A0A5K4FD46_SCHMA Loading...

CST complex subunit CTC1

AlphaFold DB , UniProt , Accession A0A5K4FD46, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,238 aa.

						>A0A5K4FD46_SCHMA|A0A5K4FD46
MSQSFSSSSSSSSSTITSLTLSSYTSIYGYVQCISRIFLIKDKHTAFIKITSHSNCFYHSIYNIIIQWNVITNEEKYLKFLLNCPINSWIRIHNLKESRIYYKQNRESKVWLFIPDQTYIETLPHPRILSNCNHECCLPQLFPPSSSSSSSSSSTSFPVGLIPSIDLSLISSHCNGIFLEFERTNPNYHQRVNQHYLLLNIDKVIQSIDKLLYRQTIKLFNVWSFYIGDNNDYYDKKSKQCIDLYALLIPGIYSSSSSSIIDIDDKSSNISYSRPTVQCPSVCFNFNEQLTKKNFSLLLHNLNYLFNFCLAYQINGLLQHKEVIHFKENIFRNQDCTLSESFQRLLSNLFIQSRNINFKSYQYAEDFIQFPFISNVQENHQSFNFVKDNIIDLHDIITWLQSSKKSYNLNKDSEEICTLSTTDQCFKCIYTSHYTQFIPSKSSSSLLTTTTNYLWHVQVCETRLQIQLHHNQFQQYHHLLKRSTPISSMMTETSLKNHSESSLYVIGKILWNNTHGCFYLQTVHNNDTTTTTTTNNNNNNKKDNTIFIPLIFNMNTSDEINILYLPSDYSLILLKGVQVIYEEEENPVEVITSENCVDMPFHSTDSVSSISRMYIYAKQIIPFQVNYLSESIMDGYGKTQEQQQSCTIVLVNLGPLSCCSPEASVDPTERSSSSNKLLWSYVFAGKFIENNTVAIGNADTTTAFNNGSSIDSNLMHLSLTGDLAYRWYYNFQIGYHYQLVWVNIDNSTSFTNDQSPLRQLINVSILNNSTLINRENLSLVNVANLNDIIHEGSKYPIGCLLNFEAIILFKQCCSLNGDCILWVTTCNELPKSLSNFNDIDITTVYKVNLSRKIKSVNNLDLISLFTTSNQTILYCRFTNFSLSEIIPRSSSSSLTSLHLNYTDLSHIIIVNQMNTDSMLNKISTQLSDSLMISLDNEYDNSPIVTKEPKLLISNNYDWIGRSISTGYSNIEGDLFKEHINVQATITRCLEFQIYRLSNNTGDDQNDDFVNLGICIRFVITDGSGSALVQLGHPFIMPSSSSSGVPCQILSNNDSSSTSPEDNLELARLLLGLNCLIWKRLCCQWKRLLDQGVDLSFNFYEVTNDSTTSECNTLSFSSSSASFSSEVTSNNKYNLIPIKLALKTYLNSPTFLRNCRFTLKYRTKNTPRCHRSTTTSTSSLSNSADHWRLKQINLKDSDNSLYSHDNHLGQQQSVYFVLPPYKLYTLINVTSHDDYFNEL
					

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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	27.1	Very low	27.4	Very low	251 Å²	251	139.5 Å²	139.5	100%	1.236	85%	0.851	S	S	*	*				0	124	0	-62.3	171.6	174.6	0	0	106.2
2	S	30.1	Very low	27.2	Very low	118 Å²	118	137.2 Å²	137.2	83%	0.825	85%	0.845	S	S	*	*			cis	-135.5	146.6	2.5	36.1	0	0	0	0	109.3
3	Q	23	Very low	27	Very low	175 Å²	175	134.9 Å²	134.9	82%	0.818	84%	0.838	S	S	*	*			trans	-86.9	131.4	167.8	-75.4	175.6	-27	0	0	108.8
4	S	31.3	Very low	26.8	Very low	114 Å²	114	132.1 Å²	132.1	80%	0.797	83%	0.826	S	S	*	*			trans	-122.5	96.2	163.1	53.1	0	0	0	0	109.8
5	F	25	Very low	26.7	Very low	171 Å²	171	132.1 Å²	132.1	75%	0.75	83%	0.825	S	S	*	*			trans	-45.3	157.7	145.2	-70.2	-96.7	0	0	0	110.1
6	S	25.6	Very low	26.7	Very low	105 Å²	105	134.4 Å²	134.4	73%	0.734	83%	0.828	S	S	*	*			cis	-177.2	149.4	-3.2	42.2	0	0	0	0	108
7	S	30.8	Very low	26.5	Very low	125 Å²	125	133.1 Å²	133.1	87%	0.874	82%	0.819	S	S	*	*			trans	-155.4	114.7	149.3	45.7	0	0	0	0	111.1
8	S	25.5	Very low	26.6	Very low	120 Å²	120	132.1 Å²	132.1	84%	0.839	82%	0.819	S	S	*	*			trans	-91.9	128.1	176.6	50.4	0	0	0	0	110.9
9	S	28.8	Very low	26.6	Very low	116 Å²	116	133.6 Å²	133.6	81%	0.811	82%	0.82	S	S	*	*			trans	-130.5	85.9	162.2	46.2	0	0	0	0	109.8	S11	S9-S11 PolarHBondContact O-N 3.28Å
10	S	24.6	Very low	26.8	Very low	122 Å²	122	133.1 Å²	133.1	85%	0.853	82%	0.817	S	S	*	*			trans	-73.2	114.8	172.1	51.2	0	0	0	0	110.9
11	S	30.1	Very low	27	Very low	118 Å²	118	135 Å²	135	83%	0.825	82%	0.821	S	S	*	*			trans	-132.2	104.4	160	47.1	0	0	0	0	110	S9	S9-S11 PolarHBondContact O-N 3.28Å
