85Å; K644-H646 VanDerWaalsContact C-N 3.33Å; K644-H646 PolarHBondContact O-N 3.3Å; K644-R647 PolarHBondContact O-N 2.68Å; K644-Y651 HydrophobicContact CD-CE2 3.76Å; K644-Y651 WeakPolarHBondContact CE-OH 2.78Å; K644-Y651 HydrophobicContact CG-CE2 4.21Å; K644-Y651 PolarHBondContact NZ-OH 2.79Å
645	R	71.9	Confident	68.8	Low	184 Å²	184	113.9 Å²	113.9	69%	0.694	59%	0.592	S	S	*	*	H	α-helix	trans	-61.4	-39.8	171.6	-175	175.6	179.8	166.1	0.1	111.5	Y641 L642 R647 G648	Y641-R645 WeakPolarHBondContact O-CB 3.42Å; Y641-R645 PolarHBondContact O-N 2.99Å; L642-R645 WeakPolarHBondContact O-CB 3.1Å; L642-R645 PolarHBondContact O-N 2.87Å; R645-R647 PolarHBondContact O-N 3.4Å; R645-G648 PolarHBondContact O-N 3.03Å; R645-G648 VanDerWaalsContact O-N 3.12Å
646	H	72.5	Confident	66.1	Low	177 Å²	177	122.5 Å²	122.5	82%	0.819	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64	-14.3	172.4	-97.1	-74.9	0	0	0	114.6	L642 W643 K644	L642-H646 PolarHBondContact O-N 3.1Å; W643-H646 PolarHBondContact O-N 3.03Å; K644-H646 VanDerWaalsContact C-N 3.33Å; K644-H646 PolarHBondContact O-N 3.3Å
647	R	72.3	Confident	63.4	Low	164 Å²	164	121.5 Å²	121.5	62%	0.619	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.2	10.8	174.3	-69.3	-177.8	168.6	177.7	-4.4	114	K644 R645 I649	K644-R647 PolarHBondContact O-N 2.68Å; R645-R647 PolarHBondContact O-N 3.4Å; R647-I649 VanDerWaalsContact C-N 3.28Å; R647-I649 PolarHBondContact O-N 2.85Å
648	G	52.8	Low	61.2	Low	69 Å²	69	124.4 Å²	124.4	71%	0.711	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	71.7	8.2	165.7	0	0	0	0	0	116.9	R645 A650	R645-G648 PolarHBondContact O-N 3.03Å; R645-G648 VanDerWaalsContact O-N 3.12Å; G648-A650 PolarHBondContact O-N 3.36Å
649	I	49.2	Very low	59	Low	90 Å²	90	124.2 Å²	124.2	46%	0.462	63%	0.627	S	S	.	*			trans	-81.3	107	-178.7	-50	174.5	0	0	0	109.9	R647 Y651	R647-I649 VanDerWaalsContact C-N 3.28Å; R647-I649 PolarHBondContact O-N 2.85Å; I649-Y651 HydrophobicContact CB-CD2 4.46Å; I649-Y651 HydrophobicContact CB-CE2 3.78Å; I649-Y651 HydrophobicContact CG2-CD2 4.23Å; I649-Y651 HydrophobicContact CG2-CE1 4.15Å; I649-Y651 HydrophobicContact CG2-CE2 3.57Å; I649-Y651 VanDerWaalsContact O-CD2 3.31Å; I649-Y651 WeakPolarHBondContact O-CD2 3.48Å; I649-Y651 PolarHBondContact O-N 3.21Å
650	A	42.5	Very low	56.6	Low	98 Å²	98	125.4 Å²	125.4	81%	0.81	64%	0.639	S	S	*	*			trans	-73.9	107.4	177.4	0	0	0	0	0	111.6	G648 Q652	G648-A650 PolarHBondContact O-N 3.36Å; A650-Q652 PolarHBondContact O-N 2.99Å
651	Y	47.3	Very low	54.7	Low	121 Å²	121	125 Å²	125	48%	0.475	64%	0.642	S	S	.	*			trans	-90.7	95.7	176.5	-74.3	-73.8	0	0	0	111.8	K644 I649 I653	K644-Y651 HydrophobicContact CD-CE2 3.76Å; K644-Y651 WeakPolarHBondContact CE-OH 2.78Å; K644-Y651 HydrophobicContact CG-CE2 4.21Å; K644-Y651 PolarHBondContact NZ-OH 2.79Å; I649-Y651 HydrophobicContact CB-CD2 4.46Å; I649-Y651 HydrophobicContact CB-CE2 3.78Å; I649-Y651 HydrophobicContact CG2-CD2 4.23Å; I649-Y651 HydrophobicContact CG2-CE1 4.15Å; I649-Y651 HydrophobicContact CG2-CE2 3.57Å; I649-Y651 VanDerWaalsContact O-CD2 3.31Å; I649-Y651 WeakPolarHBondContact O-CD2 3.48Å; I649-Y651 PolarHBondContact O-N 3.21Å; Y651-I653 VanDerWaalsContact C-N 3.27Å; Y651-I653 PolarHBondContact O-N 2.98Å
652	Q	38.2	Very low	53	Low	193 Å²	193	122.4 Å²	122.4	90%	0.902	64%	0.644	S	S	*	*			trans	-74.3	80.7	166.8	-168.1	178	32.7	0	0	109.6	A650 G654	A650-Q652 PolarHBondContact O-N 2.99Å; Q652-G654 VanDerWaalsContact C-N 3.29Å; Q652-G654 PolarHBondContact O-N 2.99Å
653	I	40.3	Very low	51.6	Low	123 Å²	123	118.7 Å²	118.7	63%	0.631	63%	0.626	S	S	*	*			trans	-72.1	86.8	177.9	-57.5	-179.2	0	0	0	108.9	Y651 L655	Y651-I653 VanDerWaalsContact C-N 3.27Å; Y651-I653 PolarHBondContact O-N 2.98Å; I653-L655 VanDerWaalsContact C-N 3.27Å; I653-L655 HydrophobicContact CG2-CD1 4.36Å; I653-L655 HydrophobicContact CG2-CG 4.35Å; I653-L655 PolarHBondContact O-N 3.43Å
654	G	32.5	Very low	50.4	Low	66 Å²	66	114.9 Å²	114.9	68%	0.68	62%	0.616	S	S	*	*			trans	-73.8	70.9	-179.7	0	0	0	0	0	113.2	Q652 R656	Q652-G654 VanDerWaalsContact C-N 3.29Å; Q652-G654 PolarHBondContact O-N 2.99Å; G654-R656 PolarHBondContact O-N 3.45Å
655	L	31.5	Very low	49.2	Very low	161 Å²	161	113.5 Å²	113.5	84%	0.843	62%	0.615	S	S	*	*			trans	-67.4	73.8	164.6	-85.3	161	0	0	0	110.2	I653	I653-L655 VanDerWaalsContact C-N 3.27Å; I653-L655 HydrophobicContact CG2-CD1 4.36Å; I653-L655 HydrophobicContact CG2-CG 4.35Å; I653-L655 PolarHBondContact O-N 3.43Å
656	R	38.2	Very low	48.4	Very low	224 Å²	224	111.4 Å²	111.4	85%	0.845	62%	0.617	S	S	*	*			trans	-75.5	128.3	165.1	-80.8	-169.4	173.6	-158.8	-0.9	109	G654 I658	G654-R656 PolarHBondContact O-N 3.45Å; R656-I658 PolarHBondContact O-N 2.95Å
657	P	37.9	Very low	47.7	Very low	102 Å²	102	106.1 Å²	106.1	66%	0.662	60%	0.597	S	S	*	*			trans	-62.9	132.7	174.2	26.2	-33.5	0	0	0	110.2	L659 G660	P657-L659 PolarHBondContact O-N 3.28Å; P657-G660 PolarHBondContact O-N 2.97Å
658	I	46.3	Very low	46.7	Very low	145 Å²	145	101.3 Å²	101.3	74%	0.744	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.9	-15.7	-169.8	-70.7	169.3	0	0	0	113.1	R656	R656-I658 PolarHBondContact O-N 2.95Å
659	L	45.1	Very low	46.8	Very low	94 Å²	94	106 Å²	106	49%	0.492	60%	0.599	S	S	.	*	T	Hydrogen-bonded Turn	trans	-119	12.6	-176	-71	166.2	0	0	0	114.6	P657 D661 F681 W781	P657-L659 PolarHBondContact O-N 3.28Å; L659-D661 PolarHBondContact O-N 3.09Å; L659-D661 VanDerWaalsContact O-N 3.08Å; L659-F681 HydrophobicContact CD2-CE2 4.5Å; L659-W781 WeakPolarHBondContact CD1-O 3.47Å
660	G	42.3	Very low	47.1	Very low	62 Å²	62	105.1 Å²	105.1	64%	0.639	60%	0.598	S	S	*	*			trans	-71.3	2.3	-177.7	0	0	0	0	0	116.8	P657	P657-G660 PolarHBondContact O-N 2.97Å
661	D	50.6	Low	48.2	Very low	105 Å²	105	104.1 Å²	104.1	56%	0.561	58%	0.575	S	S	*	*	S	Bend	trans	-101.2	88.8	-174	-150.8	56	0	0	0	109.6	L659 K671	L659-D661 PolarHBondContact O-N 3.09Å; L659-D661 VanDerWaalsContact O-N 3.08Å; D661-K671 IonicContact OD2-NZ 2.7Å; D661-K671 PolarHBondContact OD2-NZ 3.49Å
662	S	51	Low	49.4	Very low	89 Å²	89	102.8 Å²	102.8	62%	0.622	57%	0.57	S	S	*	*			trans	-57.7	148.5	-177.4	59	0	0	0	0	112.4	N664	S662-N664 PolarHBondContact O-N 2.94Å
663	C	58.9	Low	50.9	Low	15 Å²	15	99.4 Å²	99.4	10%	0.101	55%	0.552	C	S	.	*			trans	-73.3	70.1	-179.7	179.5	0	0	0	0	110.3	C683 G695 W697	C663-C683 VanDerWaalsContact CA-SG 3.56Å; C663-C683 HydrophobicContact CB-CB 4.01Å; C663-C683 WeakPolarHBondContact CB-SG 3.31Å; C663-C683 WeakPolarHBondContact SG-CB 3.37Å; C663-C683 CovalentContact SG-SG 2.04Å; C663-C683 PolarHBondContact SG-SG 2.79Å; C663-G695 WeakPolarHBondContact SG-CA 2.97Å; C663-W697 HydrophobicContact CB-CZ2 4.16Å
664	N	58.6	Low	52.2	Low	62 Å²	62	97.7 Å²	97.7	33%	0.332	54%	0.544	S	S	.	.			trans	-61.1	121.5	-167.7	-174	-31.5	0	0	0	111.4	S662 N666 T667 Q685	S662-N664 PolarHBondContact O-N 2.94Å; N664-N666 PolarHBondContact O-N 3.35Å; N664-N666 WeakPolarHBondContact OD1-CB 3.18Å; N664-N666 PolarHBondContact OD1-N 3.37Å; N664-T667 PolarHBondContact O-OG1 3.27Å; N664-Q685 PolarHBondContact O-NE2 3.01Å
665	P	52.6	Low	53.9	Low	40 Å²	40	98.3 Å²	98.3	26%	0.26	53%	0.531	S	S	.	.	G	3₁₀ helix	trans	-64.5	-21.6	-177.9	24.3	-33.1	0	0	0	113.5	Q685 R693	P665-Q685 VanDerWaalsContact C-NE2 3.26Å; P665-Q685 VanDerWaalsContact CA-NE2 3.33Å; P665-Q685 PolarHBondContact O-NE2 3.19Å; P665-Q685 PolarHBondContact O-OE1 2.81Å; P665-R693 HydrophobicContact CB-CB 3.57Å
666	N	55.8	Low	55.8	Low	139 Å²	139	93 Å²	93	74%	0.743	51%	0.508	S	S	*	.	G	3₁₀ helix	trans	-86.7	-11.6	-169.3	-61.9	-20.3	0	0	0	114.5	N664 G668	N664-N666 PolarHBondContact O-N 3.35Å; N664-N666 WeakPolarHBondContact OD1-CB 3.18Å; N664-N666 PolarHBondContact OD1-N 3.37Å; N666-G668 PolarHBondContact O-N 3.12Å
667	T	57.3	Low	57.6	Low	67 Å²	67	87 Å²	87	41%	0.411	50%	0.496	S	S	.	.	G	3₁₀ helix	trans	-80.6	-6.4	-172.7	47.6	0	0	0	0	115.9	N664 K669	N664-T667 PolarHBondContact O-OG1 3.27Å; T667-K669 PolarHBondContact O-N 3.41Å
668	G	51.9	Low	59.4	Low	62 Å²	62	85.3 Å²	85.3	64%	0.639	48%	0.481	S	S	*	.			trans	59.3	7.7	171.7	0	0	0	0	0	117	N666	N666-G668 PolarHBondContact O-N 3.12Å
669	K	55.5	Low	60.4	Low	169 Å²	169	80 Å²	80	74%	0.735	46%	0.456	S	S	*	.	S	Bend	trans	-134.6	128.1	-174.5	-68.4	175.3	-178.9	173.7	0	108.9	T667 K671	T667-K669 PolarHBondContact O-N 3.41Å; K669-K671 PolarHBondContact O-N 3.2Å
670	V	55.7	Low	61.9	Low	71 Å²	71	75.8 Å²	75.8	43%	0.43	43%	0.433	S	S	.	.			trans	-63.1	117.7	174.2	178.6	0	0	0	0	109.2	I682 Y711	V670-I682 HydrophobicContact CG1-CG2 3.79Å; V670-Y711 HydrophobicContact CG1-CE2 4.12Å; V670-Y711 WeakPolarHBondContact CG1-OH 3.37Å
671	K	65	Low	63.3	Low	77 Å²	77	74.8 Å²	74.8	34%	0.335	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	135.5	168.2	-75.2	-178.7	177.6	175.5	0	109.1	D661 K669 C683	D661-K671 IonicContact OD2-NZ 2.7Å; D661-K671 PolarHBondContact OD2-NZ 3.49Å; K669-K671 PolarHBondContact O-N 3.2Å; K671-C683 HydrophobicContact CB-CB 4.35Å; K671-C683 PolarHBondContact O-N 3.2Å
672	Y	71.8	Confident	64.4	Low	93 Å²	93	70.4 Å²	70.4	37%	0.365	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	149.5	165.7	65.9	-95.5	0	0	0	109.9	M680 F681 K708	Y672-M680 HydrophobicContact CD2-CE 4.02Å; Y672-F681 CarbonylContact C-O 3.57Å; Y672-F681 WeakPolarHBondContact CA-O 3.03Å; Y672-K708 WeakPolarHBondContact OH-CE 3.42Å
673	K	70.4	Confident	65.4	Low	121 Å²	121	66.4 Å²	66.4	53%	0.526	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	130	-180	-165.9	179.8	178.3	-173.4	0	109.2	F681	K673-F681 PolarHBondContact N-O 3.41Å; K673-F681 PolarHBondContact O-N 3.16Å
674	L	68	Low	66	Low	87 Å²	87	70.4 Å²	70.4	46%	0.455	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	141.8	169.4	-102.7	69.5	0	0	0	109.5	S676 M680 C706	L674-S676 WeakPolarHBondContact CD2-O 3Å; L674-M680 HydrophobicContact CD1-CE 3.6Å; L674-C706 HydrophobicContact CD1-CB 4.25Å; L674-C706 HydrophobicContact CG-CB 4.46Å
675	I	67.4	Low	66.5	Low	80 Å²	80	70.4 Å²	70.4	41%	0.41	38%	0.375	S	S	.	.	S	Bend	trans	-104	-46.3	172.3	-44.8	166.5	0	0	0	108.7	T679 F681	I675-T679 HydrophobicContact CD1-CG2 3.95Å; I675-T679 PolarHBondContact N-O 3.41Å; I675-F681 HydrophobicContact CD1-CD2 3.41Å; I675-F681 VanDerWaalsContact CD1-CD2 3.41Å; I675-F681 HydrophobicContact CD1-CE2 3.37Å; I675-F681 HydrophobicContact CD1-CG 4.01Å; I675-F681 HydrophobicContact CD1-CZ 3.96Å; I675-F681 HydrophobicContact CG1-CD2 3.46Å; I675-F681 VanDerWaalsContact CG1-CD2 3.46Å; I675-F681 HydrophobicContact CG1-CE2 3.7Å; I675-F681 HydrophobicContact CG1-CG 4.32Å
676	S	72.7	Confident	66.9	Low	50 Å²	50	75.9 Å²	75.9	35%	0.35	39%	0.39	S	S	.	.	S	Bend	trans	-135.8	-176.4	175.9	80.8	0	0	0	0	109.3	L674 N678 T679	L674-S676 WeakPolarHBondContact CD2-O 3Å; S676-N678 PolarHBondContact O-N 3.29Å; S676-N678 PolarHBondContact OG-N 3.37Å; S676-T679 PolarHBondContact N-O 3.21Å; S676-T679 PolarHBondContact OG-N 3.04Å; S676-T679 PolarHBondContact OG-OG1 3.08Å
677	T	74.3	Confident	67.4	Low	98 Å²	98	74.4 Å²	74.4	60%	0.601	38%	0.379	S	S	*	.	S	Bend	trans	-57.8	-33	167.8	51.3	0	0	0	0	112.3	P705 C706	T677-P705 CarbonylContact O-C 3.55Å; T677-P705 VanDerWaalsContact O-CA 3.32Å; T677-P705 WeakPolarHBondContact O-CA 3.37Å; T677-C706 PolarHBondContact O-N 3.49Å
678	N	76.9	Confident	68.1	Low	66 Å²	66	73.5 Å²	73.5	35%	0.353	37%	0.372	S	S	.	.	S	Bend	trans	-106.6	-5.2	-169.1	-63.8	16.6	0	0	0	112.8	S676 C702 C706	S676-N678 PolarHBondContact O-N 3.29Å; S676-N678 PolarHBondContact OG-N 3.37Å; N678-C702 WeakPolarHBondContact CB-O 3.13Å; N678-C702 WeakPolarHBondContact O-CA 3.29Å; N678-C702 WeakPolarHBondContact O-CB 3.14Å; N678-C702 PolarHBondContact O-N 2.69Å; N678-C706 PolarHBondContact O-SG 3.38Å; N678-C706 VanDerWaalsContact O-SG 3.37Å
679	T	66.6	Low	69.1	Low	34 Å²	34	76.2 Å²	76.2	21%	0.209	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	130.7	-170.4	-25.3	0	0	0	0	112.5	I675 S676 I699 L700	I675-T679 HydrophobicContact CD1-CG2 3.95Å; I675-T679 PolarHBondContact N-O 3.41Å; S676-T679 PolarHBondContact N-O 3.21Å; S676-T679 PolarHBondContact OG-N 3.04Å; S676-T679 PolarHBondContact OG-OG1 3.08Å; T679-I699 HydrophobicContact CG2-CG2 3.86Å; T679-L700 WeakPolarHBondContact CA-O 3.22Å
680	M	77	Confident	70.2	Confident	5 Å²	5	74.4 Å²	74.4	3%	0.025	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	133.7	-175.6	173.2	-178.7	-74.5	0	0	111.6	Y672 L674 I682 L700 C706	Y672-M680 HydrophobicContact CD2-CE 4.02Å; L674-M680 HydrophobicContact CD1-CE 3.6Å; M680-I682 HydrophobicContact CG-CG1 4.12Å; M680-I682 HydrophobicContact SD-CD1 4.17Å; M680-I682 HydrophobicContact SD-CG1 4Å; M680-L700 PolarHBondContact N-O 3.11Å; M680-L700 PolarHBondContact O-N 2.86Å; M680-C706 HydrophobicContact CB-CB 4.42Å; M680-C706 HydrophobicContact CE-CB 4.2Å
681	F	71.7	Confident	71.1	Confident	41 Å²	41	73.3 Å²	73.3	18%	0.18	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	139.2	161.9	-80.9	-65.3	0	0	0	110.9	L659 Y672 K673 I675 W697 I698 I699	L659-F681 HydrophobicContact CD2-CE2 4.5Å; Y672-F681 CarbonylContact C-O 3.57Å; Y672-F681 WeakPolarHBondContact CA-O 3.03Å; K673-F681 PolarHBondContact N-O 3.41Å; K673-F681 PolarHBondContact O-N 3.16Å; I675-F681 HydrophobicContact CD1-CD2 3.41Å; I675-F681 VanDerWaalsContact CD1-CD2 3.41Å; I675-F681 HydrophobicContact CD1-CE2 3.37Å; I675-F681 HydrophobicContact CD1-CG 4.01Å; I675-F681 HydrophobicContact CD1-CZ 3.96Å; I675-F681 HydrophobicContact CG1-CD2 3.46Å; I675-F681 VanDerWaalsContact CG1-CD2 3.46Å; I675-F681 HydrophobicContact CG1-CE2 3.7Å; I675-F681 HydrophobicContact CG1-CG 4.32Å; F681-W697 HydrophobicContact CB-CE3 3.98Å; F681-W697 HydrophobicContact CB-CZ3 3.97Å; F681-W697 HydrophobicContact CD1-CE3 4.29Å; F681-W697 HydrophobicContact CG-CE3 4.4Å; F681-I698 WeakPolarHBondContact CA-O 3.13Å; F681-I699 HydrophobicContact CD1-CG1 3.82Å; F681-I699 HydrophobicContact CE1-CD1 3.89Å; F681-I699 HydrophobicContact CE1-CG1 3.47Å; F681-I699 VanDerWaalsContact CE1-CG1 3.47Å; F681-I699 HydrophobicContact CZ-CD1 4.4Å; F681-I699 HydrophobicContact CZ-CG1 4.32Å
682	I	73.7	Confident	71.3	Confident	13 Å²	13	73.2 Å²	73.2	7%	0.067	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	132.1	167.4	-60.1	176.6	0	0	0	109	V670 M680 W697 I698 L700 Y711	V670-I682 HydrophobicContact CG1-CG2 3.79Å; M680-I682 HydrophobicContact CG-CG1 4.12Å; M680-I682 HydrophobicContact SD-CD1 4.17Å; M680-I682 HydrophobicContact SD-CG1 4Å; I682-W697 CarbonylContact O-C 2.94Å; I682-W697 WeakPolarHBondContact O-CA 3.42Å; I682-I698 PolarHBondContact N-O 2.74Å; I682-I698 PolarHBondContact O-N 3.3Å; I682-L700 HydrophobicContact CD1-CD1 3.52Å; I682-L700 HydrophobicContact CD1-CG 4.33Å; I682-L700 HydrophobicContact CG1-CD1 4.47Å; I682-Y711 HydrophobicContact CD1-CD2 3.77Å; I682-Y711 HydrophobicContact CD1-CE2 4.1Å; I682-Y711 HydrophobicContact CG1-CD2 4.47Å; I682-Y711 HydrophobicContact CG2-CE2 4.47Å
683	C	72.5	Confident	70.9	Confident	5 Å²	5	74.6 Å²	74.6	3%	0.034	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	104.8	170.4	155.7	0	0	0	0	108.7	C663 K671 W697	C663-C683 VanDerWaalsContact CA-SG 3.56Å; C663-C683 HydrophobicContact CB-CB 4.01Å; C663-C683 WeakPolarHBondContact CB-SG 3.31Å; C663-C683 WeakPolarHBondContact SG-CB 3.37Å; C663-C683 CovalentContact SG-SG 2.04Å; C663-C683 PolarHBondContact SG-SG 2.79Å; K671-C683 HydrophobicContact CB-CB 4.35Å; K671-C683 PolarHBondContact O-N 3.2Å; C683-W697 HydrophobicContact CB-CD2 4.11Å; C683-W697 HydrophobicContact CB-CE3 3.67Å; C683-W697 HydrophobicContact CB-CH2 3.73Å; C683-W697 HydrophobicContact CB-CZ2 4.15Å; C683-W697 HydrophobicContact CB-CZ3 3.48Å; C683-W697 VanDerWaalsContact CB-CZ3 3.48Å
684	Q	70	Confident	70.6	Confident	98 Å²	98	72.9 Å²	72.9	46%	0.458	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	129.2	179.9	-177.6	169.7	-5.7	0	0	110.5	V696 I698	Q684-V696 PolarHBondContact N-O 2.6Å; Q684-V696 PolarHBondContact O-N 3.22Å; Q684-I698 HydrophobicContact CB-CD1 4.08Å; Q684-I698 VanDerWaalsContact OE1-CD1 3.31Å
685	Q	69	Low	70.3	Confident	62 Å²	62	70.3 Å²	70.3	29%	0.29	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	137.2	177.3	-63.3	-179	-9.6	0	0	110.7	N664 P665 H694	N664-Q685 PolarHBondContact O-NE2 3.01Å; P665-Q685 VanDerWaalsContact C-NE2 3.26Å; P665-Q685 VanDerWaalsContact CA-NE2 3.33Å; P665-Q685 PolarHBondContact O-NE2 3.19Å; P665-Q685 PolarHBondContact O-OE1 2.81Å; Q685-H694 CarbonylContact C-O 3.57Å; Q685-H694 WeakPolarHBondContact CA-O 3.35Å
686	R	61.9	Low	70	Confident	155 Å²	155	69.1 Å²	69.1	59%	0.585	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.9	121.4	170.5	179.6	-179.3	178.7	-168.5	-1.4	109.2	H694	R686-H694 PolarHBondContact N-O 3.44Å; R686-H694 PolarHBondContact O-N 3.08Å
687	E	65.4	Low	69.9	Low	108 Å²	108	71.5 Å²	71.5	51%	0.505	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	132	166.7	-142.7	154.6	-127.2	0	0	107.9	V692 R693	E687-V692 WeakPolarHBondContact CA-O 3.45Å; E687-R693 HydrophobicContact CG-CG 4.01Å; E687-R693 IonicContact OE1-CZ 2.81Å; E687-R693 IonicContact OE1-NE 2.62Å; E687-R693 PolarHBondContact OE1-NE 2.82Å; E687-R693 IonicContact OE1-NH2 2.75Å; E687-R693 PolarHBondContact OE1-NH2 2.62Å
688	D	73.8	Confident	69.7	Low	48 Å²	48	68.2 Å²	68.2	26%	0.257	36%	0.358	S	S	.	.			trans	-89.4	-177.7	175.7	71	15.5	0	0	0	112.6	N690 G691 V692 H694	D688-N690 PolarHBondContact O-N 2.57Å; D688-N690 VanDerWaalsContact O-N 3.09Å; D688-N690 WeakPolarHBondContact OD1-CA 3.46Å; D688-N690 WeakPolarHBondContact OD1-CB 3.1Å; D688-N690 PolarHBondContact OD1-N 3.44Å; D688-G691 PolarHBondContact O-N 3.37Å; D688-G691 PolarHBondContact OD1-N 2.84Å; D688-G691 VanDerWaalsContact OD1-N 3.16Å; D688-V692 PolarHBondContact N-O 2.78Å; D688-V692 PolarHBondContact OD1-N 2.91Å; D688-V692 WeakPolarHBondContact OD2-CB 3.15Å; D688-H694 IonicContact OD2-CD2 2.69Å; D688-H694 IonicContact OD2-CE1 3.56Å; D688-H694 IonicContact OD2-NE2 2.84Å; D688-H694 PolarHBondContact OD2-NE2 2.98Å
689	S	72.9	Confident	69.3	Low	119 Å²	119	66.6 Å²	66.6	83%	0.832	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-16.4	178.6	51.6	0	0	0	0	114.2
690	N	77.4	Confident	69.5	Low	131 Å²	131	65.6 Å²	65.6	70%	0.701	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.3	4.1	-172.8	-52.7	-3.5	0	0	0	111.1	D688 V692	D688-N690 PolarHBondContact O-N 2.57Å; D688-N690 VanDerWaalsContact O-N 3.09Å; D688-N690 WeakPolarHBondContact OD1-CA 3.46Å; D688-N690 WeakPolarHBondContact OD1-CB 3.1Å; D688-N690 PolarHBondContact OD1-N 3.44Å; N690-V692 HydrophobicContact CB-CG2 4.43Å
691	G	75.9	Confident	69.2	Low	48 Å²	48	68.3 Å²	68.3	50%	0.495	36%	0.356	S	S	.	.	S	Bend	trans	81.6	6.8	-177.9	0	0	0	0	0	114.7	D688	D688-G691 PolarHBondContact O-N 3.37Å; D688-G691 PolarHBondContact OD1-N 2.84Å; D688-G691 VanDerWaalsContact OD1-N 3.16Å
692	V	68.5	Low	69	Low	76 Å²	76	66.9 Å²	66.9	46%	0.461	35%	0.352	S	S	.	.			trans	-82.4	130.9	-179.8	-173	0	0	0	0	109.6	E687 D688 N690 H694	E687-V692 WeakPolarHBondContact CA-O 3.45Å; D688-V692 PolarHBondContact N-O 2.78Å; D688-V692 PolarHBondContact OD1-N 2.91Å; D688-V692 WeakPolarHBondContact OD2-CB 3.15Å; N690-V692 HydrophobicContact CB-CG2 4.43Å; V692-H694 PolarHBondContact O-CD2 3.31Å
693	R	64	Low	68.3	Low	122 Å²	122	72.8 Å²	72.8	46%	0.46	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	108	179.3	-70.7	-175.7	-177	177	3.3	111.7	P665 E687	P665-R693 HydrophobicContact CB-CB 3.57Å; E687-R693 HydrophobicContact CG-CG 4.01Å; E687-R693 IonicContact OE1-CZ 2.81Å; E687-R693 IonicContact OE1-NE 2.62Å; E687-R693 PolarHBondContact OE1-NE 2.82Å; E687-R693 IonicContact OE1-NH2 2.75Å; E687-R693 PolarHBondContact OE1-NH2 2.62Å
694	H	62.3	Low	68.4	Low	84 Å²	84	73.6 Å²	73.6	39%	0.389	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	133	173.7	-57.7	-84.8	0	0	0	110.1	Q685 R686 D688 V692	Q685-H694 CarbonylContact C-O 3.57Å; Q685-H694 WeakPolarHBondContact CA-O 3.35Å; R686-H694 PolarHBondContact N-O 3.44Å; R686-H694 PolarHBondContact O-N 3.08Å; D688-H694 IonicContact OD2-CD2 2.69Å; D688-H694 IonicContact OD2-CE1 3.56Å; D688-H694 IonicContact OD2-NE2 2.84Å; D688-H694 PolarHBondContact OD2-NE2 2.98Å; V692-H694 PolarHBondContact O-CD2 3.31Å
695	G	61.9	Low	68.7	Low	34 Å²	34	73.5 Å²	73.5	35%	0.351	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	110.6	176	0	0	0	0	0	111.2	C663	C663-G695 WeakPolarHBondContact SG-CA 2.97Å
696	V	62.7	Low	68.5	Low	55 Å²	55	71.1 Å²	71.1	33%	0.333	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	125.5	-179	-177	0	0	0	0	109.9	Q684 I698	Q684-V696 PolarHBondContact N-O 2.6Å; Q684-V696 PolarHBondContact O-N 3.22Å; V696-I698 HydrophobicContact CG1-CG1 4.36Å
697	W	69.1	Low	69.2	Low	100 Å²	100	66.7 Å²	66.7	38%	0.379	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	134.4	166.5	-72.5	111.2	0	0	0	110.4	C663 F681 I682 C683	C663-W697 HydrophobicContact CB-CZ2 4.16Å; F681-W697 HydrophobicContact CB-CE3 3.98Å; F681-W697 HydrophobicContact CB-CZ3 3.97Å; F681-W697 HydrophobicContact CD1-CE3 4.29Å; F681-W697 HydrophobicContact CG-CE3 4.4Å; I682-W697 CarbonylContact O-C 2.94Å; I682-W697 WeakPolarHBondContact O-CA 3.42Å; C683-W697 HydrophobicContact CB-CD2 4.11Å; C683-W697 HydrophobicContact CB-CE3 3.67Å; C683-W697 HydrophobicContact CB-CH2 3.73Å; C683-W697 HydrophobicContact CB-CZ2 4.15Å; C683-W697 HydrophobicContact CB-CZ3 3.48Å; C683-W697 VanDerWaalsContact CB-CZ3 3.48Å
698	I	70	Confident	69.2	Low	29 Å²	29	68.6 Å²	68.6	15%	0.149	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	131.4	175.6	-58.1	171.5	0	0	0	107.6	F681 I682 Q684 V696 I745	F681-I698 WeakPolarHBondContact CA-O 3.13Å; I682-I698 PolarHBondContact N-O 2.74Å; I682-I698 PolarHBondContact O-N 3.3Å; Q684-I698 HydrophobicContact CB-CD1 4.08Å; Q684-I698 VanDerWaalsContact OE1-CD1 3.31Å; V696-I698 HydrophobicContact CG1-CG1 4.36Å; I698-I745 HydrophobicContact CG2-CG2 4.44Å
699	I	70.1	Confident	68.8	Low	31 Å²	31	69.3 Å²	69.3	16%	0.159	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	129.8	169.6	-61.1	173.7	0	0	0	108	T679 F681 L769	T679-I699 HydrophobicContact CG2-CG2 3.86Å; F681-I699 HydrophobicContact CD1-CG1 3.82Å; F681-I699 HydrophobicContact CE1-CD1 3.89Å; F681-I699 HydrophobicContact CE1-CG1 3.47Å; F681-I699 VanDerWaalsContact CE1-CG1 3.47Å; F681-I699 HydrophobicContact CZ-CD1 4.4Å; F681-I699 HydrophobicContact CZ-CG1 4.32Å; I699-L769 HydrophobicContact CD1-CD1 4.2Å
700	L	69.1	Low	68.4	Low	14 Å²	14	66.5 Å²	66.5	7%	0.073	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	121.2	168.5	-71.1	179.2	0	0	0	110.1	T679 M680 I682 F714 I745	T679-L700 WeakPolarHBondContact CA-O 3.22Å; M680-L700 PolarHBondContact N-O 3.11Å; M680-L700 PolarHBondContact O-N 2.86Å; I682-L700 HydrophobicContact CD1-CD1 3.52Å; I682-L700 HydrophobicContact CD1-CG 4.33Å; I682-L700 HydrophobicContact CG1-CD1 4.47Å; L700-F714 HydrophobicContact CD1-CD2 4.43Å; L700-F714 HydrophobicContact CD1-CE2 4.35Å; L700-F714 HydrophobicContact CD2-CZ 4.39Å; L700-I745 HydrophobicContact CD2-CG1 4.37Å
701	D	71	Confident	67.4	Low	61 Å²	61	62.8 Å²	62.8	33%	0.326	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	107.9	161	-178	43.5	0	0	0	109.7	G743	D701-G743 WeakPolarHBondContact O-CA 3.48Å; D701-G743 PolarHBondContact O-N 2.81Å; D701-G743 WeakPolarHBondContact OD2-CA 2.9Å
702	C	67.4	Low	66.4	Low	12 Å²	12	67.7 Å²	67.7	8%	0.081	35%	0.353	C	S	.	.	B	Isolated β-bridge	trans	-83.4	126.6	169.4	-52.6	0	0	0	0	108.4	N678 G704 C706	N678-C702 WeakPolarHBondContact CB-O 3.13Å; N678-C702 WeakPolarHBondContact O-CA 3.29Å; N678-C702 WeakPolarHBondContact O-CB 3.14Å; N678-C702 PolarHBondContact O-N 2.69Å; C702-G704 CarbonylContact C-O 3.38Å; C702-G704 WeakPolarHBondContact CB-O 3.23Å; C702-G704 PolarHBondContact O-N 2.77Å; C702-C706 HydrophobicContact CB-CB 4.11Å; C702-C706 WeakPolarHBondContact CB-SG 3.46Å; C702-C706 WeakPolarHBondContact SG-CA 3.06Å; C702-C706 WeakPolarHBondContact SG-CB 3.44Å; C702-C706 CovalentContact SG-SG 2.04Å; C702-C706 PolarHBondContact SG-SG 3.5Å