12	S	24.7	Very low	27.7	Very low	111 Å²	111	125.9 Å²	125.9	78%	0.776	78%	0.782	S	S	*	*			trans	-75.2	137.3	174.5	50.7	0	0	0	0	111.7
13	S	24.8	Very low	28.7	Very low	108 Å²	108	124.3 Å²	124.3	76%	0.755	77%	0.771	S	S	*	*				168.2	145	109	48.9	0	0	0	0	115
14	S	24.3	Very low	30.3	Very low	96 Å²	96	121 Å²	121	67%	0.671	75%	0.752	S	S	*	*			trans	56.2	97.9	150.4	54.4	0	0	0	0	120.9
15	T	24.7	Very low	32.1	Very low	131 Å²	131	117.3 Å²	117.3	80%	0.804	72%	0.724	S	S	*	*				45.8	100.4	124.9	53.8	0	0	0	0	119.2
16	I	26.4	Very low	34.5	Very low	170 Å²	170	112.2 Å²	112.2	87%	0.872	71%	0.71	S	S	*	*			trans	-116.3	134	139.9	-64.7	-178.8	0	0	0	108.1
17	T	24.7	Very low	36.8	Very low	112 Å²	112	107.6 Å²	107.6	69%	0.687	68%	0.677	S	S	*	*			trans	-71.7	129.6	-167.6	42.9	0	0	0	0	114.2	L19	T17-L19 PolarHBondContact O-N 3.34Å
18	S	26.9	Very low	38.9	Very low	115 Å²	115	107.3 Å²	107.3	80%	0.804	66%	0.657	S	S	*	*			trans	22.8	68.2	141.8	63.3	0	0	0	0	118	T20	S18-T20 PolarHBondContact O-N 3.38Å
19	L	27.4	Very low	41.3	Very low	161 Å²	161	101.6 Å²	101.6	84%	0.843	62%	0.617	S	S	*	*			trans	-80.1	94.3	155	-81.2	164.3	0	0	0	108	T17 L21	T17-L19 PolarHBondContact O-N 3.34Å; L19-L21 PolarHBondContact O-N 2.86Å
20	T	30.1	Very low	43.1	Very low	123 Å²	123	97.1 Å²	97.1	76%	0.755	58%	0.583	S	S	*	*			trans	13.2	103.6	160.9	54.2	0	0	0	0	115.5	S18 S22	S18-T20 PolarHBondContact O-N 3.38Å; T20-S22 PolarHBondContact O-N 3.4Å
21	L	31.6	Very low	45.1	Very low	173 Å²	173	91.6 Å²	91.6	91%	0.906	54%	0.544	S	S	*	.			trans	-57.3	104.1	163.3	-88.5	79.2	0	0	0	108	L19 S23	L19-L21 PolarHBondContact O-N 2.86Å; L21-S23 PolarHBondContact O-N 2.95Å
22	S	42	Very low	46.6	Very low	59 Å²	59	87.4 Å²	87.4	41%	0.413	51%	0.511	S	S	.	.			trans	-59.3	123.8	168.2	53.5	0	0	0	0	107.7	T20 Y24	T20-S22 PolarHBondContact O-N 3.4Å; S22-Y24 WeakPolarHBondContact O-CD2 3.31Å; S22-Y24 PolarHBondContact O-N 3.48Å
23	S	50.6	Low	48	Very low	86 Å²	86	84.6 Å²	84.6	60%	0.601	49%	0.491	S	S	*	.			trans	-64	93.4	-174.4	53.1	0	0	0	0	111.2	L21 T25	L21-S23 PolarHBondContact O-N 2.95Å; S23-T25 PolarHBondContact O-N 2.71Å
24	Y	57.6	Low	48.4	Very low	106 Å²	106	85.7 Å²	85.7	42%	0.416	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	126.3	165.1	-70.7	-85.5	0	0	0	108.7	S22 N94 L95 I114 Q117	S22-Y24 WeakPolarHBondContact O-CD2 3.31Å; S22-Y24 PolarHBondContact O-N 3.48Å; Y24-N94 HydrophobicContact CD1-CB 4.22Å; Y24-L95 WeakPolarHBondContact CA-O 3.48Å; Y24-I114 HydrophobicContact CD1-CD1 4.49Å; Y24-I114 HydrophobicContact CE1-CD1 3.72Å; Y24-Q117 PolarHBondContact OH-OE1 2.86Å
25	T	68.9	Low	48.7	Very low	36 Å²	36	85.3 Å²	85.3	22%	0.221	48%	0.484	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	161.2	-177.2	63.7	0	0	0	0	111.5	S23 N94 L95 W111	S23-T25 PolarHBondContact O-N 2.71Å; T25-N94 PolarHBondContact O-N 2.98Å; T25-N94 VanDerWaalsContact O-N 3.09Å; T25-L95 PolarHBondContact N-O 2.88Å; T25-L95 PolarHBondContact O-N 3.37Å; T25-W111 HydrophobicContact CG2-CH2 3.85Å; T25-W111 HydrophobicContact CG2-CZ3 3.55Å; T25-W111 VanDerWaalsContact OG1-CE3 3.22Å; T25-W111 WeakPolarHBondContact OG1-CZ3 3.38Å
26	S	74.7	Confident	48.8	Very low	63 Å²	63	89.3 Å²	89.3	44%	0.441	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	131.7	167	-55.4	0	0	0	0	109.1	I92 H93	S26-I92 CarbonylContact C-O 3.59Å; S26-I92 WeakPolarHBondContact CA-O 3.25Å; S26-H93 PolarHBondContact OG-ND1 3.17Å
27	I	74.2	Confident	49.1	Very low	8 Å²	8	86 Å²	86	4%	0.041	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	138.7	178	-57.3	176	0	0	0	108.2	Y62 R91 I92 L95 W111	I27-Y62 HydrophobicContact CG2-CD1 4.38Å; I27-Y62 HydrophobicContact CG2-CD2 3.57Å; I27-Y62 HydrophobicContact CG2-CE2 4.18Å; I27-Y62 HydrophobicContact CG2-CG 3.68Å; I27-R91 CarbonylContact O-C 3.6Å; I27-R91 VanDerWaalsContact O-CA 3.31Å; I27-R91 WeakPolarHBondContact O-CA 3.47Å; I27-I92 PolarHBondContact N-O 3.21Å; I27-I92 PolarHBondContact O-N 3.33Å; I27-L95 HydrophobicContact CB-CD1 4.27Å; I27-L95 HydrophobicContact CD1-CD1 3.49Å; I27-L95 VanDerWaalsContact CD1-CD1 3.49Å; I27-L95 HydrophobicContact CG1-CD1 3.91Å; I27-W111 HydrophobicContact CD1-CB 3.83Å; I27-W111 HydrophobicContact CD1-CD2 3.53Å; I27-W111 HydrophobicContact CD1-CE3 4.27Å; I27-W111 HydrophobicContact CD1-CG 3.28Å; I27-W111 HydrophobicContact CG1-CD2 4.46Å
28	Y	74.8	Confident	49.5	Very low	119 Å²	119	87.7 Å²	87.7	47%	0.467	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	147.9	171.9	72.8	-83.2	0	0	0	110	I90	Y28-I90 WeakPolarHBondContact CA-O 3.43Å
29	G	74.9	Confident	49.5	Very low	0 Å²	0	87.9 Å²	87.9	0%	0	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	164.7	-170.6	172.9	0	0	0	0	0	113.1	I50 T51 W89 I90	G29-I50 VanDerWaalsContact CA-CG2 3.47Å; G29-T51 CarbonylContact C-O 3.59Å; G29-T51 VanDerWaalsContact CA-O 3.32Å; G29-T51 WeakPolarHBondContact CA-O 3.29Å; G29-W89 WeakPolarHBondContact O-CA 3.44Å; G29-I90 PolarHBondContact N-O 3.37Å; G29-I90 VanDerWaalsContact N-O 3.09Å; G29-I90 PolarHBondContact O-N 2.97Å
30	Y	67.6	Low	49.8	Very low	23 Å²	23	84.2 Å²	84.2	9%	0.09	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	133	-177.2	-172	-96.5	0	0	0	111.6	Q32 I50 T51 N87 S88 W89	Y30-Q32 HydrophobicContact CD1-CB 3.92Å; Y30-Q32 HydrophobicContact CD1-CG 4.17Å; Y30-Q32 HydrophobicContact CE1-CB 4.21Å; Y30-Q32 HydrophobicContact CE1-CG 4.12Å; Y30-Q32 PolarHBondContact O-N 2.84Å; Y30-I50 WeakPolarHBondContact O-CA 3.44Å; Y30-T51 PolarHBondContact N-O 3.43Å; Y30-T51 PolarHBondContact O-N 2.76Å; Y30-T51 PolarHBondContact O-OG1 3.44Å; Y30-N87 VanDerWaalsContact OH-CA 3.25Å; Y30-N87 WeakPolarHBondContact OH-CA 3.05Å; Y30-N87 VanDerWaalsContact OH-CB 3.24Å; Y30-N87 WeakPolarHBondContact OH-CB 3.37Å; Y30-N87 PolarHBondContact OH-O 2.88Å; Y30-N87 PolarHBondContact OH-OD1 3.31Å; Y30-N87 VanDerWaalsContact OH-OD1 3.11Å; Y30-S88 WeakPolarHBondContact CA-O 3.32Å; Y30-S88 WeakPolarHBondContact CD2-O 3.27Å; Y30-W89 AromaticContact CD2-CD1 3.69Å; Y30-W89 HydrophobicContact CD2-CD2 4.22Å; Y30-W89 AromaticContact CD2-CE2 3.93Å; Y30-W89 HydrophobicContact CD2-CG 4.11Å; Y30-W89 AromaticContact CD2-NE1 3.56Å