703	K	60.1	Low	65.6	Low	137 Å²	137	73.6 Å²	73.6	60%	0.596	37%	0.367	S	S	*	.	S	Bend	trans	-74.1	43.1	175	-73.1	178.3	170.6	154.4	0	113	V742	K703-V742 WeakPolarHBondContact CD-O 3.45Å; K703-V742 WeakPolarHBondContact CE-O 3.43Å; K703-V742 PolarHBondContact NZ-O 2.97Å
704	G	74.5	Confident	64.7	Low	22 Å²	22	72.4 Å²	72.4	23%	0.227	37%	0.365	C	S	.	.	S	Bend	trans	152.1	-176.7	-168.2	0	0	0	0	0	110.6	C702 C706	C702-G704 CarbonylContact C-O 3.38Å; C702-G704 WeakPolarHBondContact CB-O 3.23Å; C702-G704 PolarHBondContact O-N 2.77Å; G704-C706 PolarHBondContact O-N 2.84Å
705	P	75.7	Confident	63.7	Low	96 Å²	96	71.9 Å²	71.9	62%	0.623	37%	0.371	S	S	*	.			trans	-58	122.7	-175.5	21.3	-32.5	0	0	0	113.1	T677 T707 N710	T677-P705 CarbonylContact O-C 3.55Å; T677-P705 VanDerWaalsContact O-CA 3.32Å; T677-P705 WeakPolarHBondContact O-CA 3.37Å; P705-T707 WeakPolarHBondContact O-CG2 3.27Å; P705-T707 PolarHBondContact O-N 2.74Å; P705-N710 PolarHBondContact O-ND2 2.84Å
706	C	65.7	Low	62.7	Low	11 Å²	11	75.5 Å²	75.5	7%	0.074	39%	0.386	C	S	.	.			trans	-69.6	87.9	177.1	-73.2	0	0	0	0	111.9	L674 T677 N678 M680 C702 G704	L674-C706 HydrophobicContact CD1-CB 4.25Å; L674-C706 HydrophobicContact CG-CB 4.46Å; T677-C706 PolarHBondContact O-N 3.49Å; N678-C706 PolarHBondContact O-SG 3.38Å; N678-C706 VanDerWaalsContact O-SG 3.37Å; M680-C706 HydrophobicContact CB-CB 4.42Å; M680-C706 HydrophobicContact CE-CB 4.2Å; C702-C706 HydrophobicContact CB-CB 4.11Å; C702-C706 WeakPolarHBondContact CB-SG 3.46Å; C702-C706 WeakPolarHBondContact SG-CA 3.06Å; C702-C706 WeakPolarHBondContact SG-CB 3.44Å; C702-C706 CovalentContact SG-SG 2.04Å; C702-C706 PolarHBondContact SG-SG 3.5Å; G704-C706 PolarHBondContact O-N 2.84Å
707	T	74.9	Confident	61.5	Low	63 Å²	63	77.3 Å²	77.3	39%	0.387	40%	0.397	S	S	.	.			trans	-83.3	161.2	177.9	87.1	0	0	0	0	113	P705 A709 N710	P705-T707 WeakPolarHBondContact O-CG2 3.27Å; P705-T707 PolarHBondContact O-N 2.74Å; T707-A709 PolarHBondContact O-N 3.29Å; T707-A709 VanDerWaalsContact O-N 3.16Å; T707-A709 WeakPolarHBondContact OG1-CB 3.37Å; T707-A709 PolarHBondContact OG1-N 2.61Å; T707-A709 VanDerWaalsContact OG1-N 3.08Å; T707-N710 PolarHBondContact N-ND2 3.29Å; T707-N710 WeakPolarHBondContact O-CB 3.43Å; T707-N710 PolarHBondContact O-N 3.38Å; T707-N710 PolarHBondContact OG1-N 3.12Å; T707-N710 PolarHBondContact OG1-OD1 3.06Å
708	K	66.7	Low	59.8	Low	148 Å²	148	81.6 Å²	81.6	64%	0.643	42%	0.418	S	S	*	.	H	α-helix	trans	-62.2	-17.4	171.4	-159.3	173.6	-173.6	174.4	0	113.4	Y672 K712	Y672-K708 WeakPolarHBondContact OH-CE 3.42Å; K708-K712 PolarHBondContact O-N 2.92Å
709	A	66	Low	58.2	Low	63 Å²	63	90.4 Å²	90.4	52%	0.521	46%	0.456	S	S	.	.	H	α-helix	trans	-78.1	-32.9	172.8	0	0	0	0	0	112.3	T707 Y711 K712 R713	T707-A709 PolarHBondContact O-N 3.29Å; T707-A709 VanDerWaalsContact O-N 3.16Å; T707-A709 WeakPolarHBondContact OG1-CB 3.37Å; T707-A709 PolarHBondContact OG1-N 2.61Å; T707-A709 VanDerWaalsContact OG1-N 3.08Å; A709-Y711 VanDerWaalsContact C-N 3.35Å; A709-Y711 PolarHBondContact O-N 3.21Å; A709-K712 PolarHBondContact O-N 2.75Å; A709-R713 PolarHBondContact O-N 3.18Å
710	N	64.1	Low	56.6	Low	59 Å²	59	91.6 Å²	91.6	32%	0.316	47%	0.467	S	S	.	.	H	α-helix	trans	-59.3	-49.2	175.7	-53.1	18.5	0	0	0	109.3	P705 T707 K712 R713	P705-N710 PolarHBondContact O-ND2 2.84Å; T707-N710 PolarHBondContact N-ND2 3.29Å; T707-N710 WeakPolarHBondContact O-CB 3.43Å; T707-N710 PolarHBondContact O-N 3.38Å; T707-N710 PolarHBondContact OG1-N 3.12Å; T707-N710 PolarHBondContact OG1-OD1 3.06Å; N710-K712 PolarHBondContact O-N 2.95Å; N710-R713 PolarHBondContact O-N 3.4Å
711	Y	56.8	Low	55.1	Low	54 Å²	54	94.5 Å²	94.5	21%	0.212	49%	0.487	C	S	.	.	H	α-helix	trans	-56.1	-44.4	174	172	-94.4	0	0	0	113	V670 I682 A709 R713 F714 S715	V670-Y711 HydrophobicContact CG1-CE2 4.12Å; V670-Y711 WeakPolarHBondContact CG1-OH 3.37Å; I682-Y711 HydrophobicContact CD1-CD2 3.77Å; I682-Y711 HydrophobicContact CD1-CE2 4.1Å; I682-Y711 HydrophobicContact CG1-CD2 4.47Å; I682-Y711 HydrophobicContact CG2-CE2 4.47Å; A709-Y711 VanDerWaalsContact C-N 3.35Å; A709-Y711 PolarHBondContact O-N 3.21Å; Y711-R713 PolarHBondContact O-N 2.96Å; Y711-F714 PolarHBondContact O-N 2.88Å; Y711-F714 VanDerWaalsContact O-N 3.12Å; Y711-S715 PolarHBondContact O-N 3.1Å
712	K	54.9	Low	53.6	Low	151 Å²	151	95.7 Å²	95.7	66%	0.657	49%	0.492	S	S	*	.	H	α-helix	trans	-58.7	-33.4	-178.2	-102.9	-168.9	173.5	-170.9	0	112.9	K708 A709 N710 S715	K708-K712 PolarHBondContact O-N 2.92Å; A709-K712 PolarHBondContact O-N 2.75Å; N710-K712 PolarHBondContact O-N 2.95Å; K712-S715 PolarHBondContact O-N 3.19Å; K712-S715 PolarHBondContact O-OG 3.16Å
713	R	51	Low	52.2	Low	200 Å²	200	100.6 Å²	100.6	76%	0.755	52%	0.517	S	S	*	.	H	α-helix	trans	-63.1	-41.4	176.6	-73.3	-175.2	172.5	174	-1.7	112.5	A709 N710 Y711	A709-R713 PolarHBondContact O-N 3.18Å; N710-R713 PolarHBondContact O-N 3.4Å; Y711-R713 PolarHBondContact O-N 2.96Å
714	F	44.5	Very low	51.2	Low	96 Å²	96	99 Å²	99	42%	0.421	51%	0.512	S	S	.	.	H	α-helix	trans	-68.1	-33.4	177.2	-74.2	-83.2	0	0	0	112.9	L700 Y711 V716 V717 V742	L700-F714 HydrophobicContact CD1-CD2 4.43Å; L700-F714 HydrophobicContact CD1-CE2 4.35Å; L700-F714 HydrophobicContact CD2-CZ 4.39Å; Y711-F714 PolarHBondContact O-N 2.88Å; Y711-F714 VanDerWaalsContact O-N 3.12Å; F714-V716 PolarHBondContact O-N 2.72Å; F714-V717 PolarHBondContact O-N 3.42Å; F714-V742 HydrophobicContact CZ-CG1 4.36Å; F714-V742 HydrophobicContact CZ-CG2 4.45Å
715	S	41.4	Very low	49.5	Very low	74 Å²	74	101.7 Å²	101.7	52%	0.517	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-2.7	-179.3	68.3	0	0	0	0	116.2	Y711 K712	Y711-S715 PolarHBondContact O-N 3.1Å; K712-S715 PolarHBondContact O-N 3.19Å; K712-S715 PolarHBondContact O-OG 3.16Å
716	V	40.4	Very low	47.7	Very low	110 Å²	110	100.6 Å²	100.6	67%	0.667	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	-12.2	-178.2	-178.4	0	0	0	0	112.8	F714 K718	F714-V716 PolarHBondContact O-N 2.72Å; V716-K718 PolarHBondContact O-N 2.89Å
717	V	39.2	Very low	46.2	Very low	93 Å²	93	108.3 Å²	108.3	56%	0.564	54%	0.536	S	S	*	.			trans	-71.5	92	-178.8	-174.4	0	0	0	0	110.8	F714	F714-V717 PolarHBondContact O-N 3.42Å
718	K	32.5	Very low	44.2	Very low	189 Å²	189	112.3 Å²	112.3	82%	0.822	55%	0.554	S	S	*	*			trans	-73.3	123.6	178.2	-74.9	-179.1	176.4	176.5	0	111.7	V716 S720	V716-K718 PolarHBondContact O-N 2.89Å; K718-S720 VanDerWaalsContact C-N 3.27Å; K718-S720 PolarHBondContact O-N 3.3Å
719	K	36.5	Very low	42.7	Very low	215 Å²	215	109.8 Å²	109.8	94%	0.935	55%	0.551	S	S	*	*	S	Bend	trans	60.5	0.2	156.5	-73.4	-165.9	171.2	-169.5	0	119.6
720	S	35.8	Very low	41.1	Very low	56 Å²	56	112.9 Å²	112.9	39%	0.392	56%	0.558	S	S	.	*			trans	-62.1	136.8	169.4	-72.7	0	0	0	0	111.5	K718 E724	K718-S720 VanDerWaalsContact C-N 3.27Å; K718-S720 PolarHBondContact O-N 3.3Å; S720-E724 PolarHBondContact OG-OE2 3.09Å
721	P	37.2	Very low	39.4	Very low	75 Å²	75	116.4 Å²	116.4	49%	0.487	58%	0.576	S	S	.	*			trans	-69.8	147.1	173.5	30.4	-34	0	0	0	110.4	I723 E724	P721-I723 PolarHBondContact O-N 2.69Å; P721-E724 HydrophobicContact CG-CG 4.34Å; P721-E724 PolarHBondContact O-N 3.25Å
722	L	40.4	Very low	38	Very low	85 Å²	85	120.9 Å²	120.9	45%	0.445	60%	0.599	S	S	.	*	H	α-helix	trans	-53.5	-26.2	-179	-148.8	84	0	0	0	113.3	E724 I725 L726	L722-E724 VanDerWaalsContact C-N 3.33Å; L722-E724 PolarHBondContact O-N 2.88Å; L722-I725 PolarHBondContact O-N 2.83Å; L722-I725 VanDerWaalsContact O-N 3.17Å; L722-L726 HydrophobicContact CD2-CD1 4.03Å; L722-L726 HydrophobicContact CG-CD1 4.02Å; L722-L726 WeakPolarHBondContact O-CD1 3.4Å; L722-L726 PolarHBondContact O-N 3.14Å
723	I	39.1	Very low	36.7	Very low	115 Å²	115	118.2 Å²	118.2	59%	0.59	61%	0.605	S	S	*	*	H	α-helix	trans	-61.6	-33.2	177.9	-65.9	168.7	0	0	0	112.6	P721 R727	P721-I723 PolarHBondContact O-N 2.69Å; I723-R727 WeakPolarHBondContact O-CB 3.32Å; I723-R727 WeakPolarHBondContact O-CG 3.04Å; I723-R727 PolarHBondContact O-N 3.4Å
724	E	37.8	Very low	35.6	Very low	105 Å²	105	114.7 Å²	114.7	49%	0.491	61%	0.608	S	S	.	*	H	α-helix	trans	-70.6	-38.8	173.4	-76.1	-167.6	138.6	0	0	111.7	S720 P721 L722 R727 L728	S720-E724 PolarHBondContact OG-OE2 3.09Å; P721-E724 HydrophobicContact CG-CG 4.34Å; P721-E724 PolarHBondContact O-N 3.25Å; L722-E724 VanDerWaalsContact C-N 3.33Å; L722-E724 PolarHBondContact O-N 2.88Å; E724-R727 PolarHBondContact O-N 3.18Å; E724-L728 WeakPolarHBondContact O-CB 3.13Å; E724-L728 PolarHBondContact O-N 2.98Å
725	I	39	Very low	34.7	Very low	78 Å²	78	115.2 Å²	115.2	40%	0.4	62%	0.619	S	S	.	*	H	α-helix	trans	-68.3	-38.7	179.4	-58.2	178	0	0	0	110.3	L722 V729	L722-I725 PolarHBondContact O-N 2.83Å; L722-I725 VanDerWaalsContact O-N 3.17Å; I725-V729 WeakPolarHBondContact O-CG2 3.36Å; I725-V729 PolarHBondContact O-N 2.76Å
726	L	38.1	Very low	33.9	Very low	73 Å²	73	117.7 Å²	117.7	38%	0.382	63%	0.631	S	S	.	*	H	α-helix	trans	-67.4	-40.1	171.6	-90.9	79.4	0	0	0	112.3	L722 L728 V729 L730	L722-L726 HydrophobicContact CD2-CD1 4.03Å; L722-L726 HydrophobicContact CG-CD1 4.02Å; L722-L726 WeakPolarHBondContact O-CD1 3.4Å; L722-L726 PolarHBondContact O-N 3.14Å; L726-L728 VanDerWaalsContact C-N 3.34Å; L726-L728 PolarHBondContact O-N 3.04Å; L726-V729 PolarHBondContact O-N 3.27Å; L726-V729 VanDerWaalsContact O-N 3.09Å; L726-L730 HydrophobicContact CB-CD1 4.32Å; L726-L730 HydrophobicContact CD2-CD1 4.36Å; L726-L730 WeakPolarHBondContact O-CB 3.17Å; L726-L730 PolarHBondContact O-N 2.82Å
727	R	34.5	Very low	33.2	Very low	173 Å²	173	118.6 Å²	118.6	65%	0.653	64%	0.637	S	S	*	*	H	α-helix	trans	-61.4	-40.3	176	-84.2	-179.2	167	-178.7	-4.5	112.7	I723 E724 V729 L731	I723-R727 WeakPolarHBondContact O-CB 3.32Å; I723-R727 WeakPolarHBondContact O-CG 3.04Å; I723-R727 PolarHBondContact O-N 3.4Å; E724-R727 PolarHBondContact O-N 3.18Å; R727-V729 PolarHBondContact O-N 2.94Å; R727-L731 PolarHBondContact O-N 2.81Å
728	L	32.3	Very low	32.5	Very low	147 Å²	147	123.5 Å²	123.5	77%	0.77	65%	0.651	S	S	*	*	H	α-helix	trans	-69	-5.1	174.8	-82.3	162.6	0	0	0	114.6	E724 L726	E724-L728 WeakPolarHBondContact O-CB 3.13Å; E724-L728 PolarHBondContact O-N 2.98Å; L726-L728 VanDerWaalsContact C-N 3.34Å; L726-L728 PolarHBondContact O-N 3.04Å
729	V	34.7	Very low	32.5	Very low	95 Å²	95	119.1 Å²	119.1	58%	0.576	64%	0.644	S	S	*	*	H	α-helix	trans	-116.9	-21.6	-179.8	172.6	0	0	0	0	112.5	I725 L726 R727	I725-V729 WeakPolarHBondContact O-CG2 3.36Å; I725-V729 PolarHBondContact O-N 2.76Å; L726-V729 PolarHBondContact O-N 3.27Å; L726-V729 VanDerWaalsContact O-N 3.09Å; R727-V729 PolarHBondContact O-N 2.94Å
730	L	33.4	Very low	32.5	Very low	128 Å²	128	113.1 Å²	113.1	67%	0.67	63%	0.629	S	S	*	*	H	α-helix	trans	-109.9	-3.3	-174.2	-68.7	168.4	0	0	0	114.9	L726	L726-L730 HydrophobicContact CB-CD1 4.32Å; L726-L730 HydrophobicContact CD2-CD1 4.36Å; L726-L730 WeakPolarHBondContact O-CB 3.17Å; L726-L730 PolarHBondContact O-N 2.82Å
731	L	28.4	Very low	32.7	Very low	133 Å²	133	115 Å²	115	70%	0.696	64%	0.635	S	S	*	*	S	Bend	trans	-138	58.3	-175.2	-75.2	170.9	0	0	0	113.2	R727	R727-L731 PolarHBondContact O-N 2.81Å
732	E	27.7	Very low	32.5	Very low	147 Å²	147	114 Å²	114	69%	0.687	63%	0.628	S	S	*	*			trans	-153.5	114.3	160.5	-135.5	171.7	-115.7	0	0	114.1
733	A	27.3	Very low	32.3	Very low	95 Å²	95	110.9 Å²	110.9	79%	0.785	62%	0.615	S	S	*	*			trans	-150.1	136.1	158.4	0	0	0	0	0	108.6
734	P	27.3	Very low	32	Very low	127 Å²	127	111.6 Å²	111.6	83%	0.825	62%	0.62	S	S	*	*	S	Bend	cis	-125.9	97.5	-3.6	35.7	-16.5	0	0	0	113
735	T	26.1	Very low	31.8	Very low	107 Å²	107	109.6 Å²	109.6	66%	0.656	61%	0.612	S	S	*	*			trans	-134.6	142.8	166.3	38.1	0	0	0	0	112.5
736	T	23.8	Very low	31.8	Very low	125 Å²	125	108.8 Å²	108.8	77%	0.767	61%	0.611	S	S	*	*			trans	-82.6	116.2	-168.2	50.1	0	0	0	0	114
737	V	25.1	Very low	31.7	Very low	130 Å²	130	107.8 Å²	107.8	79%	0.788	61%	0.613	S	S	*	*			trans	-130	95.1	156.4	-174.6	0	0	0	0	110	S739	V737-S739 PolarHBondContact O-N 2.83Å