31	V	67	Low	50.1	Low	5 Å²	5	88.8 Å²	88.8	3%	0.03	45%	0.447	C	S	.	.			trans	-86.4	85.9	177.2	-171.9	0	0	0	0	109.4	I48 N87 S88 I90	V31-I48 HydrophobicContact CG1-CG2 4.45Å; V31-N87 PolarHBondContact O-N 3.09Å; V31-S88 PolarHBondContact N-O 3.15Å; V31-I90 HydrophobicContact CG2-CD1 3.38Å; V31-I90 HydrophobicContact CG2-CG1 3.65Å; V31-I90 HydrophobicContact CG2-CG2 4.13Å
32	Q	61	Low	50.2	Low	31 Å²	31	85.7 Å²	85.7	15%	0.145	43%	0.431	C	S	.	.			trans	-79.1	-15.6	-172.7	-153.3	-172.9	3.2	0	0	114.4	Y30 I34 S54 F57	Y30-Q32 HydrophobicContact CD1-CB 3.92Å; Y30-Q32 HydrophobicContact CD1-CG 4.17Å; Y30-Q32 HydrophobicContact CE1-CB 4.21Å; Y30-Q32 HydrophobicContact CE1-CG 4.12Å; Y30-Q32 PolarHBondContact O-N 2.84Å; Q32-I34 PolarHBondContact O-N 3.42Å; Q32-I34 VanDerWaalsContact O-N 3.1Å; Q32-S54 PolarHBondContact NE2-O 3.37Å; Q32-F57 VanDerWaalsContact OE1-CE1 3.28Å
33	C	53	Low	50.2	Low	52 Å²	52	90.9 Å²	90.9	35%	0.351	45%	0.446	S	S	.	.			trans	-79.5	100.8	-161.4	-92.7	0	0	0	0	115.2
34	I	33.5	Very low	50.2	Low	131 Å²	131	89.1 Å²	89.1	67%	0.672	43%	0.429	S	S	*	.			trans	-77	135.4	145	-60.9	167.1	0	0	0	108	Q32 I86	Q32-I34 PolarHBondContact O-N 3.42Å; Q32-I34 VanDerWaalsContact O-N 3.1Å; I34-I86 HydrophobicContact CG1-CG2 4.35Å
35	S	30.4	Very low	50	Low	88 Å²	88	85.3 Å²	85.3	62%	0.615	42%	0.416	S	S	*	.	S	Bend	trans	90.2	123.5	168	-158.3	0	0	0	0	119.7
36	R	27.9	Very low	49.4	Very low	214 Å²	214	84 Å²	84	81%	0.808	41%	0.41	S	S	*	.			trans	55.1	101.7	156.3	-66.1	177.9	-169.7	-164.6	2.2	118.7	F38	R36-F38 WeakPolarHBondContact O-CD2 3.46Å; R36-F38 PolarHBondContact O-N 2.97Å; R36-F38 VanDerWaalsContact O-N 3.14Å
37	I	32.7	Very low	48.6	Very low	100 Å²	100	83.7 Å²	83.7	51%	0.513	40%	0.4	S	S	.	.			trans	-45.2	113.7	151.2	-59.8	164.3	0	0	0	108.9	L39 A46	I37-L39 HydrophobicContact CG2-CD2 4.46Å; I37-L39 HydrophobicContact CG2-CG 4.26Å; I37-L39 PolarHBondContact O-N 3.22Å; I37-L39 VanDerWaalsContact O-N 3.13Å; I37-A46 HydrophobicContact CG2-CB 4.3Å
38	F	31.8	Very low	48	Very low	149 Å²	149	84.3 Å²	84.3	65%	0.654	40%	0.404	S	S	*	.			trans	-77.7	95.1	169.3	-79.3	-91	0	0	0	109	R36 I40	R36-F38 WeakPolarHBondContact O-CD2 3.46Å; R36-F38 PolarHBondContact O-N 2.97Å; R36-F38 VanDerWaalsContact O-N 3.14Å; F38-I40 VanDerWaalsContact C-N 3.32Å; F38-I40 HydrophobicContact CB-CG1 4.49Å; F38-I40 PolarHBondContact O-N 3.39Å
39	L	28.2	Very low	47.5	Very low	119 Å²	119	81.1 Å²	81.1	62%	0.623	39%	0.392	S	S	*	.			trans	-66.5	87.2	170.8	-76	165	0	0	0	109.9	I37 K41	I37-L39 HydrophobicContact CG2-CD2 4.46Å; I37-L39 HydrophobicContact CG2-CG 4.26Å; I37-L39 PolarHBondContact O-N 3.22Å; I37-L39 VanDerWaalsContact O-N 3.13Å; L39-K41 PolarHBondContact O-N 3.42Å
40	I	32.9	Very low	47	Very low	84 Å²	84	81.1 Å²	81.1	43%	0.431	39%	0.392	S	S	.	.			trans	-77.7	91.4	177.4	-56.6	-168.9	0	0	0	109.9	F38 D42 F47	F38-I40 VanDerWaalsContact C-N 3.32Å; F38-I40 HydrophobicContact CB-CG1 4.49Å; F38-I40 PolarHBondContact O-N 3.39Å; I40-D42 PolarHBondContact O-N 2.91Å; I40-F47 HydrophobicContact CB-CE2 4.48Å; I40-F47 HydrophobicContact CD1-CD2 4.32Å; I40-F47 HydrophobicContact CD1-CE1 4.39Å; I40-F47 HydrophobicContact CD1-CE2 3.38Å; I40-F47 HydrophobicContact CD1-CZ 3.42Å; I40-F47 VanDerWaalsContact CD1-CZ 3.42Å; I40-F47 HydrophobicContact CG1-CD2 4.47Å; I40-F47 HydrophobicContact CG1-CE2 3.76Å; I40-F47 HydrophobicContact CG1-CZ 4.32Å
41	K	36.5	Very low	46.9	Very low	218 Å²	218	80 Å²	80	95%	0.948	39%	0.388	S	S	*	.	S	Bend	trans	62.5	-24.9	158.1	-149.7	175.8	-174.3	-178.3	0	118.2	L39	L39-K41 PolarHBondContact O-N 3.42Å
42	D	34.6	Very low	46.6	Very low	109 Å²	109	80.6 Å²	80.6	58%	0.583	39%	0.392	S	S	*	.	S	Bend	trans	-118.9	141.3	169.3	-152.4	-18.8	0	0	0	107.2	I40 H44	I40-D42 PolarHBondContact O-N 2.91Å; D42-H44 PolarHBondContact O-N 2.84Å; D42-H44 IonicContact OD1-CD2 2.67Å
43	K	41.8	Very low	46.4	Very low	167 Å²	167	84.7 Å²	84.7	73%	0.726	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	7.7	-164.5	-72.9	-177.8	178.7	-179.8	0	114.3
44	H	50.9	Low	46.5	Very low	50 Å²	50	84 Å²	84	23%	0.231	41%	0.407	C	S	.	.	T	Hydrogen-bonded Turn	trans	-133.5	33.2	-159	-43.3	-59.6	0	0	0	113.5	D42 W68 V70	D42-H44 PolarHBondContact O-N 2.84Å; D42-H44 IonicContact OD1-CD2 2.67Å; H44-W68 HydrophobicContact CB-CB 4.14Å; H44-W68 HydrophobicContact CB-CD2 4.28Å; H44-W68 HydrophobicContact CB-CE3 3.88Å; H44-W68 HydrophobicContact CB-CG 4.45Å; H44-W68 WeakPolarHBondContact CB-O 3.48Å; H44-W68 AromaticContact ND1-CE3 3.62Å; H44-W68 AromaticContact ND1-CZ3 3.54Å; H44-W68 WeakPolarHBondContact O-CA 3.47Å; H44-W68 WeakPolarHBondContact O-CB 3.15Å; H44-W68 PolarHBondContact O-N 3.46Å; H44-V70 WeakPolarHBondContact CE1-CG2 3.39Å; H44-V70 WeakPolarHBondContact ND1-CG2 3.48Å
45	T	52.7	Low	47.3	Very low	25 Å²	25	84.7 Å²	84.7	15%	0.153	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	125.9	172	-53	0	0	0	0	111.1	F47 I65 I66	T45-F47 HydrophobicContact CG2-CD2 4.21Å; T45-F47 HydrophobicContact CG2-CE2 3.68Å; T45-F47 HydrophobicContact CG2-CZ 4.47Å; T45-I65 HydrophobicContact CG2-CG2 3.78Å; T45-I66 CarbonylContact C-O 3.56Å; T45-I66 WeakPolarHBondContact CA-O 3.34Å
46	A	56.7	Low	48	Very low	10 Å²	10	82.3 Å²	82.3	8%	0.083	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	149.5	174.7	0	0	0	0	0	111.2	I37 I66 Y77	I37-A46 HydrophobicContact CG2-CB 4.3Å; A46-I66 HydrophobicContact CB-CB 4.32Å; A46-I66 PolarHBondContact N-O 3.29Å; A46-I66 PolarHBondContact O-N 2.85Å; A46-Y77 HydrophobicContact CB-CE2 4.43Å
47	F	57.8	Low	48.8	Very low	56 Å²	56	78 Å²	78	25%	0.246	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	128.3	-176.3	-82.3	-100.1	0	0	0	110.3	I40 T45 I64 I65 I100	I40-F47 HydrophobicContact CB-CE2 4.48Å; I40-F47 HydrophobicContact CD1-CD2 4.32Å; I40-F47 HydrophobicContact CD1-CE1 4.39Å; I40-F47 HydrophobicContact CD1-CE2 3.38Å; I40-F47 HydrophobicContact CD1-CZ 3.42Å; I40-F47 VanDerWaalsContact CD1-CZ 3.42Å; I40-F47 HydrophobicContact CG1-CD2 4.47Å; I40-F47 HydrophobicContact CG1-CE2 3.76Å; I40-F47 HydrophobicContact CG1-CZ 4.32Å; T45-F47 HydrophobicContact CG2-CD2 4.21Å; T45-F47 HydrophobicContact CG2-CE2 3.68Å; T45-F47 