738	F	25	Very low	31.8	Very low	196 Å²	196	102.4 Å²	102.4	86%	0.86	61%	0.611	S	S	*	*			trans	-75.4	118.1	177.2	-96.4	-96.2	0	0	0	111.9
739	S	32.2	Very low	32.1	Very low	96 Å²	96	99.9 Å²	99.9	67%	0.671	60%	0.598	S	S	*	*			trans	-115.3	109.2	155.6	-174.9	0	0	0	0	108.7	V737 N741	V737-S739 PolarHBondContact O-N 2.83Å; S739-N741 VanDerWaalsContact C-N 3.28Å; S739-N741 PolarHBondContact O-N 2.94Å
740	S	36.9	Very low	32.5	Very low	89 Å²	89	98.6 Å²	98.6	62%	0.622	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	-2.3	-156.1	46.6	0	0	0	0	117.2
741	N	40	Very low	32.8	Very low	96 Å²	96	92.9 Å²	92.9	51%	0.513	56%	0.562	S	S	.	*	T	Hydrogen-bonded Turn	trans	-121.4	0.6	-157.2	-64.5	-77.5	0	0	0	117.1	S739	S739-N741 VanDerWaalsContact C-N 3.28Å; S739-N741 PolarHBondContact O-N 2.94Å
742	V	34.4	Very low	33.4	Very low	55 Å²	55	93 Å²	93	33%	0.333	56%	0.563	S	S	.	*	B	Isolated β-bridge	trans	-125.6	139.2	-174.4	-170	0	0	0	0	111.3	K703 F714	K703-V742 WeakPolarHBondContact CD-O 3.45Å; K703-V742 WeakPolarHBondContact CE-O 3.43Å; K703-V742 PolarHBondContact NZ-O 2.97Å; F714-V742 HydrophobicContact CZ-CG1 4.36Å; F714-V742 HydrophobicContact CZ-CG2 4.45Å
743	G	35.8	Very low	34	Very low	18 Å²	18	94.5 Å²	94.5	19%	0.186	56%	0.564	C	S	.	*			trans	-97.4	-159.6	175.4	0	0	0	0	0	113.3	D701	D701-G743 WeakPolarHBondContact O-CA 3.48Å; D701-G743 PolarHBondContact O-N 2.81Å; D701-G743 WeakPolarHBondContact OD2-CA 2.9Å
744	L	32.4	Very low	34.4	Very low	130 Å²	130	93.1 Å²	93.1	68%	0.681	55%	0.546	S	S	*	.			trans	-65.1	140.6	-174.3	-162.9	74.2	0	0	0	111.6	T746	L744-T746 HydrophobicContact CD2-CG2 4.42Å
745	I	34.3	Very low	34.6	Very low	64 Å²	64	95.6 Å²	95.6	33%	0.328	55%	0.547	S	S	.	.			trans	-112.2	101.9	173.3	-55.9	175.7	0	0	0	108.4	I698 L700	I698-I745 HydrophobicContact CG2-CG2 4.44Å; L700-I745 HydrophobicContact CD2-CG1 4.37Å
746	T	38.6	Very low	35.1	Very low	61 Å²	61	102.1 Å²	102.1	37%	0.374	56%	0.559	S	S	.	*			trans	-87	113.2	168.1	26.1	0	0	0	0	109.8	L744	L744-T746 HydrophobicContact CD2-CG2 4.42Å
747	A	34.7	Very low	35.6	Very low	52 Å²	52	102.8 Å²	102.8	43%	0.43	56%	0.556	S	S	.	*	P	Polyproline II helix	trans	-95.8	145.9	173.6	0	0	0	0	0	110.6
748	G	38.3	Very low	36.7	Very low	60 Å²	60	98.4 Å²	98.4	62%	0.619	54%	0.538	S	S	*	.	P	Polyproline II helix	trans	-64	132.3	-164	0	0	0	0	0	116
749	L	38.4	Very low	38.6	Very low	94 Å²	94	95 Å²	95	49%	0.492	52%	0.524	S	S	.	.	P	Polyproline II helix	trans	-99.5	139.9	162.1	-71	165.5	0	0	0	109.2
750	P	41.9	Very low	40.1	Very low	67 Å²	67	91.1 Å²	91.1	44%	0.435	50%	0.498	S	S	.	.	P	Polyproline II helix	trans	-70.3	146.6	164.6	30.9	-32	0	0	0	109.7	N752 Y753	P750-N752 PolarHBondContact O-N 3.02Å; P750-Y753 HydrophobicContact CG-CD2 4.3Å; P750-Y753 PolarHBondContact O-N 2.88Å
751	C	40.3	Very low	41.7	Very low	8 Å²	8	89.4 Å²	89.4	5%	0.054	48%	0.481	C	S	.	.	G	3₁₀ helix	trans	-62.7	-12.3	-177.4	-55.3	0	0	0	0	114.1	Y753 C771 W781	C751-Y753 VanDerWaalsContact C-N 3.25Å; C751-Y753 PolarHBondContact O-N 2.83Å; C751-C771 HydrophobicContact CB-CB 3.97Å; C751-C771 WeakPolarHBondContact CB-SG 3.22Å; C751-C771 WeakPolarHBondContact SG-CB 3.12Å; C751-C771 CovalentContact SG-SG 2.05Å; C751-C771 PolarHBondContact SG-SG 3.22Å; C751-W781 VanDerWaalsContact SG-CZ2 3.53Å
752	N	41.7	Very low	43.3	Very low	135 Å²	135	87.9 Å²	87.9	72%	0.722	48%	0.477	S	S	*	.	G	3₁₀ helix	trans	-83.8	16.4	176.5	-160.2	26	0	0	0	113.9	P750	P750-N752 PolarHBondContact O-N 3.02Å
753	Y	39.5	Very low	44.8	Very low	179 Å²	179	87.9 Å²	87.9	70%	0.702	48%	0.477	S	S	*	.	G	3₁₀ helix	trans	-124.8	3.3	-176.5	-125.5	-80.3	0	0	0	114.9	P750 C751	P750-Y753 HydrophobicContact CG-CD2 4.3Å; P750-Y753 PolarHBondContact O-N 2.88Å; C751-Y753 VanDerWaalsContact C-N 3.25Å; C751-Y753 PolarHBondContact O-N 2.83Å
754	T	35.9	Very low	46.9	Very low	66 Å²	66	90.8 Å²	90.8	41%	0.405	49%	0.488	S	S	.	.			trans	-95.8	101.7	177.5	49.9	0	0	0	0	110.8	R756	T754-R756 PolarHBondContact O-N 2.78Å
755	E	32.1	Very low	49.1	Very low	180 Å²	180	92.5 Å²	92.5	84%	0.841	49%	0.49	S	S	*	.			trans	-74	106.1	178.6	-68.8	-159.7	110.1	0	0	112.6	I757	E755-I757 VanDerWaalsContact C-N 3.3Å; E755-I757 PolarHBondContact O-N 2.9Å
756	R	35.9	Very low	51.3	Low	243 Å²	243	91.8 Å²	91.8	92%	0.917	49%	0.489	S	S	*	.	S	Bend	trans	62	-16.7	148	-66.9	-173.8	170.5	-159.5	-3.6	121.4	T754	T754-R756 PolarHBondContact O-N 2.78Å
757	I	34.4	Very low	53.1	Low	139 Å²	139	91.5 Å²	91.5	71%	0.713	48%	0.483	S	S	*	.	S	Bend	trans	-121	102	-179.7	-52.2	-177.5	0	0	0	111.2	E755	E755-I757 VanDerWaalsContact C-N 3.3Å; E755-I757 PolarHBondContact O-N 2.9Å
758	G	48.6	Very low	55.4	Low	38 Å²	38	89.7 Å²	89.7	39%	0.392	47%	0.466	S	S	.	.			trans	81.3	112.2	169.5	0	0	0	0	0	115.2	A760	G758-A760 PolarHBondContact O-N 3.32Å
759	H	64	Low	57.1	Low	125 Å²	125	88 Å²	88	58%	0.579	44%	0.442	S	S	*	.	S	Bend	trans	-75.2	15	-179.9	-65.1	-68	0	0	0	115	T770	H759-T770 WeakPolarHBondContact O-CA 3.42Å; H759-T770 WeakPolarHBondContact O-CG2 3.44Å
760	A	65.1	Low	58.8	Low	15 Å²	15	84.6 Å²	84.6	12%	0.124	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	119.5	-169.4	0	0	0	0	0	113.3	G758 F768 L769 T770 F792 A797	G758-A760 PolarHBondContact O-N 3.32Å; A760-F768 HydrophobicContact CB-CB 4.38Å; A760-F768 HydrophobicContact CB-CD2 3.48Å; A760-F768 VanDerWaalsContact CB-CD2 3.48Å; A760-F768 HydrophobicContact CB-CE2 4.03Å; A760-F768 HydrophobicContact CB-CG 4.22Å; A760-L769 CarbonylContact C-O 3.59Å; A760-L769 WeakPolarHBondContact CA-O 3.31Å; A760-T770 HydrophobicContact CB-CG2 4.18Å; A760-F792 HydrophobicContact CB-CE2 3.81Å; A760-F792 HydrophobicContact CB-CZ 3.66Å; A760-A797 HydrophobicContact CB-CB 3.6Å
761	I	69.1	Low	60	Low	52 Å²	52	82.5 Å²	82.5	27%	0.267	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	119	173.6	-57.5	-179.3	0	0	0	109.4	F768 L769 W781	I761-F768 CarbonylContact O-C 3.53Å; I761-F768 VanDerWaalsContact O-CA 3.27Å; I761-F768 WeakPolarHBondContact O-CA 3.41Å; I761-L769 HydrophobicContact CB-CB 4.44Å; I761-L769 PolarHBondContact N-O 2.76Å; I761-L769 PolarHBondContact O-N 3.12Å; I761-W781 HydrophobicContact CD1-CH2 3.63Å; I761-W781 HydrophobicContact CD1-CZ3 3.86Å; I761-W781 HydrophobicContact CG1-CH2 4.5Å; I761-W781 HydrophobicContact CG1-CZ3 4.33Å
762	P	74	Confident	61	Low	65 Å²	65	85.9 Å²	85.9	42%	0.422	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	136.9	174.5	25.5	-31.6	0	0	0	111.5	F792	P762-F792 HydrophobicContact CB-CD1 3.78Å; P762-F792 HydrophobicContact CB-CE1 3.69Å; P762-F792 HydrophobicContact CG-CD1 4.49Å; P762-F792 HydrophobicContact CG-CE1 4.01Å
763	T	67	Low	61.8	Low	54 Å²	54	84.2 Å²	84.2	33%	0.331	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	-29.9	172.8	59.8	0	0	0	0	112.4	H767 L769	T763-H767 PolarHBondContact N-O 3.19Å; T763-H767 VanDerWaalsContact OG1-CB 3.23Å; T763-H767 WeakPolarHBondContact OG1-CB 3.48Å; T763-H767 PolarHBondContact OG1-O 3.05Å; T763-L769 HydrophobicContact CG2-CD1 3.45Å; T763-L769 VanDerWaalsContact CG2-CD1 3.45Å; T763-L769 HydrophobicContact CG2-CG 3.7Å
764	N	78.2	Confident	62.1	Low	80 Å²	80	80.6 Å²	80.6	43%	0.428	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157	-174.2	164.8	64.6	59	0	0	0	109.3	T766 H767	N764-T766 PolarHBondContact O-N 3.08Å; N764-T766 PolarHBondContact OD1-N 2.61Å; N764-T766 PolarHBondContact OD1-OG1 3.01Å; N764-T766 VanDerWaalsContact OD1-OG1 3.09Å; N764-H767 PolarHBondContact N-O 3.17Å; N764-H767 PolarHBondContact ND2-ND1 2.91Å; N764-H767 PolarHBondContact O-N 3.38Å; N764-H767 PolarHBondContact OD1-N 2.95Å; N764-H767 VanDerWaalsContact OD1-N 3.15Å; N764-H767 PolarHBondContact OD1-ND1 3.04Å; N764-H767 VanDerWaalsContact OD1-ND1 3.1Å
765	K	80.4	Confident	62.7	Low	165 Å²	165	85.1 Å²	85.1	72%	0.717	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-21.9	-178	-73.1	-169.5	175.8	-172.8	0	115.3	L791 F792	K765-L791 HydrophobicContact CB-CD2 3.9Å; K765-L791 HydrophobicContact CD-CD2 4.19Å; K765-L791 HydrophobicContact CG-CD2 4.47Å; K765-L791 WeakPolarHBondContact O-CA 3.32Å; K765-F792 PolarHBondContact O-N 3.18Å
766	T	79.9	Confident	63.2	Low	49 Å²	49	82.1 Å²	82.1	30%	0.301	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125	6.5	-174.5	62.7	0	0	0	0	113.6	N764 S785 C786	N764-T766 PolarHBondContact O-N 3.08Å; N764-T766 PolarHBondContact OD1-N 2.61Å; N764-T766 PolarHBondContact OD1-OG1 3.01Å; N764-T766 VanDerWaalsContact OD1-OG1 3.09Å; T766-S785 CarbonylContact O-C 3.09Å; T766-S785 WeakPolarHBondContact O-CA 3.48Å; T766-C786 PolarHBondContact O-N 3.3Å
767	H	76.6	Confident	63.7	Low	56 Å²	56	75 Å²	75	26%	0.259	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	136.5	-175.1	-68	72	0	0	0	112.7	T763 N764 H784 S785	T763-H767 PolarHBondContact N-O 3.19Å; T763-H767 VanDerWaalsContact OG1-CB 3.23Å; T763-H767 WeakPolarHBondContact OG1-CB 3.48Å; T763-H767 PolarHBondContact OG1-O 3.05Å; N764-H767 PolarHBondContact N-O 3.17Å; N764-H767 PolarHBondContact ND2-ND1 2.91Å; N764-H767 PolarHBondContact O-N 3.38Å; N764-H767 PolarHBondContact OD1-N 2.95Å; N764-H767 VanDerWaalsContact OD1-N 3.15Å; N764-H767 PolarHBondContact OD1-ND1 3.04Å; N764-H767 VanDerWaalsContact OD1-ND1 3.1Å; H767-H784 VanDerWaalsContact CA-O 3.28Å; H767-H784 WeakPolarHBondContact CA-O 3.49Å; H767-S785 PolarHBondContact CD2-OG 3.16Å; H767-S785 PolarHBondContact NE2-OG 2.79Å
768	F	82.3	Confident	63.9	Low	13 Å²	13	74 Å²	74	6%	0.057	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	165.2	177.9	66.2	-86.9	0	0	0	112.8	A760 I761 T770 I783 H784 F792	A760-F768 HydrophobicContact CB-CB 4.38Å; A760-F768 HydrophobicContact CB-CD2 3.48Å; A760-F768 VanDerWaalsContact CB-CD2 3.48Å; A760-F768 HydrophobicContact CB-CE2 4.03Å; A760-F768 HydrophobicContact CB-CG 4.22Å; I761-F768 CarbonylContact O-C 3.53Å; I761-F768 VanDerWaalsContact O-CA 3.27Å; I761-F768 WeakPolarHBondContact O-CA 3.41Å; F768-T770 HydrophobicContact CD2-CG2 4.06Å; F768-T770 HydrophobicContact CE2-CG2 3.87Å; F768-I783 WeakPolarHBondContact O-CA 3.39Å; F768-H784 HydrophobicContact CD1-CB 3.82Å; F768-H784 HydrophobicContact CD2-CB 3.99Å; F768-H784 AromaticContact CD2-CD2 3.75Å; F768-H784 HydrophobicContact CE1-CB 3.43Å; F768-H784 VanDerWaalsContact CE1-CB 3.43Å; F768-H784 HydrophobicContact CE2-CB 3.65Å; F768-H784 AromaticContact CE2-CD2 3.35Å; F768-H784 WeakPolarHBondContact CE2-CD2 3.44Å; F768-H784 AromaticContact CE2-CG 3.57Å; F768-H784 HydrophobicContact CG-CB 4.1Å; F768-H784 HydrophobicContact CZ-CB 3.36Å; F768-H784 AromaticContact CZ-CD2 3.9Å; F768-H784 AromaticContact CZ-CG 3.61Å; F768-H784 PolarHBondContact N-O 2.85Å; F768-H784 VanDerWaalsContact N-O 3.08Å; F768-H784 PolarHBondContact O-N 2.96Å; F768-F792 HydrophobicContact CB-CD2 3.81Å; F768-F792 HydrophobicContact CB-CE2 3.55Å; F768-F792 HydrophobicContact CB-CG 4.38Å; F768-F792 HydrophobicContact CB-CZ 3.94Å; F768-F792 AromaticContact CD1-CD2 3.35Å; F768-F792 HydrophobicContact CD1-CD2 3.35Å; F768-F792 AromaticContact CD1-CE2 3.6Å; F768-F792 HydrophobicContact CD1-CE2 3.6Å; F768-F792 HydrophobicContact CD1-CG 4.33Å; F768-F792 HydrophobicContact CD2-CD2 4.5Å; F768-F792 AromaticContact CD2-CE2 3.9Å; F768-F792 HydrophobicContact CD2-CE2 3.9Å; F768-F792 AromaticContact CE1-CD2 3.96Å; F768-F792 HydrophobicContact CE1-CD2 3.96Å; F768-F792 HydrophobicContact CE1-CE2 4.19Å; F768-F792 HydrophobicContact CE2-CE2 4.43Å; F768-F792 AromaticContact CG-CD2 3.65Å; F768-F792 HydrophobicContact CG-CD2 3.65Å; F768-F792 AromaticContact CG-CE2 3.42Å; F768-F792 HydrophobicContact CG-CE2 3.42Å; F768-F792 VanDerWaalsContact CG-CE2 3.42Å; F768-F792 HydrophobicContact CG-CZ 4.25Å