HydrophobicContact CG2-CZ 4.47Å; F47-I64 WeakPolarHBondContact CA-O 3.48Å; F47-I65 HydrophobicContact CD1-CG1 3.87Å; F47-I65 HydrophobicContact CE1-CD1 3.78Å; F47-I65 HydrophobicContact CE1-CG1 3.33Å; F47-I65 HydrophobicContact CE2-CG1 4.11Å; F47-I65 HydrophobicContact CG-CG1 4.47Å; F47-I65 HydrophobicContact CZ-CD1 3.7Å; F47-I65 HydrophobicContact CZ-CG1 3.45Å; F47-I65 VanDerWaalsContact CZ-CG1 3.45Å; F47-I100 HydrophobicContact CE1-CD1 3.56Å; F47-I100 HydrophobicContact CZ-CD1 3.92Å
48	I	61.4	Low	49.2	Very low	21 Å²	21	82.4 Å²	82.4	11%	0.108	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	128.1	176.7	-59.5	176.6	0	0	0	108.6	V31 I50 I64 I66 F80 L81	V31-I48 HydrophobicContact CG1-CG2 4.45Å; I48-I50 HydrophobicContact CG2-CG1 4.29Å; I48-I64 PolarHBondContact N-O 3.24Å; I48-I64 PolarHBondContact O-N 3.39Å; I48-I66 HydrophobicContact CD1-CD1 3.75Å; I48-I66 HydrophobicContact CG1-CD1 4.49Å; I48-F80 HydrophobicContact CD1-CE1 3.73Å; I48-L81 HydrophobicContact CD1-CD2 3.99Å
49	K	64.9	Low	49.6	Very low	51 Å²	51	80.9 Å²	80.9	22%	0.222	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	128	176.2	179	175.8	172.7	169.5	0	109.6	I61	K49-I61 HydrophobicContact CD-CG2 4.11Å; K49-I61 HydrophobicContact CG-CG2 3.83Å
50	I	64.3	Low	50.6	Low	0 Å²	0	78.2 Å²	78.2	0%	0	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	132.2	175.3	-58.9	-171.8	0	0	0	108.4	G29 Y30 I48 Y62 I64 I90 I92	G29-I50 VanDerWaalsContact CA-CG2 3.47Å; Y30-I50 WeakPolarHBondContact O-CA 3.44Å; I48-I50 HydrophobicContact CG2-CG1 4.29Å; I50-Y62 PolarHBondContact N-O 3.01Å; I50-Y62 PolarHBondContact O-N 3.35Å; I50-I64 HydrophobicContact CD1-CD1 3.52Å; I50-I64 HydrophobicContact CD1-CG1 4.5Å; I50-I64 HydrophobicContact CG1-CD1 4.24Å; I50-I90 HydrophobicContact CD1-CD1 3.85Å; I50-I90 HydrophobicContact CD1-CG1 4.12Å; I50-I92 HydrophobicContact CD1-CD1 3.6Å
51	T	64.1	Low	51.5	Low	0 Å²	0	77.3 Å²	77.3	0%	0	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	151.5	180	55.7	0	0	0	0	111.1	G29 Y30 H53 C56	G29-T51 CarbonylContact C-O 3.59Å; G29-T51 VanDerWaalsContact CA-O 3.32Å; G29-T51 WeakPolarHBondContact CA-O 3.29Å; Y30-T51 PolarHBondContact N-O 3.43Å; Y30-T51 PolarHBondContact O-N 2.76Å; Y30-T51 PolarHBondContact O-OG1 3.44Å; T51-H53 WeakPolarHBondContact CB-O 3.49Å; T51-H53 PolarHBondContact O-N 2.97Å; T51-H53 PolarHBondContact OG1-O 2.89Å; T51-C56 WeakPolarHBondContact CB-O 3.29Å; T51-C56 WeakPolarHBondContact CG2-O 3.44Å
52	S	60.6	Low	52.5	Low	17 Å²	17	70.5 Å²	70.5	12%	0.119	34%	0.344	C	S	.	.	S	Bend	trans	-69	-14.4	176.1	67.6	0	0	0	0	114.2	H59 S60 W89	S52-H59 PolarHBondContact OG-O 3.09Å; S52-S60 VanDerWaalsContact CB-OG 3.3Å; S52-S60 WeakPolarHBondContact CB-OG 3.49Å; S52-S60 PolarHBondContact N-O 3.12Å; S52-S60 PolarHBondContact OG-OG 3.46Å; S52-S60 VanDerWaalsContact OG-OG 3.08Å; S52-W89 WeakPolarHBondContact O-CH2 3.33Å
53	H	56.9	Low	53.7	Low	117 Å²	117	67.7 Å²	67.7	54%	0.542	33%	0.329	S	S	.	.	S	Bend	trans	-144.6	145.9	-179.3	-74.7	69.5	0	0	0	110	T51 N55 C56	T51-H53 WeakPolarHBondContact CB-O 3.49Å; T51-H53 PolarHBondContact O-N 2.97Å; T51-H53 PolarHBondContact OG1-O 2.89Å; H53-N55 PolarHBondContact O-N 3.35Å; H53-C56 HydrophobicContact CB-CB 3.8Å; H53-C56 PolarHBondContact O-N 2.98Å
54	S	55	Low	54.3	Low	39 Å²	39	59.8 Å²	59.8	27%	0.273	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-30.7	179.7	58.5	0	0	0	0	114.3	Q32	Q32-S54 PolarHBondContact NE2-O 3.37Å
55	N	51	Low	54.5	Low	145 Å²	145	58.1 Å²	58.1	78%	0.775	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.7	3.8	-172	-59.1	12	0	0	0	112.9	H53	H53-N55 PolarHBondContact O-N 3.35Å
56	C	44.5	Very low	54.5	Low	38 Å²	38	57.1 Å²	57.1	26%	0.257	28%	0.281	S	S	.	.			trans	-115.4	112	-173.4	-165.1	0	0	0	0	112.8	T51 H53 Y58 H59	T51-C56 WeakPolarHBondContact CB-O 3.29Å; T51-C56 WeakPolarHBondContact CG2-O 3.44Å; H53-C56 HydrophobicContact CB-CB 3.8Å; H53-C56 PolarHBondContact O-N 2.98Å; C56-Y58 VanDerWaalsContact C-N 3.3Å; C56-Y58 PolarHBondContact SG-N 3.26Å; C56-H59 PolarHBondContact SG-N 3.38Å; C56-H59 VanDerWaalsContact SG-N 3.42Å
57	F	46.4	Very low	54.3	Low	124 Å²	124	62.8 Å²	62.8	54%	0.544	31%	0.306	S	S	.	.	S	Bend	trans	-78.6	-8.4	170.5	-77.9	-71.2	0	0	0	114.5	Q32 I61	Q32-F57 VanDerWaalsContact OE1-CE1 3.28Å; F57-I61 WeakPolarHBondContact O-CD1 3.25Å
58	Y	40.5	Very low	54	Low	192 Å²	192	63 Å²	63	75%	0.753	31%	0.305	S	S	*	.	S	Bend	trans	-113.8	-30.2	-160.3	-168.9	-105.6	0	0	0	115.8	C56	C56-Y58 VanDerWaalsContact C-N 3.3Å; C56-Y58 PolarHBondContact SG-N 3.26Å
59	H	39.1	Very low	53.2	Low	117 Å²	117	68.1 Å²	68.1	54%	0.542	33%	0.332	S	S	.	.	S	Bend	trans	-106.2	129.2	-177.5	-90.8	21.4	0	0	0	113.2	S52 C56	S52-H59 PolarHBondContact OG-O 3.09Å; C56-H59 PolarHBondContact SG-N 3.38Å; C56-H59 VanDerWaalsContact SG-N 3.42Å
60	S	50.9	Low	52.2	Low	63 Å²	63	68.6 Å²	68.6	44%	0.441	34%	0.34	S	S	.	.	S	Bend	trans	47.9	67.8	176.6	20.7	0	0	0	0	112.7	S52	S52-S60 VanDerWaalsContact CB-OG 3.3Å; S52-S60 WeakPolarHBondContact CB-OG 3.49Å; S52-S60 PolarHBondContact N-O 3.12Å; S52-S60 PolarHBondContact OG-OG 3.46Å; S52-S60 VanDerWaalsContact OG-OG 3.08Å
61	I	51.8	Low	51.4	Low	64 Å²	64	76.3 Å²	76.3	33%	0.328	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	124.5	173.9	-51.9	167.3	0	0	0	108.9	K49 F57	K49-I61 HydrophobicContact CD-CG2 4.11Å; K49-I61 HydrophobicContact CG-CG2 3.83Å; F57-I61 WeakPolarHBondContact O-CD1 3.25Å
62	Y	56.7	Low	50.6	Low	75 Å²	75	81.4 Å²	81.4	29%	0.294	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	116.3	168.4	-56.5	-71.4	0	0	0	109	I27 I50 W111	I27-Y62 HydrophobicContact CG2-CD1 4.38Å; I27-Y62 HydrophobicContact CG2-CD2 3.57Å; I27-Y62 HydrophobicContact CG2-CE2 4.18Å; I27-Y62 HydrophobicContact CG2-CG 3.68Å; I50-Y62 PolarHBondContact N-O 3.01Å; I50-Y62 PolarHBondContact O-N 3.35Å; Y62-W111 AromaticContact CD1-NE1 3.81Å
63	N	60.5	Low	50.2	Low	51 Å²	51	82.3 Å²	82.3	27%	0.273	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	135.4	170.3	-59.3	-51.1	0	0	0	108.6	V110 W111	N63-V110 HydrophobicContact CB-CG1 4.16Å; N63-V110 HydrophobicContact CB-CG2 4.24Å; N63-V110 WeakPolarHBondContact O-CA 3.41Å; N63-V110 WeakPolarHBondContact O-CG1 3.43Å; N63-W111 PolarHBondContact O-N 3.27Å