769	L	74.4	Confident	64	Low	24 Å²	24	72.5 Å²	72.5	13%	0.126	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	125.6	-177.1	-72.2	167.9	0	0	0	110.8	I699 A760 I761 T763 W781 T782 I783	I699-L769 HydrophobicContact CD1-CD1 4.2Å; A760-L769 CarbonylContact C-O 3.59Å; A760-L769 WeakPolarHBondContact CA-O 3.31Å; I761-L769 HydrophobicContact CB-CB 4.44Å; I761-L769 PolarHBondContact N-O 2.76Å; I761-L769 PolarHBondContact O-N 3.12Å; T763-L769 HydrophobicContact CG2-CD1 3.45Å; T763-L769 VanDerWaalsContact CG2-CD1 3.45Å; T763-L769 HydrophobicContact CG2-CG 3.7Å; L769-W781 HydrophobicContact CB-CE3 3.92Å; L769-W781 HydrophobicContact CB-CZ3 4.22Å; L769-T782 CarbonylContact C-O 3.59Å; L769-T782 WeakPolarHBondContact CA-O 3.4Å; L769-I783 HydrophobicContact CD2-CB 3.74Å; L769-I783 HydrophobicContact CD2-CD1 4.34Å; L769-I783 HydrophobicContact CD2-CG1 3.96Å
770	T	74.4	Confident	63.3	Low	24 Å²	24	70.3 Å²	70.3	15%	0.147	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	156.4	170.6	51.8	0	0	0	0	111.2	H759 A760 F768 W781 T782 H784	H759-T770 WeakPolarHBondContact O-CA 3.42Å; H759-T770 WeakPolarHBondContact O-CG2 3.44Å; A760-T770 HydrophobicContact CB-CG2 4.18Å; F768-T770 HydrophobicContact CD2-CG2 4.06Å; F768-T770 HydrophobicContact CE2-CG2 3.87Å; T770-W781 CarbonylContact O-C 3.2Å; T770-W781 VanDerWaalsContact O-CA 3.26Å; T770-W781 WeakPolarHBondContact O-CA 3.36Å; T770-W781 VanDerWaalsContact O-CE3 3.31Å; T770-T782 PolarHBondContact N-O 2.7Å; T770-T782 PolarHBondContact O-N 3.03Å; T770-T782 PolarHBondContact O-OG1 3.42Å; T770-T782 PolarHBondContact OG1-OG1 2.69Å; T770-H784 PolarHBondContact OG1-CD2 2.79Å; T770-H784 PolarHBondContact OG1-NE2 2.9Å
771	C	67.1	Low	63.1	Low	23 Å²	23	73.4 Å²	73.4	16%	0.155	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	120	171.8	-174.9	0	0	0	0	109.6	C751 H773 T780 W781	C751-C771 HydrophobicContact CB-CB 3.97Å; C751-C771 WeakPolarHBondContact CB-SG 3.22Å; C751-C771 WeakPolarHBondContact SG-CB 3.12Å; C751-C771 CovalentContact SG-SG 2.05Å; C751-C771 PolarHBondContact SG-SG 3.22Å; C771-H773 VanDerWaalsContact C-N 3.34Å; C771-H773 PolarHBondContact O-N 3.03Å; C771-T780 WeakPolarHBondContact CA-O 3.17Å; C771-W781 HydrophobicContact CB-CD2 4.1Å; C771-W781 HydrophobicContact CB-CE3 4.03Å; C771-W781 HydrophobicContact CB-CH2 4.13Å; C771-W781 HydrophobicContact CB-CZ2 4.19Å; C771-W781 HydrophobicContact CB-CZ3 4.05Å
772	D	60.9	Low	62.8	Low	78 Å²	78	73.1 Å²	73.1	42%	0.417	40%	0.404	S	S	.	.	S	Bend	trans	-77.8	-16.3	-166	-51.4	-58.6	0	0	0	113.9	T780 T782	D772-T780 PolarHBondContact N-O 2.81Å; D772-T780 PolarHBondContact OD2-OG1 3.36Å; D772-T782 PolarHBondContact OD1-OG1 3.05Å; D772-T782 WeakPolarHBondContact OD2-CG2 3.3Å; D772-T782 PolarHBondContact OD2-OG1 2.69Å
773	H	57.6	Low	62.8	Low	101 Å²	101	74 Å²	74	47%	0.468	40%	0.404	S	S	.	.			trans	-133.7	112.3	-173.7	-66.7	-19.1	0	0	0	112.5	C771 N775	C771-H773 VanDerWaalsContact C-N 3.34Å; C771-H773 PolarHBondContact O-N 3.03Å; H773-N775 PolarHBondContact O-N 2.75Å
774	L	46.5	Very low	63.3	Low	103 Å²	103	74.8 Å²	74.8	54%	0.539	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-15.2	-171.8	-84.1	160.7	0	0	0	116.1
775	N	48.2	Very low	63.5	Low	160 Å²	160	74.5 Å²	74.5	86%	0.856	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.5	0.8	-170.3	-71.8	-29.8	0	0	0	114.8	H773	H773-N775 PolarHBondContact O-N 2.75Å
776	E	43.8	Very low	63.7	Low	118 Å²	118	67.2 Å²	67.2	55%	0.551	38%	0.378	S	S	*	.			trans	-105.3	136.8	-178.5	-65.9	-162.5	157	0	0	112.5	C778 G779	E776-C778 PolarHBondContact O-N 2.8Å; E776-G779 PolarHBondContact O-N 2.81Å
777	A	44.5	Very low	63.8	Low	94 Å²	94	70.9 Å²	70.9	78%	0.777	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-14.9	177.2	0	0	0	0	0	114
778	C	38.6	Very low	63.3	Low	116 Å²	116	76.7 Å²	76.7	78%	0.784	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.5	41.3	-178.9	-67.2	0	0	0	0	112.1	E776	E776-C778 PolarHBondContact O-N 2.8Å
779	G	51.8	Low	63	Low	7 Å²	7	79.9 Å²	79.9	7%	0.072	46%	0.464	C	S	.	.	P	Polyproline II helix	trans	-52.4	146.1	178	0	0	0	0	0	113.7	E776	E776-G779 PolarHBondContact O-N 2.81Å
780	T	50.1	Low	63.3	Low	79 Å²	79	80.3 Å²	80.3	49%	0.485	47%	0.465	S	S	.	.	P	Polyproline II helix	trans	-69.1	133.5	177.7	47.5	0	0	0	0	110.9	C771 D772	C771-T780 WeakPolarHBondContact CA-O 3.17Å; D772-T780 PolarHBondContact N-O 2.81Å; D772-T780 PolarHBondContact OD2-OG1 3.36Å
781	W	60.1	Low	63.7	Low	81 Å²	81	83.8 Å²	83.8	31%	0.307	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	128.1	173	-70.7	85.5	0	0	0	110.4	L659 C751 I761 L769 T770 C771	L659-W781 WeakPolarHBondContact CD1-O 3.47Å; C751-W781 VanDerWaalsContact SG-CZ2 3.53Å; I761-W781 HydrophobicContact CD1-CH2 3.63Å; I761-W781 HydrophobicContact CD1-CZ3 3.86Å; I761-W781 HydrophobicContact CG1-CH2 4.5Å; I761-W781 HydrophobicContact CG1-CZ3 4.33Å; L769-W781 HydrophobicContact CB-CE3 3.92Å; L769-W781 HydrophobicContact CB-CZ3 4.22Å; T770-W781 CarbonylContact O-C 3.2Å; T770-W781 VanDerWaalsContact O-CA 3.26Å; T770-W781 WeakPolarHBondContact O-CA 3.36Å; T770-W781 VanDerWaalsContact O-CE3 3.31Å; C771-W781 HydrophobicContact CB-CD2 4.1Å; C771-W781 HydrophobicContact CB-CE3 4.03Å; C771-W781 HydrophobicContact CB-CH2 4.13Å; C771-W781 HydrophobicContact CB-CZ2 4.19Å; C771-W781 HydrophobicContact CB-CZ3 4.05Å
782	T	62.1	Low	64.4	Low	45 Å²	45	83.6 Å²	83.6	28%	0.276	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	128.1	176.9	23.8	0	0	0	0	109.1	L769 T770 D772	L769-T782 CarbonylContact C-O 3.59Å; L769-T782 WeakPolarHBondContact CA-O 3.4Å; T770-T782 PolarHBondContact N-O 2.7Å; T770-T782 PolarHBondContact O-N 3.03Å; T770-T782 PolarHBondContact O-OG1 3.42Å; T770-T782 PolarHBondContact OG1-OG1 2.69Å; D772-T782 PolarHBondContact OD1-OG1 3.05Å; D772-T782 WeakPolarHBondContact OD2-CG2 3.3Å; D772-T782 PolarHBondContact OD2-OG1 2.69Å
783	I	74.7	Confident	65.2	Low	84 Å²	84	81.6 Å²	81.6	43%	0.431	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	131.8	175.8	-168.8	171.1	0	0	0	110.2	F768 L769	F768-I783 WeakPolarHBondContact O-CA 3.39Å; L769-I783 HydrophobicContact CD2-CB 3.74Å; L769-I783 HydrophobicContact CD2-CD1 4.34Å; L769-I783 HydrophobicContact CD2-CG1 3.96Å
784	H	77.8	Confident	65.6	Low	70 Å²	70	81 Å²	81	32%	0.324	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	148.3	179.7	-58.7	-87.5	0	0	0	110.2	H767 F768 T770	H767-H784 VanDerWaalsContact CA-O 3.28Å; H767-H784 WeakPolarHBondContact CA-O 3.49Å; F768-H784 HydrophobicContact CD1-CB 3.82Å; F768-H784 HydrophobicContact CD2-CB 3.99Å; F768-H784 AromaticContact CD2-CD2 3.75Å; F768-H784 HydrophobicContact CE1-CB 3.43Å; F768-H784 VanDerWaalsContact CE1-CB 3.43Å; F768-H784 HydrophobicContact CE2-CB 3.65Å; F768-H784 AromaticContact CE2-CD2 3.35Å; F768-H784 WeakPolarHBondContact CE2-CD2 3.44Å; F768-H784 AromaticContact CE2-CG 3.57Å; F768-H784 HydrophobicContact CG-CB 4.1Å; F768-H784 HydrophobicContact CZ-CB 3.36Å; F768-H784 AromaticContact CZ-CD2 3.9Å; F768-H784 AromaticContact CZ-CG 3.61Å; F768-H784 PolarHBondContact N-O 2.85Å; F768-H784 VanDerWaalsContact N-O 3.08Å; F768-H784 PolarHBondContact O-N 2.96Å; T770-H784 PolarHBondContact OG1-CD2 2.79Å; T770-H784 PolarHBondContact OG1-NE2 2.9Å
785	S	82.4	Confident	66.4	Low	74 Å²	74	84.4 Å²	84.4	52%	0.517	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	126.8	173.4	-59.4	0	0	0	0	108.6	T766 H767	T766-S785 CarbonylContact O-C 3.09Å; T766-S785 WeakPolarHBondContact O-CA 3.48Å; H767-S785 PolarHBondContact CD2-OG 3.16Å; H767-S785 PolarHBondContact NE2-OG 2.79Å
786	C	84.9	Confident	67.3	Low	13 Å²	13	79.8 Å²	79.8	9%	0.088	45%	0.452	C	S	.	.			trans	-66.8	153.4	170.8	-58.4	0	0	0	0	110.8	T766 E790 C799	T766-C786 PolarHBondContact O-N 3.3Å; C786-E790 HydrophobicContact CB-CB 3.75Å; C786-C799 WeakPolarHBondContact CA-SG 3.36Å; C786-C799 HydrophobicContact CB-CB 3.73Å; C786-C799 WeakPolarHBondContact CB-SG 3.44Å; C786-C799 WeakPolarHBondContact SG-CB 3.49Å; C786-C799 CovalentContact SG-SG 2.04Å; C786-C799 PolarHBondContact SG-SG 2.89Å
787	L	81.8	Confident	68.8	Low	126 Å²	126	75.2 Å²	75.2	66%	0.66	43%	0.434	S	S	*	.			trans	-70	162.1	-177.3	-66.7	166.7	0	0	0	111.1	G789 E790	L787-G789 PolarHBondContact O-N 2.8Å; L787-E790 HydrophobicContact CB-CG 4.38Å; L787-E790 PolarHBondContact N-OE2 3.03Å; L787-E790 WeakPolarHBondContact O-CB 3.49Å; L787-E790 PolarHBondContact O-N 2.93Å
788	N	66.6	Low	70.4	Confident	178 Å²	178	71 Å²	71	95%	0.952	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	108.3	-169.9	-78.3	-27.9	0	0	0	113.1
789	G	74.9	Confident	72.7	Confident	79 Å²	79	66 Å²	66	81%	0.814	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	103.5	-11.1	179.1	0	0	0	0	0	114.9	L787	L787-G789 PolarHBondContact O-N 2.8Å
790	E	81.7	Confident	73.8	Confident	33 Å²	33	68.1 Å²	68.1	15%	0.154	38%	0.379	C	S	.	.			trans	-76.2	155.4	177	-66.5	178.6	166.7	0	0	112.8	C786 L787 S800 S801	C786-E790 HydrophobicContact CB-CB 3.75Å; L787-E790 HydrophobicContact CB-CG 4.38Å; L787-E790 PolarHBondContact N-OE2 3.03Å; L787-E790 WeakPolarHBondContact O-CB 3.49Å; L787-E790 PolarHBondContact O-N 2.93Å; E790-S800 WeakPolarHBondContact CA-OG 3.31Å; E790-S800 WeakPolarHBondContact CB-OG 3.25Å; E790-S801 WeakPolarHBondContact OE1-CB 3.36Å; E790-S801 PolarHBondContact OE1-OG 3.42Å
791	L	82.9	Confident	74.9	Confident	97 Å²	97	66.7 Å²	66.7	51%	0.508	37%	0.373	S	S	.	.			trans	-119.7	140.5	176.4	-65	172.8	0	0	0	110	K765 C799 S800	K765-L791 HydrophobicContact CB-CD2 3.9Å; K765-L791 HydrophobicContact CD-CD2 4.19Å; K765-L791 HydrophobicContact CG-CD2 4.47Å; K765-L791 WeakPolarHBondContact O-CA 3.32Å; L791-C799 CarbonylContact O-C 3.36Å; L791-S800 PolarHBondContact N-OG 3.36Å; L791-S800 VanDerWaalsContact N-OG 3.08Å; L791-S800 WeakPolarHBondContact O-CA 3.38Å; L791-S800 VanDerWaalsContact O-CB 3.25Å; L791-S800 WeakPolarHBondContact O-CB 3.23Å; L791-S800 PolarHBondContact O-N 2.94Å
792	F	80.1	Confident	75	Confident	20 Å²	20	67.6 Å²	67.6	9%	0.088	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	130	172	177.1	-99.9	0	0	0	111.1	A760 P762 K765 F768 P794 A797	A760-F792 HydrophobicContact CB-CE2 3.81Å; A760-F792 HydrophobicContact CB-CZ 3.66Å; P762-F792 HydrophobicContact CB-CD1 3.78Å; P762-F792 HydrophobicContact CB-CE1 3.69Å; P762-F792 HydrophobicContact CG-CD1 4.49Å; P762-F792 HydrophobicContact CG-CE1 4.01Å; K765-F792 PolarHBondContact O-N 3.18Å; F768-F792 HydrophobicContact CB-CD2 3.81Å; F768-F792 HydrophobicContact CB-CE2 3.55Å; F768-F792 HydrophobicContact CB-CG 4.38Å; F768-F792 HydrophobicContact CB-CZ 3.94Å; F768-F792 AromaticContact CD1-CD2 3.35Å; F768-F792 HydrophobicContact CD1-CD2 3.35Å; F768-F792 AromaticContact CD1-CE2 3.6Å; F768-F792 HydrophobicContact CD1-CE2 3.6Å; F768-F792 HydrophobicContact CD1-CG 4.33Å; F768-F792 HydrophobicContact CD2-CD2 4.5Å; F768-F792 AromaticContact CD2-CE2 3.9Å; F768-F792 HydrophobicContact CD2-CE2 3.9Å; F768-F792 AromaticContact CE1-CD2 3.96Å; F768-F792 HydrophobicContact CE1-CD2 3.96Å; F768-F792 HydrophobicContact CE1-CE2 4.19Å; F768-F792 HydrophobicContact CE2-CE2 4.43Å; F768-F792 AromaticContact CG-CD2 3.65Å; F768-F792 HydrophobicContact CG-CD2 3.65Å; F768-F792 AromaticContact CG-CE2 3.42Å; F768-F792 HydrophobicContact CG-CE2 3.42Å; F768-F792 VanDerWaalsContact CG-CE2 3.42Å; F768-F792 HydrophobicContact CG-CZ 4.25Å; F792-P794 HydrophobicContact CD1-CB 4.37Å; F792-P794 HydrophobicContact CE1-CB 3.93Å; F792-P794 WeakPolarHBondContact O-CD 3.27Å; F792-A797 VanDerWaalsContact CE2-C 3.47Å
793	D	78.1	Confident	74.8	Confident	35 Å²	35	65.8 Å²	65.8	19%	0.187	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	103.2	173.1	-175.6	-3	0	0	0	109.8	R795 K796 A797 A798 A803	D793-R795 PolarHBondContact O-N 3.44Å; D793-R795 VanDerWaalsContact O-N 3.13Å; D793-R795 WeakPolarHBondContact OD1-CB 3.28Å; D793-R795 WeakPolarHBondContact OD1-CG 3.4Å; D793-R795 PolarHBondContact OD1-N 3.43Å; D793-K796 HydrophobicContact CB-CB 4.42Å; D793-K796 PolarHBondContact O-N 3.43Å; D793-A797 PolarHBondContact O-N 3.45Å; D793-A797 VanDerWaalsContact O-N 3.1Å; D793-A798 PolarHBondContact N-O 3.38Å; D793-A803 HydrophobicContact CB-CB 4.18Å
794	P	66.4	Low	73.7	Confident	90 Å²	90	63.8 Å²	63.8	58%	0.584	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-17.6	-178.1	27.8	-35.3	0	0	0	113.3	F792 K796	F792-P794 HydrophobicContact CD1-CB 4.37Å; F792-P794 HydrophobicContact CE1-CB 3.93Å; F792-P794 WeakPolarHBondContact O-CD 3.27Å; P794-K796 PolarHBondContact O-N 2.77Å
795	R	63	Low	72.2	Confident	174 Å²	174	65.5 Å²	65.5	66%	0.657	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-15.6	175.6	-51.5	178	-163.1	-122.1	-4.8	112.7	H416 D793	H416-R795 PolarHBondContact CD2-NH2 3.27Å; H416-R795 PolarHBondContact NE2-NH2 3.34Å; D793-R795 PolarHBondContact O-N 3.44Å; D793-R795 VanDerWaalsContact O-N 3.13Å; D793-R795 WeakPolarHBondContact OD1-CB 3.28Å; D793-R795 WeakPolarHBondContact OD1-CG 3.4Å; D793-R795 PolarHBondContact OD1-N 3.43Å
796	K	68	Low	70.1	Confident	63 Å²	63	65 Å²	65	27%	0.274	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.9	-5.4	-174.1	-64.7	-163.4	-179.2	-159.6	0	114.5	D793 P794 A798 A803 L806	D793-K796 HydrophobicContact CB-CB 4.42Å; D793-K796 PolarHBondContact O-N 3.43Å; P794-K796 PolarHBondContact O-N 2.77Å; K796-A798 HydrophobicContact CB-CB 4.38Å; K796-A798 PolarHBondContact O-N 2.85Å; K796-A803 HydrophobicContact CD-CB 3.78Å; K796-A803 PolarHBondContact NZ-O 3.28Å; K796-L806 HydrophobicContact CD-CD1 4.43Å
797	A	73.9	Confident	68	Low	22 Å²	22	72 Å²	72	18%	0.182	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.7	29.4	-175	0	0	0	0	0	114.1	A760 F792 D793	A760-A797 HydrophobicContact CB-CB 3.6Å; F792-A797 VanDerWaalsContact CE2-C 3.47Å; D793-A797 PolarHBondContact O-N 3.45Å; D793-A797 VanDerWaalsContact O-N 3.1Å
798	A	79.7	Confident	65.9	Low	4 Å²	4	71.6 Å²	71.6	3%	0.033	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	162.3	-169.6	0	0	0	0	0	112.7	D793 K796 E802 L806	D793-A798 PolarHBondContact N-O 3.38Å; K796-A798 HydrophobicContact CB-CB 4.38Å; K796-A798 PolarHBondContact O-N 2.85Å; A798-E802 HydrophobicContact CB-CB 4.15Å; A798-E802 HydrophobicContact CB-CG 3.97Å; A798-E802 WeakPolarHBondContact CB-OE2 3.48Å; A798-L806 HydrophobicContact CB-CD1 4.42Å
799	C	85.5	Confident	64.3	Low	12 Å²	12	72.2 Å²	72.2	8%	0.081	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	159	173.9	-65.2	0	0	0	0	112.2	C786 L791 S801 E802 A803	C786-C799 WeakPolarHBondContact CA-SG 3.36Å; C786-C799 HydrophobicContact CB-CB 3.73Å; C786-C799 WeakPolarHBondContact CB-SG 3.44Å; C786-C799 WeakPolarHBondContact SG-CB 3.49Å; C786-C799 CovalentContact SG-SG 2.04Å; C786-C799 PolarHBondContact SG-SG 2.89Å; L791-C799 CarbonylContact O-C 3.36Å; C799-S801 VanDerWaalsContact C-N 3.27Å; C799-S801 PolarHBondContact O-N 3.37Å; C799-S801 VanDerWaalsContact O-N 3.09Å; C799-E802 WeakPolarHBondContact O-CB 3.34Å; C799-E802 PolarHBondContact O-N 3Å; C799-E802 VanDerWaalsContact O-N 3.08Å; C799-A803 VanDerWaalsContact O-CB 3.25Å; C799-A803 WeakPolarHBondContact O-CB 3.32Å; C799-A803 PolarHBondContact O-N 2.76Å
800	S	76.2	Confident	62.6	Low	51 Å²	51	77.7 Å²	77.7	36%	0.357	38%	0.375	S	S	.	.	H	α-helix	trans	-59.7	-27.9	-168.6	50.5	0	0	0	0	115.7	E790 L791 A804	E790-S800 WeakPolarHBondContact CA-OG 3.31Å; E790-S800 WeakPolarHBondContact CB-OG 3.25Å; L791-S800 PolarHBondContact N-OG 3.36Å; L791-S800 VanDerWaalsContact N-OG 3.08Å; L791-S800 WeakPolarHBondContact O-CA 3.38Å; L791-S800 VanDerWaalsContact O-CB 3.25Å; L791-S800 WeakPolarHBondContact O-CB 3.23Å; L791-S800 PolarHBondContact O-N 2.94Å; S800-A804 WeakPolarHBondContact O-CB 3.34Å; S800-A804 PolarHBondContact O-N 3.03Å; S800-A804 VanDerWaalsContact O-N 3.11Å
801	S	71.3	Confident	60.5	Low	50 Å²	50	81.8 Å²	81.8	35%	0.35	40%	0.396	S	S	.	.	H	α-helix	trans	-76.8	-43.4	174.8	52.4	0	0	0	0	112.4	E790 C799 A804 L805	E790-S801 WeakPolarHBondContact OE1-CB 3.36Å; E790-S801 PolarHBondContact OE1-OG 3.42Å; C799-S801 VanDerWaalsContact C-N 3.27Å; C799-S801 PolarHBondContact O-N 3.37Å; C799-S801 VanDerWaalsContact O-N 3.09Å; S801-A804 CarbonylContact O-C 3.36Å; S801-A804 WeakPolarHBondContact O-CA 3.11Å; S801-A804 WeakPolarHBondContact O-CB 3.45Å; S801-A804 PolarHBondContact O-N 2.96Å; S801-L805 PolarHBondContact O-N 2.75Å
802	E	64	Low	58.3	Low	100 Å²	100	82.9 Å²	82.9	47%	0.467	40%	0.402	S	S	.	.	H	α-helix	trans	-66	-39.4	174	-169.6	171.6	-128.4	0	0	111.4	A798 C799 A804 L805 L806	A798-E802 HydrophobicContact CB-CB 4.15Å; A798-E802 HydrophobicContact CB-CG 3.97Å; A798-E802 WeakPolarHBondContact CB-OE2 3.48Å; C799-E802 WeakPolarHBondContact O-CB 3.34Å; C799-E802 PolarHBondContact O-N 3Å; C799-E802 VanDerWaalsContact O-N 3.08Å; E802-A804 VanDerWaalsContact C-N 3.26Å; E802-A804 PolarHBondContact O-N 3.47Å; E802-L805 PolarHBondContact O-N 3.34Å; E802-L806 WeakPolarHBondContact O-CB 3.47Å; E802-L806 WeakPolarHBondContact O-CG 3.4Å; E802-L806 PolarHBondContact O-N 3.3Å
803	A	56.4	Low	56.2	Low	6 Å²	6	85 Å²	85	5%	0.05	42%	0.418	C	S	.	.	H	α-helix	trans	-62.5	-29	168.2	0	0	0	0	0	113.1	D793 K796 C799 R807	D793-A803 HydrophobicContact CB-CB 4.18Å; K796-A803 HydrophobicContact CD-CB 3.78Å; K796-A803 PolarHBondContact NZ-O 3.28Å; C799-A803 VanDerWaalsContact O-CB 3.25Å; C799-A803 WeakPolarHBondContact O-CB 3.32Å; C799-A803 PolarHBondContact O-N 2.76Å; A803-R807 PolarHBondContact O-N 3.03Å
804	A	52.6	Low	53.9	Low	43 Å²	43	89.5 Å²	89.5	36%	0.355	44%	0.439	S	S	.	.	H	α-helix	trans	-79.4	-40.8	173.1	0	0	0	0	0	112	S800 S801 E802 R807 Q808	S800-A804 WeakPolarHBondContact O-CB 3.34Å; S800-A804 PolarHBondContact O-N 3.03Å; S800-A804 VanDerWaalsContact O-N 3.11Å; S801-A804 CarbonylContact O-C 3.36Å; S801-A804 WeakPolarHBondContact O-CA 3.11Å; S801-A804 WeakPolarHBondContact O-CB 3.45Å; S801-A804 PolarHBondContact O-N 2.96Å; E802-A804 VanDerWaalsContact C-N 3.26Å; E802-A804 PolarHBondContact O-N 3.47Å; A804-R807 CarbonylContact O-C 3.53Å; A804-R807 WeakPolarHBondContact O-CA 3.2Å; A804-R807 WeakPolarHBondContact O-CB 3.47Å; A804-R807 PolarHBondContact O-N 2.69Å; A804-Q808 PolarHBondContact O-N 3.48Å
805	L	46	Very low	52.3	Low	106 Å²	106	88.6 Å²	88.6	56%	0.555	45%	0.446	S	S	*	.	H	α-helix	trans	-60.5	-43.3	171.4	-79.9	164.4	0	0	0	111.5	S801 E802 R807 Q808 Y809	S801-L805 PolarHBondContact O-N 2.75Å; E802-L805 PolarHBondContact O-N 3.34Å; L805-R807 VanDerWaalsContact C-N 3.26Å; L805-R807 PolarHBondContact O-N 2.85Å; L805-Q808 WeakPolarHBondContact O-CB 3.21Å; L805-Q808 PolarHBondContact O-N 2.94Å; L805-Q808 VanDerWaalsContact O-N 3.14Å; L805-Y809 PolarHBondContact O-N 3.32Å
806	L	38.9	Very low	50.7	Low	64 Å²	64	83.6 Å²	83.6	34%	0.335	45%	0.448	S	S	.	.	H	α-helix	trans	-59.8	-37	169.5	-75.8	167.5	0	0	0	111.6	K796 A798 E802 Y809 Y810	K796-L806 HydrophobicContact CD-CD1 4.43Å; A798-L806 HydrophobicContact CB-CD1 4.42Å; E802-L806 WeakPolarHBondContact O-CB 3.47Å; E802-L806 WeakPolarHBondContact O-CG 3.4Å; E802-L806 PolarHBondContact O-N 3.3Å; L806-Y809 PolarHBondContact O-N 3.46Å; L806-Y810 WeakPolarHBondContact O-CD2 3.43Å; L806-Y810 PolarHBondContact O-N 2.99Å
807	R	39.4	Very low	48.9	Very low	159 Å²	159	90.9 Å²	90.9	60%	0.6	48%	0.476	S	S	*	.	H	α-helix	trans	-64.4	-38.6	174	-115.2	169.5	-168.6	162.9	3.2	111.9	A803 A804 L805 M811	A803-R807 PolarHBondContact O-N 3.03Å; A804-R807 CarbonylContact O-C 3.53Å; A804-R807 WeakPolarHBondContact O-CA 3.2Å; A804-R807 WeakPolarHBondContact O-CB 3.47Å; A804-R807 PolarHBondContact O-N 2.69Å; L805-R807 VanDerWaalsContact C-N 3.26Å; L805-R807 PolarHBondContact O-N 2.85Å; R807-M811 WeakPolarHBondContact O-CB 3.43Å; R807-M811 VanDerWaalsContact O-CG 3.22Å; R807-M811 WeakPolarHBondContact O-CG 3.46Å; R807-M811 PolarHBondContact O-N 3.34Å
808	Q	37.8	Very low	46.7	Very low	117 Å²	117	98.2 Å²	98.2	55%	0.547	51%	0.509	S	S	.	.	H	α-helix	trans	-66.8	-45.6	172.8	-67.5	179.9	-77.1	0	0	111.1	A804 L805 Y810 M811 D812	A804-Q808 PolarHBondContact O-N 3.48Å; L805-Q808 WeakPolarHBondContact O-CB 3.21Å; L805-Q808 PolarHBondContact O-N 2.94Å; L805-Q808 VanDerWaalsContact O-N 3.14Å; Q808-Y810 VanDerWaalsContact C-N 3.26Å; Q808-Y810 PolarHBondContact O-N 3.26Å; Q808-M811 PolarHBondContact O-N 3.07Å; Q808-D812 PolarHBondContact O-N 3.31Å
809	Y	34.4	Very low	44.4	Very low	191 Å²	191	102.6 Å²	102.6	75%	0.749	54%	0.544	S	S	*	.	H	α-helix	trans	-56.7	-35.5	176.2	-116.7	-86.4	0	0	0	113.6	L805 L806	L805-Y809 PolarHBondContact O-N 3.32Å; L806-Y809 PolarHBondContact O-N 3.46Å
810	Y	38.6	Very low	41.9	Very low	194 Å²	194	106.3 Å²	106.3	76%	0.761	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.6	-5.5	174.3	-77.3	-67.2	0	0	0	114.6	L806 Q808	L806-Y810 WeakPolarHBondContact O-CD2 3.43Å; L806-Y810 PolarHBondContact O-N 2.99Å; Q808-Y810 VanDerWaalsContact C-N 3.26Å; Q808-Y810 PolarHBondContact O-N 3.26Å
811	M	37.6	Very low	39.5	Very low	120 Å²	120	107.6 Å²	107.6	59%	0.591	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.6	-24.5	179.8	-76	-177.9	166.9	0	0	114	R465 R807 Q808	R465-M811 PolarHBondContact NH2-O 2.98Å; R807-M811 WeakPolarHBondContact O-CB 3.43Å; R807-M811 VanDerWaalsContact O-CG 3.22Å; R807-M811 WeakPolarHBondContact O-CG 3.46Å; R807-M811 PolarHBondContact O-N 3.34Å; Q808-M811 PolarHBondContact O-N 3.07Å
812	D	35.9	Very low	37.6	Very low	120 Å²	120	114.7 Å²	114.7	64%	0.642	61%	0.61	S	S	*	*			trans	-66	149.4	-178.8	-108.2	-48.2	0	0	0	113	R465 Q808	R465-D812 PolarHBondContact NH2-O 3.17Å; Q808-D812 PolarHBondContact O-N 3.31Å
813	P	36.8	Very low	35.8	Very low	65 Å²	65	114.6 Å²	114.6	42%	0.422	63%	0.627	S	S	.	*			trans	-83.8	-177.5	-176.4	-14.6	32.8	0	0	0	115.5	G815	P813-G815 PolarHBondContact O-N 3.5Å
814	M	30.3	Very low	34.7	Very low	129 Å²	129	125 Å²	125	64%	0.635	67%	0.666	S	S	*	*	S	Bend	trans	-56.7	117.6	168.1	-64.4	165.6	175.6	0	0	110.2	V316	V316-M814 HydrophobicContact CG2-CE 3.93Å
815	G	31.6	Very low	33.5	Very low	71 Å²	71	126.9 Å²	126.9	73%	0.732	69%	0.69	S	S	*	*			trans	162	41.6	179.1	0	0	0	0	0	115.5	P813	P813-G815 PolarHBondContact O-N 3.5Å
816	G	29.7	Very low	32.8	Very low	68 Å²	68	125.4 Å²	125.4	70%	0.701	70%	0.7	S	S	*	*			trans	-149	25.9	-166.1	0	0	0	0	0	117.6	M818	G816-M818 PolarHBondContact O-N 3.23Å
817	Y	30.6	Very low	32.3	Very low	217 Å²	217	125.5 Å²	125.5	85%	0.851	72%	0.717	S	S	*	*			trans	-76.8	50.6	177.2	-99.5	-69.9	0	0	0	113.7
818	M	28.6	Very low	32	Very low	176 Å²	176	129.5 Å²	129.5	87%	0.867	73%	0.734	S	S	*	*			trans	-144.4	113.8	160	-76.6	-160.1	176.7	0	0	109.7	G816	G816-M818 PolarHBondContact O-N 3.23Å
819	A	30.7	Very low	31.6	Very low	95 Å²	95	126.5 Å²	126.5	79%	0.785	74%	0.735	S	S	*	*			trans	-70.9	132.8	175.5	0	0	0	0	0	110.6	G821	A819-G821 PolarHBondContact O-N 3.48Å; A819-G821 VanDerWaalsContact O-N 3.16Å
820	P	32	Very low	31.6	Very low	90 Å²	90	129.2 Å²	129.2	58%	0.584	75%	0.745	S	S	*	*			trans	-65.8	115	163.5	28.1	-31.6	0	0	0	108.1	Y822	P820-Y822 VanDerWaalsContact C-N 3.32Å; P820-Y822 HydrophobicContact CB-CD2 4.24Å; P820-Y822 HydrophobicContact CB-CE2 4.03Å; P820-Y822 HydrophobicContact CG-CD2 4.23Å; P820-Y822 HydrophobicContact CG-CE2 4.05Å; P820-Y822 WeakPolarHBondContact O-CD2 3.32Å; P820-Y822 PolarHBondContact O-N 2.93Å
821	G	26.1	Very low	31.2	Very low	78 Å²	78	122.8 Å²	122.8	80%	0.804	74%	0.738	S	S	*	*			trans	-69.1	81.7	-176.4	0	0	0	0	0	112.9	A819 A823	A819-G821 PolarHBondContact O-N 3.48Å; A819-G821 VanDerWaalsContact O-N 3.16Å; G821-A823 VanDerWaalsContact C-N 3.32Å; G821-A823 PolarHBondContact O-N 2.95Å
822	Y	32.6	Very low	31.1	Very low	199 Å²	199	129 Å²	129	78%	0.78	76%	0.757	S	S	*	*			trans	-71.9	87.1	172.1	-83.5	-81.1	0	0	0	110.9	P820 Y824	P820-Y822 VanDerWaalsContact C-N 3.32Å; P820-Y822 HydrophobicContact CB-CD2 4.24Å; P820-Y822 HydrophobicContact CB-CE2 4.03Å; P820-Y822 HydrophobicContact CG-CD2 4.23Å; P820-Y822 HydrophobicContact CG-CE2 4.05Å; P820-Y822 WeakPolarHBondContact O-CD2 3.32Å; P820-Y822 PolarHBondContact O-N 2.93Å; Y822-Y824 PolarHBondContact O-N 2.98Å
823	A	25.7	Very low	30.8	Very low	99 Å²	99	126.7 Å²	126.7	82%	0.818	76%	0.761	S	S	*	*			trans	-68.7	87.7	172.6	0	0	0	0	0	111.4	G821	G821-A823 VanDerWaalsContact C-N 3.32Å; G821-A823 PolarHBondContact O-N 2.95Å
824	Y	32.9	Very low	30.6	Very low	223 Å²	223	132.6 Å²	132.6	88%	0.875	79%	0.785	S	S	*	*			trans	-105.6	96.6	160.5	-104.8	-87.3	0	0	0	109.8	Y822	Y822-Y824 PolarHBondContact O-N 2.98Å
825	G	27.6	Very low	30.8	Very low	83 Å²	83	132 Å²	132	86%	0.856	79%	0.791	S	S	*	*			trans	-82.9	133.1	176.4	0	0	0	0	0	112.3
826	G	31	Very low	30.7	Very low	75 Å²	75	131.9 Å²	131.9	77%	0.773	79%	0.789	S	S	*	*			trans	-173.6	122.1	171.3	0	0	0	0	0	111.4
827	G	28.1	Very low	31	Very low	66 Å²	66	140.6 Å²	140.6	68%	0.68	80%	0.803	S	S	*	*			trans	-69.6	170.2	166.5	0	0	0	0	0	111
828	Y	33.8	Very low	30.9	Very low	243 Å²	243	133.5 Å²	133.5	95%	0.953	80%	0.796	S	S	*	*			cis	-140.6	171.2	19.9	-59	-104.6	0	0	0	107.6
829	G	28.3	Very low	31.1	Very low	55 Å²	55	133 Å²	133	57%	0.567	80%	0.797	S	S	*	*			cis	140	142.3	8.9	0	0	0	0	0	108.9
830	Y	34.4	Very low	31.2	Very low	248 Å²	248	133.4 Å²	133.4	97%	0.973	79%	0.791	S	S	*	*			trans	68.2	145.1	-168	-47.2	-79.3	0	0	0	114.9
831	G	30.1	Very low	31.2	Very low	59 Å²	59	138.3 Å²	138.3	61%	0.608	81%	0.809	S	S	*	*			cis	167	145.4	-8.7	0	0	0	0	0	112.5
832	Y	35.5	Very low	31.6	Very low	250 Å²	250	142.4 Å²	142.4	98%	0.98	81%	0.811	S	S	*	*			trans	66.2	135.5	-176.3	-49	-84.2	0	0	0	116
833	G	30.9	Very low	31.3	Very low	71 Å²	71	136.5 Å²	136.5	73%	0.732	81%	0.811	S	S	*	*			cis	138.8	105.3	-16.7	0	0	0	0	0	114.9
834	M	32.2	Very low	31.5	Very low	190 Å²	190	140.8 Å²	140.8	94%	0.936	82%	0.817	S	S	*	*			trans	-165.7	155.2	153.1	-98.5	-70.4	168.7	0	0	108.4
835	P	34.9	Very low	31.5	Very low	117 Å²	117	135.7 Å²	135.7	76%	0.76	81%	0.811	S	S	*	*			trans	-121.4	166.3	-152.8	42.4	-33.5	0	0	0	117.1
836	G	29.8	Very low	31.5	Very low	67 Å²	67	141 Å²	141	69%	0.691	82%	0.815	S	S	*	*				103.3	92.6	129.6	0	0	0	0	0	118.7
837	Y	34.8	Very low	31.6	Very low	251 Å²	251	143.6 Å²	143.6	98%	0.984	82%	0.816	S	S	*	*				-162.5	147.6	124.2	-107.9	-75.6	0	0	0	107.9
838	G	28.4	Very low	31.7	Very low	68 Å²	68	148.4 Å²	148.4	70%	0.701	82%	0.821	S	S	*	*			trans	-173.6	159.8	178.3	0	0	0	0	0	112.8
839	D	33.4	Very low	31.8	Very low	166 Å²	166	142.8 Å²	142.8	89%	0.888	81%	0.814	S	S	*	*			trans	-146	146	170	-116.1	-34.4	0	0	0	108.6
840	P	31.7	Very low	32	Very low	103 Å²	103	150.4 Å²	150.4	67%	0.669	83%	0.827	S	S	*	*			trans	-97.1	151.6	-174.5	36.8	-32.8	0	0	0	113.1
841	M	32	Very low	32	Very low	194 Å²	194	143.4 Å²	143.4	96%	0.956	82%	0.821	S	S	*	*			trans	-117.3	136.4	162	-79.5	-113.4	167.6	0	0	110.2
842	L	34.8	Very low	32.2	Very low	163 Å²	163	150.5 Å²	150.5	85%	0.853	83%	0.831	S	S	*	*			trans	-84.3	151.4	-172.9	-67.1	86.8	0	0	0	111.8
843	G	27	Very low	32.4	Very low	76 Å²	76	144.2 Å²	144.2	78%	0.784	82%	0.82	S	S	*	*			trans	-79.9	156.8	167.5	0	0	0	0	0	112.9
844	M	30.5	Very low	32.5	Very low	189 Å²	189	145.5 Å²	145.5	93%	0.931	82%	0.824	S	S	*	*			trans	-131.5	157.1	166.1	-76.2	-155.1	-164.9	0	0	109.9
845	P	31.2	Very low	32.7	Very low	115 Å²	115	145.1 Å²	145.1	75%	0.747	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-84.8	155.3	-158.3	32.8	-36.6	0	0	0	114.6
846	M	28.6	Very low	32.7	Very low	194 Å²	194	148.6 Å²	148.6	96%	0.956	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-70.9	130.2	164.4	-74.1	-163.7	-79.7	0	0	110.8
847	V	33.2	Very low	33	Very low	130 Å²	130	151.8 Å²	151.8	79%	0.788	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-99.3	135.9	168	178.7	0	0	0	0	108.6
848	Q	29.2	Very low	33.1	Very low	168 Å²	168	145.4 Å²	145.4	79%	0.785	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-78.5	131	-179.3	-62.4	175.5	-60.1	0	0	111.3
849	P	36.2	Very low	33.3	Very low	124 Å²	124	151.1 Å²	151.1	81%	0.805	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-76.9	133.2	160.5	31.3	-31.1	0	0	0	109.9
850	Y	33.3	Very low	33.7	Very low	215 Å²	215	149.9 Å²	149.9	84%	0.843	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-71.8	136.1	175.2	-78.8	-104	0	0	0	110.9
851	A	33.1	Very low	33.9	Very low	101 Å²	101	149.1 Å²	149.1	84%	0.835	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-87.6	119.7	173.2	0	0	0	0	0	110.8
852	Y	36	Very low	34.3	Very low	209 Å²	209	148.9 Å²	148.9	82%	0.82	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-89.7	147.5	165.1	-89.1	-91.7	0	0	0	110.7
853	P	38.3	Very low	34.7	Very low	117 Å²	117	145.7 Å²	145.7	76%	0.76	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-71.2	141.2	-179	-14.8	30.1	0	0	0	112.1
854	A	34.5	Very low	35.4	Very low	98 Å²	98	148.7 Å²	148.7	81%	0.81	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-70.5	137.7	167	0	0	0	0	0	110.5
855	M	35.6	Very low	36	Very low	182 Å²	182	149.7 Å²	149.7	90%	0.897	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-101.9	126.2	163.6	-64.8	-167.3	-166.8	0	0	109.3
856	E	34.4	Very low	36.6	Very low	190 Å²	190	148.6 Å²	148.6	89%	0.888	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-83.1	132.3	174.3	-58.1	179.2	138.9	0	0	110.4
857	V	37.3	Very low	37.3	Very low	134 Å²	134	145.1 Å²	145.1	81%	0.812	81%	0.806	S	S	*	*			trans	-139.3	127.7	163.3	-174.2	0	0	0	0	107.8
858	P	36.7	Very low	37.9	Very low	117 Å²	117	143.3 Å²	143.3	76%	0.76	80%	0.804	S	S	*	*			trans	-83.5	157.4	-165.2	32.3	-36.9	0	0	0	114.6
859	M	32.6	Very low	38.6	Very low	188 Å²	188	141 Å²	141	93%	0.926	80%	0.804	S	S	*	*			trans	-78.3	124	173.8	-63.6	175.6	68.7	0	0	112.2
860	V	40.8	Very low	38.8	Very low	141 Å²	141	139.5 Å²	139.5	86%	0.855	80%	0.802	S	S	*	*			trans	-140.9	130.1	155.3	-176.2	0	0	0	0	109.8
861	A	37.6	Very low	39.2	Very low	87 Å²	87	137.8 Å²	137.8	72%	0.719	80%	0.804	S	S	*	*			trans	-133.8	144.7	161.6	0	0	0	0	0	106.4
862	Q	40.1	Very low	39.8	Very low	188 Å²	188	138 Å²	138	88%	0.879	81%	0.806	S	S	*	*				-156.5	174.7	70.7	-95.6	-166.4	-17.2	0	0	112.8
863	P	43.6	Very low	39.8	Very low	97 Å²	97	132.5 Å²	132.5	63%	0.63	80%	0.803	S	S	*	*			trans	-111.3	172.6	-147.7	42	-37.6	0	0	0	116.1
864	N	41.2	Very low	40.2	Very low	138 Å²	138	132.6 Å²	132.6	74%	0.738	80%	0.804	S	S	*	*				179.3	160	115.3	-93.6	-39.6	0	0	0	115.8
865	Y	41.8	Very low	40.7	Very low	211 Å²	211	134.2 Å²	134.2	83%	0.827	81%	0.806	S	S	*	*			trans	66.4	106.4	160.6	-72.6	-65.8	0	0	0	123.5
866	A	44.1	Very low	40.6	Very low	91 Å²	91	129.7 Å²	129.7	75%	0.752	80%	0.797	S	S	*	*				73.1	152.7	125.7	0	0	0	0	0	121.2
867	P	44.5	Very low	40.9	Very low	122 Å²	122	131.1 Å²	131.1	79%	0.792	80%	0.801	S	S	*	*			trans	-134.4	176.4	-140.5	43.1	-27.2	0	0	0	118.9
868	A	45.2	Very low	40.8	Very low	91 Å²	91	128 Å²	128	75%	0.752	80%	0.797	S	S	*	*			trans	87	160.6	152.5	0	0	0	0	0	119
869	P	44.5	Very low	40.9	Very low	120 Å²	120	127.4 Å²	127.4	78%	0.779	80%	0.801	S	S	*	*				-141.5	172.3	-51.9	40.2	-25.7	0	0	0	115.9
870	A	40.4	Very low	41.5	Very low	93 Å²	93	124.5 Å²	124.5	77%	0.769	80%	0.796	S	S	*	*			trans	70.2	150.9	161.8	0	0	0	0	0	117.2
871	M	41.9	Very low	41.2	Very low	179 Å²	179	124.6 Å²	124.6	88%	0.882	80%	0.797	S	S	*	*			cis	-148.9	171	28.3	-74.7	-176.5	-81.7	0	0	114.3
872	A	44.4	Very low	41.1	Very low	106 Å²	106	125.6 Å²	125.6	88%	0.876	80%	0.799	S	S	*	*			trans	76	152.4	154.3	0	0	0	0	0	120.2
873	A	37.3	Very low	41.1	Very low	93 Å²	93	121.9 Å²	121.9	77%	0.769	79%	0.791	S	S	*	*			trans	-147.3	-159	-176.7	0	0	0	0	0	110.4
874	P	46	Very low	40.8	Very low	118 Å²	118	128.4 Å²	128.4	77%	0.766	81%	0.805	S	S	*	*				-104.4	-164	-112.9	42	-26.5	0	0	0	112.9
875	P	44.3	Very low	40.5	Very low	132 Å²	132	125.7 Å²	125.7	86%	0.857	80%	0.802	S	S	*	*				-147.6	-166.4	78.1	39.2	-18.3	0	0	0	114.6
876	A	34.5	Very low	40.3	Very low	87 Å²	87	125.3 Å²	125.3	72%	0.719	81%	0.805	S	S	*	*			trans	-108.2	153.1	-166.4	0	0	0	0	0	116.2
877	F	39.7	Very low	40.1	Very low	221 Å²	221	126.6 Å²	126.6	97%	0.969	81%	0.806	S	S	*	*			trans	-156.3	153.7	151.5	-81.8	-81.1	0	0	0	105.8
878	G	36.7	Very low	39.5	Very low	69 Å²	69	124.3 Å²	124.3	71%	0.711	80%	0.804	S	S	*	*			cis	169.9	136.7	-3.6	0	0	0	0	0	107.9
879	A	37.2	Very low	39.1	Very low	104 Å²	104	129.3 Å²	129.3	86%	0.86	81%	0.814	S	S	*	*			trans	-86.1	157.3	-175.5	0	0	0	0	0	113.2
880	P	45.1	Very low	38.6	Very low	127 Å²	127	131.2 Å²	131.2	83%	0.825	82%	0.817	S	S	*	*				-142	171.3	125.5	37.7	-24.2	0	0	0	115.4
881	T	35.4	Very low	38.8	Very low	142 Å²	142	132.9 Å²	132.9	87%	0.871	82%	0.82	S	S	*	*			trans	-94.3	156.3	-173	52	0	0	0	0	114.9
882	S	35.4	Very low	38.4	Very low	108 Å²	108	132 Å²	132	76%	0.755	82%	0.819	S	S	*	*			trans	-156.9	137.4	153.4	-167.5	0	0	0	0	112.9
883	P	39.3	Very low	38.1	Very low	110 Å²	110	131.8 Å²	131.8	71%	0.714	82%	0.817	S	S	*	*			trans	-108.5	165.3	179	40.1	-33.6	0	0	0	114.4
884	Y	39	Very low	38.1	Very low	234 Å²	234	131.6 Å²	131.6	92%	0.918	82%	0.824	S	S	*	*			trans	-141.4	151.4	164.4	-90	-83	0	0	0	112.1
885	A	34.2	Very low	37.7	Very low	82 Å²	82	129.2 Å²	129.2	68%	0.678	82%	0.821	S	S	*	*			trans	-152.3	-161.7	-177.5	0	0	0	0	0	110.9
886	F	36.4	Very low	37.3	Very low	203 Å²	203	133.6 Å²	133.6	89%	0.89	83%	0.827	S	S	*	*			trans	85.1	156.5	179.6	-67.5	-99.6	0	0	0	116.5
887	P	39.9	Very low	37.3	Very low	118 Å²	118	133 Å²	133	77%	0.766	83%	0.829	S	S	*	*			cis	-147.8	169.9	-44.8	41.1	-24.5	0	0	0	117.6
888	G	33.5	Very low	37.2	Very low	74 Å²	74	126.7 Å²	126.7	76%	0.763	83%	0.826	S	S	*	*			trans	87.9	158.4	151.7	0	0	0	0	0	117.7
889	M	36.2	Very low	37.3	Very low	195 Å²	195	126.9 Å²	126.9	96%	0.961	83%	0.829	S	S	*	*			cis	-148.1	169.3	-0.2	-69	-172.1	174.1	0	0	112.1
890	L	34.2	Very low	37.7	Very low	160 Å²	160	127.8 Å²	127.8	84%	0.838	83%	0.826	S	S	*	*			trans	-133.5	155.5	172.7	-98.9	171.3	0	0	0	109.1
891	P	43.9	Very low	37.4	Very low	128 Å²	128	128.2 Å²	128.2	83%	0.831	83%	0.826	S	S	*	*				-157.1	-176.3	93.1	40.9	-19.9	0	0	0	118.1
892	N	34.9	Very low	37.5	Very low	161 Å²	161	129.3 Å²	129.3	86%	0.861	82%	0.821	S	S	*	*			trans	-77.9	164.3	-179.3	-70.4	-43.1	0	0	0	116.5
893	A	38.1	Very low	37.5	Very low	102 Å²	102	134.1 Å²	134.1	84%	0.843	83%	0.829	S	S	*	*				-176	127.9	129.8	0	0	0	0	0	116.5
894	G	36.6	Very low	37.5	Very low	89 Å²	89	134.5 Å²	134.5	92%	0.918	83%	0.831	S	S	*	*			trans	65.3	157.1	150.1	0	0	0	0	0	121.4
895	G	36.8	Very low	37.1	Very low	67 Å²	67	126.4 Å²	126.4	69%	0.691	82%	0.819	S	S	*	*			cis	161.8	138.1	-13	0	0	0	0	0	115.2
896	F	35.7	Very low	37	Very low	225 Å²	225	134 Å²	134	99%	0.987	83%	0.831	S	S	*	*			trans	65.7	147.9	171.6	-63.8	-93.7	0	0	0	119
897	G	35.8	Very low	36.8	Very low	73 Å²	73	129.3 Å²	129.3	75%	0.753	82%	0.824	S	S	*	*			cis	171.1	154.9	-10.3	0	0	0	0	0	115.2
898	G	37.1	Very low	36.5	Very low	89 Å²	89	131.8 Å²	131.8	92%	0.918	83%	0.829	S	S	*	*			trans	82.4	151.1	173.6	0	0	0	0	0	116.2
899	G	37.8	Very low	36.7	Very low	74 Å²	74	135 Å²	135	76%	0.763	83%	0.827	S	S	*	*			cis	-166.6	166.7	-4.9	0	0	0	0	0	111.2
900	P	46.5	Very low	37	Very low	123 Å²	123	130.7 Å²	130.7	80%	0.799	81%	0.814	S	S	*	*			trans	-122.2	166.1	-150.1	41.7	-32.3	0	0	0	118.1
901	T	39.8	Very low	37.6	Very low	136 Å²	136	129 Å²	129	83%	0.834	81%	0.812	S	S	*	*			trans	-159.1	156	140.3	12.5	0	0	0	0	114.5
902	H	37.4	Very low	37.7	Very low	164 Å²	164	129 Å²	129	76%	0.759	81%	0.812	S	S	*	*			trans	-44.6	150.3	-170.2	-52.2	-66.5	0	0	0	121.9
903	F	33.6	Very low	38.1	Very low	209 Å²	209	125.3 Å²	125.3	92%	0.917	81%	0.805	S	S	*	*				-157.2	158.5	101.3	-99.3	-82.6	0	0	0	109.6
904	P	39.5	Very low	38.6	Very low	118 Å²	118	126.8 Å²	126.8	77%	0.766	81%	0.806	S	S	*	*			trans	-94	169.2	178.4	37	-28.2	0	0	0	112.1
905	G	30.7	Very low	38.9	Very low	64 Å²	64	130.2 Å²	130.2	66%	0.66	80%	0.801	S	S	*	*			cis	143.4	104.9	-2.4	0	0	0	0	0	111.7
906	Y	32.5	Very low	39.2	Very low	241 Å²	241	132.2 Å²	132.2	95%	0.945	80%	0.802	S	S	*	*			trans	-139.6	149.7	172.4	-88.2	-78.1	0	0	0	110.8
907	S	33	Very low	39.5	Very low	105 Å²	105	128 Å²	128	73%	0.734	80%	0.797	S	S	*	*			trans	-89.6	140.9	-169	46.2	0	0	0	0	113.9
908	I	33.3	Very low	39.6	Very low	170 Å²	170	128 Å²	128	87%	0.872	80%	0.797	S	S	*	*			trans	-85.7	127.3	167.8	-59.9	172.9	0	0	0	108.4
909	I	38.2	Very low	39.7	Very low	142 Å²	142	131.1 Å²	131.1	73%	0.728	79%	0.793	S	S	*	*			trans	-108.9	129.9	170.9	-61	175.2	0	0	0	107.5
910	P	41.8	Very low	39.6	Very low	105 Å²	105	133.7 Å²	133.7	68%	0.682	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-74	147.7	178.4	30.8	-34.9	0	0	0	111.8
911	P	47.3	Very low	39.3	Very low	123 Å²	123	137.1 Å²	137.1	80%	0.799	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-70.5	144.8	176.5	29.5	-34.6	0	0	0	111.9
912	P	44.6	Very low	39.3	Very low	128 Å²	128	140.2 Å²	140.2	83%	0.831	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-76.9	159	178.9	32.2	-35.7	0	0	0	113
913	A	44.8	Very low	39.4	Very low	85 Å²	85	137 Å²	137	70%	0.702	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-77.3	159.7	179.2	0	0	0	0	0	113.3
914	P	47	Very low	40	Very low	133 Å²	133	133.5 Å²	133.5	86%	0.864	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-73.8	146.1	-177.9	-11.7	28	0	0	0	113
915	I	43.1	Very low	40	Very low	160 Å²	160	132.1 Å²	132.1	82%	0.821	80%	0.803	S	S	*	*			trans	-109.7	132.2	175.2	-59	177	0	0	0	109.1
916	P	43.9	Very low	41.2	Very low	110 Å²	110	134.6 Å²	134.6	71%	0.714	81%	0.807	S	S	*	*			trans	-73.8	157.4	177.4	30.7	-35.3	0	0	0	112.8
917	P	41.1	Very low	41.9	Very low	135 Å²	135	132.6 Å²	132.6	88%	0.877	81%	0.806	S	S	*	*			trans	-77.4	141.6	-169.1	30.6	-36	0	0	0	114.2
918	G	38.3	Very low	42.5	Very low	74 Å²	74	134.2 Å²	134.2	76%	0.763	81%	0.811	S	S	*	*			trans	-156.4	102.5	179.2	0	0	0	0	0	115.2
919	N	39.1	Very low	43.6	Very low	155 Å²	155	128.7 Å²	128.7	83%	0.829	80%	0.796	S	S	*	*			trans	22.1	122.2	150.7	-75.8	-8.7	0	0	0	123
920	V	36.6	Very low	44.8	Very low	127 Å²	127	127.8 Å²	127.8	77%	0.77	80%	0.8	S	S	*	*			trans	62.1	113.9	131.9	-168.3	0	0	0	0	119.5
921	Q	40.5	Very low	46.1	Very low	195 Å²	195	128.2 Å²	128.2	91%	0.911	80%	0.803	S	S	*	*				-170.2	164.2	116.6	-101.9	176.2	11.6	0	0	112
922	Q	38.5	Very low	47.1	Very low	202 Å²	202	128.2 Å²	128.2	94%	0.944	80%	0.803	S	S	*	*			trans	-102.4	151.1	-171.3	-65.6	167.8	-52.6	0	0	112.8
923	A	41	Very low	48.2	Very low	97 Å²	97	126.9 Å²	126.9	80%	0.802	80%	0.802	S	S	*	*			trans	-137.9	154.5	166.2	0	0	0	0	0	109.7
924	P	45.4	Very low	49	Very low	135 Å²	135	127 Å²	127	88%	0.877	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-83.2	160.5	-155.6	31.8	-36.7	0	0	0	116
925	A	38.7	Very low	50.1	Low	89 Å²	89	126.2 Å²	126.2	74%	0.736	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-86.3	154.3	-174.5	0	0	0	0	0	114.4
926	P	57.1	Low	51.7	Low	115 Å²	115	124 Å²	124	75%	0.747	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-71.3	150.4	164.4	32.1	-34.7	0	0	0	111.2
927	Q	45.9	Very low	52.9	Low	199 Å²	199	124.6 Å²	124.6	93%	0.93	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-70.5	131.4	179.5	-70.9	178.7	-31.7	0	0	111.9
928	V	46.1	Very low	54.1	Low	139 Å²	139	122.3 Å²	122.3	84%	0.842	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-99.2	123.7	173.6	178.1	0	0	0	0	108.7
929	G	56.1	Low	56	Low	54 Å²	54	124.1 Å²	124.1	56%	0.557	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-67.8	154.3	172.7	0	0	0	0	0	111.8
930	P	64.9	Low	57.7	Low	123 Å²	123	122.3 Å²	122.3	80%	0.799	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-60.9	136.6	-177.8	25.8	-34.3	0	0	0	111
931	P	67.3	Low	59.4	Low	114 Å²	114	122.1 Å²	122.1	74%	0.74	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-64.8	151.4	175.2	28.5	-34.7	0	0	0	110.7
932	P	69.2	Low	61.1	Low	124 Å²	124	117 Å²	117	81%	0.805	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-59.4	147.2	172.2	27.2	-34.6	0	0	0	110.4	A934	P932-A934 PolarHBondContact O-N 2.87Å
933	A	68	Low	62.9	Low	99 Å²	99	113 Å²	113	82%	0.818	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-56.4	132.2	-179.3	0	0	0	0	0	111
934	A	60.8	Low	64.3	Low	88 Å²	88	113.8 Å²	113.8	73%	0.727	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-59.6	136.6	176.6	0	0	0	0	0	110	P932	P932-A934 PolarHBondContact O-N 2.87Å
935	P	70.8	Confident	65.7	Low	116 Å²	116	113.1 Å²	113.1	75%	0.753	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-60.3	146.1	173.2	26.9	-34	0	0	0	109.6
936	P	75.5	Confident	67.4	Low	114 Å²	114	113.1 Å²	113.1	74%	0.74	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-58.2	147.7	176.4	26	-34.4	0	0	0	110.2	A938	P936-A938 PolarHBondContact O-N 3.2Å
937	P	70.2	Confident	68	Low	123 Å²	123	113.7 Å²	113.7	80%	0.799	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-56.9	133.2	179.2	24.6	-34	0	0	0	109.7
938	A	67	Low	69.2	Low	87 Å²	87	108.4 Å²	108.4	72%	0.719	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-56.1	138.7	175.2	0	0	0	0	0	109.5	P936	P936-A938 PolarHBondContact O-N 3.2Å
939	P	77.6	Confident	70.6	Confident	112 Å²	112	107.7 Å²	107.7	73%	0.727	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-57.6	145.9	175.3	25.8	-34.1	0	0	0	109.5
940	P	75.5	Confident	71.2	Confident	116 Å²	116	109.3 Å²	109.3	75%	0.753	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-56	141.1	177.7	24.8	-34	0	0	0	109.6	A942	P940-A942 PolarHBondContact O-N 2.97Å
941	P	72.2	Confident	71.5	Confident	124 Å²	124	108.8 Å²	108.8	81%	0.805	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-56.2	137.5	178.3	24.7	-33.8	0	0	0	109.3
942	A	74.4	Confident	72	Confident	88 Å²	88	108.8 Å²	108.8	73%	0.727	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-53.7	139.2	176.7	0	0	0	0	0	109.5	P940	P940-A942 PolarHBondContact O-N 2.97Å
943	P	76.5	Confident	72.2	Confident	116 Å²	116	108.4 Å²	108.4	75%	0.753	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-55.8	139.1	177.1	24.6	-33.7	0	0	0	109.1
944	P	71.7	Confident	72.2	Confident	114 Å²	114	109.7 Å²	109.7	74%	0.74	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-56.8	143.3	-179.5	24.5	-33.9	0	0	0	109.7	A946	P944-A946 PolarHBondContact O-N 3.2Å
945	P	75.1	Confident	72.6	Confident	121 Å²	121	110.2 Å²	110.2	79%	0.786	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-55	139.7	177.2	24.5	-33.8	0	0	0	109.5
946	A	73.4	Confident	72.3	Confident	90 Å²	90	108.9 Å²	108.9	74%	0.744	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-52.4	138.8	-179.6	0	0	0	0	0	110.1	P944 A948	P944-A946 PolarHBondContact O-N 3.2Å; A946-A948 PolarHBondContact O-N 2.95Å
947	P	70.3	Confident	71.8	Confident	127 Å²	127	109.5 Å²	109.5	83%	0.825	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-51.6	129.5	-179.4	-27.3	34.6	0	0	0	110.8
948	A	70.4	Confident	71.4	Confident	88 Å²	88	107.9 Å²	107.9	73%	0.727	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-54.5	137.3	171.7	0	0	0	0	0	108.6	A946 A950	A946-A948 PolarHBondContact O-N 2.95Å; A948-A950 PolarHBondContact O-N 2.93Å
949	P	75.2	Confident	71.3	Confident	124 Å²	124	109.8 Å²	109.8	81%	0.805	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-55.7	133.9	179.3	23.9	-33.5	0	0	0	109.1
950	A	68.1	Low	70.2	Confident	88 Å²	88	108.7 Å²	108.7	73%	0.727	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-54.1	135.4	-176.1	0	0	0	0	0	110	A948	A948-A950 PolarHBondContact O-N 2.93Å
951	P	72.7	Confident	69.6	Low	112 Å²	112	109.2 Å²	109.2	73%	0.727	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-57.7	143.8	176.1	25.6	-33.9	0	0	0	109.2
952	P	78.1	Confident	68.8	Low	114 Å²	114	107.6 Å²	107.6	74%	0.74	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-56.4	145.4	177	25.1	-34.1	0	0	0	109.8
953	P	73	Confident	67.8	Low	115 Å²	115	109.6 Å²	109.6	75%	0.747	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-56.7	144.1	-179.1	24.4	-34.2	0	0	0	110.2	A955	P953-A955 PolarHBondContact O-N 2.93Å
954	P	67.7	Low	66.6	Low	127 Å²	127	109 Å²	109	83%	0.825	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-51.8	133	177.5	-26.4	34.4	0	0	0	110.9	A956	P954-A956 PolarHBondContact O-N 2.85Å
955	A	68.4	Low	65.4	Low	98 Å²	98	106.9 Å²	106.9	81%	0.81	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-55.4	133.6	173.1	0	0	0	0	0	109.1	P953	P953-A955 PolarHBondContact O-N 2.93Å
956	A	65.1	Low	64	Low	89 Å²	89	107.9 Å²	107.9	74%	0.736	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-55.3	137.7	-178.3	0	0	0	0	0	110.2	P954 A958	P954-A956 PolarHBondContact O-N 2.85Å; A956-A958 PolarHBondContact O-N 2.97Å
957	P	64.7	Low	62.6	Low	126 Å²	126	107.5 Å²	107.5	82%	0.818	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-53	130.7	178	-26.8	34.7	0	0	0	110.9
958	A	63	Low	61.2	Low	90 Å²	90	104.9 Å²	104.9	74%	0.744	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-57.7	141	174.1	0	0	0	0	0	109.6	A956 A960	A956-A958 PolarHBondContact O-N 2.97Å; A958-A960 PolarHBondContact O-N 2.87Å
959	P	64.5	Low	60	Low	126 Å²	126	109 Å²	109	82%	0.818	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-54	133.1	177.5	-26	34.6	0	0	0	111.2
960	A	54.9	Low	58.6	Low	89 Å²	89	108.6 Å²	108.6	74%	0.736	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-58.1	137.4	176.6	0	0	0	0	0	110.1	A958 A962	A958-A960 PolarHBondContact O-N 2.87Å; A960-A962 PolarHBondContact O-N 3.03Å
961	P	62.1	Low	57.3	Low	128 Å²	128	111.9 Å²	111.9	83%	0.831	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-55.3	135.9	176.9	-26.1	34.8	0	0	0	111.5
962	A	55.1	Low	56	Low	90 Å²	90	112.9 Å²	112.9	74%	0.744	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-61.4	138.7	178.6	0	0	0	0	0	110.9	A960 A964	A960-A962 PolarHBondContact O-N 3.03Å; A962-A964 PolarHBondContact O-N 3.44Å
963	P	54.1	Low	54.3	Low	129 Å²	129	111 Å²	111	84%	0.838	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-66.9	125.3	-179.9	27.1	-33.8	0	0	0	110.8
964	A	51.7	Low	52.8	Low	103 Å²	103	109.4 Å²	109.4	85%	0.851	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-66.1	143.9	171.8	0	0	0	0	0	111	A962	A962-A964 PolarHBondContact O-N 3.44Å
965	G	45.7	Very low	51.6	Low	70 Å²	70	110.3 Å²	110.3	72%	0.722	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-70.7	167.2	-171.9	0	0	0	0	0	115.5
966	P	44.8	Very low	50.6	Low	143 Å²	143	111.2 Å²	111.2	93%	0.929	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-97	155.6	-161.3	36.9	-36.8	0	0	0	115.9
967	G	44	Very low	49.6	Very low	82 Å²	82	115 Å²	115	85%	0.845	80%	0.8	S	S	*	*			trans	-162.3	144.3	155.6	0	0	0	0	0	110.3
968	G	41	Very low	48.2	Very low	71 Å²	71	115.4 Å²	115.4	73%	0.732	80%	0.795	S	S	*	*			cis	173.1	108.9	-9.5	0	0	0	0	0	114.1
969	L	46.3	Very low	47.2	Very low	174 Å²	174	116.9 Å²	116.9	91%	0.911	80%	0.797	S	S	*	*			trans	65.9	166	160.3	-64.5	168.1	0	0	0	117.8
970	P	44.9	Very low	46.3	Very low	117 Å²	117	118.1 Å²	118.1	76%	0.76	83%	0.833	S	S	*	*			cis	-119.9	167	-7.3	35.4	-20.1	0	0	0	115.4
971	I	42.3	Very low	45.8	Very low	156 Å²	156	119.6 Å²	119.6	80%	0.8	84%	0.837	S	S	*	*			trans	-117.3	150.7	162.7	-30.2	176	0	0	0	107.2
972	P	44.1	Very low	45	Very low	133 Å²	133	119.1 Å²	119.1	86%	0.864	84%	0.838	S	S	*	*				-144.3	153.8	104.9	37.2	-23.5	0	0	0	111.7
973	G	42.7	Very low	44.4	Very low	76 Å²	76	120.7 Å²	120.7	78%	0.784	84%	0.843	S	S	*	*			cis	163.9	173	13.8	0	0	0	0	0	106.2
974	G	41.7	Very low	43.9	Very low	81 Å²	81	120.2 Å²	120.2	84%	0.835	84%	0.843	S	S	*	*			cis	-160.9	172.9	-1.4	0	0	0	0	0	111.6
975	L	42.6	Very low	43.4	Very low	146 Å²	146	121.3 Å²	121.3	76%	0.764	84%	0.843	S	S	*	*			trans	-109.6	154.4	-178	-99.2	153.7	0	0	0	110.3	K977	L975-K977 HydrophobicContact CD2-CG 4.4Å
976	P	47.9	Very low	43.2	Very low	117 Å²	117	124.7 Å²	124.7	76%	0.76	85%	0.851	S	S	*	*				-138.2	155.3	89.3	34.7	-17.5	0	0	0	112.8
977	K	42.5	Very low	43.1	Very low	167 Å²	167	123.4 Å²	123.4	73%	0.726	85%	0.845	S	S	*	*				63.9	139.9	52.3	-67.1	-165.3	160.9	-170.1	0	113	L975	L975-K977 HydrophobicContact CD2-CG 4.4Å
978	L	37.2	Very low	43	Very low	136 Å²	136	126.6 Å²	126.6	71%	0.712	85%	0.845	S	S	*	*			cis	-157.5	-156.3	-8.4	-104.3	169.3	0	0	0	106.2
979	P	40.8	Very low	43.2	Very low	121 Å²	121	131.3 Å²	131.3	79%	0.786	86%	0.855	S	S	*	*				-116.3	172.4	-92.1	34.9	-16.2	0	0	0	114.9
980	G	45.4	Very low	42.9	Very low	151 Å²	151	127.4 Å²	127.4	100%	1.557	85%	0.85	S	S	*	*			trans	-150.2	0	161.3	0	0	0	0	0	109.1

Retrieved 980 of 980 residues in 707.2 ms (Link to these results)

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