64	I	54.2	Low	50.2	Low	0 Å²	0	82 Å²	82	0%	0	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	127.6	177.3	-57.6	-174.8	0	0	0	108.2	F47 I48 I50 I92 L95 W111	F47-I64 WeakPolarHBondContact CA-O 3.48Å; I48-I64 PolarHBondContact N-O 3.24Å; I48-I64 PolarHBondContact O-N 3.39Å; I50-I64 HydrophobicContact CD1-CD1 3.52Å; I50-I64 HydrophobicContact CD1-CG1 4.5Å; I50-I64 HydrophobicContact CG1-CD1 4.24Å; I64-I92 HydrophobicContact CD1-CD1 3.4Å; I64-I92 VanDerWaalsContact CD1-CD1 3.4Å; I64-L95 HydrophobicContact CD1-CD1 3.76Å; I64-L95 HydrophobicContact CG1-CD1 4.44Å; I64-L95 HydrophobicContact CG2-CD2 4.32Å; I64-W111 CarbonylContact C-O 3.49Å; I64-W111 VanDerWaalsContact CA-O 3.31Å; I64-W111 WeakPolarHBondContact CA-O 3.46Å; I64-W111 HydrophobicContact CG1-CB 4.33Å; I64-W111 WeakPolarHBondContact CG2-O 3.24Å
65	I	54.7	Low	50.6	Low	16 Å²	16	88 Å²	88	8%	0.082	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	133.1	167.3	-79.5	165	0	0	0	108.8	T45 F47 Q67 I100 V110 W111 L112 F113	T45-I65 HydrophobicContact CG2-CG2 3.78Å; F47-I65 HydrophobicContact CD1-CG1 3.87Å; F47-I65 HydrophobicContact CE1-CD1 3.78Å; F47-I65 HydrophobicContact CE1-CG1 3.33Å; F47-I65 HydrophobicContact CE2-CG1 4.11Å; F47-I65 HydrophobicContact CG-CG1 4.47Å; F47-I65 HydrophobicContact CZ-CD1 3.7Å; F47-I65 HydrophobicContact CZ-CG1 3.45Å; F47-I65 VanDerWaalsContact CZ-CG1 3.45Å; I65-Q67 HydrophobicContact CG2-CB 4.16Å; I65-I100 HydrophobicContact CD1-CD1 3.51Å; I65-I100 HydrophobicContact CD1-CG1 3.5Å; I65-I100 HydrophobicContact CG1-CD1 4.37Å; I65-V110 HydrophobicContact CB-CG1 4.12Å; I65-V110 HydrophobicContact CD1-CB 4.4Å; I65-V110 HydrophobicContact CD1-CG1 3.6Å; I65-V110 HydrophobicContact CG1-CG1 3.58Å; I65-W111 PolarHBondContact N-O 2.88Å; I65-L112 HydrophobicContact CB-CD2 3.88Å; I65-L112 HydrophobicContact CG2-CD2 3.58Å; I65-L112 WeakPolarHBondContact O-CA 3.33Å; I65-F113 PolarHBondContact O-N 3.35Å
66	I	52.1	Low	51	Low	4 Å²	4	84.9 Å²	84.9	2%	0.021	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	104.7	160.3	-53.6	174.1	0	0	0	106.6	T45 A46 I48 Y77 F80 F113	T45-I66 CarbonylContact C-O 3.56Å; T45-I66 WeakPolarHBondContact CA-O 3.34Å; A46-I66 HydrophobicContact CB-CB 4.32Å; A46-I66 PolarHBondContact N-O 3.29Å; A46-I66 PolarHBondContact O-N 2.85Å; I48-I66 HydrophobicContact CD1-CD1 3.75Å; I48-I66 HydrophobicContact CG1-CD1 4.49Å; I66-Y77 HydrophobicContact CG2-CD2 4.29Å; I66-F80 HydrophobicContact CD1-CD1 3.71Å; I66-F80 HydrophobicContact CD1-CE1 3.52Å; I66-F80 HydrophobicContact CD1-CZ 4.29Å; I66-F80 HydrophobicContact CG1-CE1 4.48Å; I66-F113 HydrophobicContact CB-CB 4.27Å; I66-F113 HydrophobicContact CG1-CB 3.89Å; I66-F113 HydrophobicContact CG1-CG 4.37Å; I66-F113 HydrophobicContact CG2-CB 4.24Å; I66-F113 HydrophobicContact CG2-CD1 3.86Å; I66-F113 HydrophobicContact CG2-CG 4.2Å
67	Q	52.7	Low	51.6	Low	129 Å²	129	85.4 Å²	85.4	60%	0.603	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.7	123.8	169.9	-170.5	177.7	1.8	0	0	108.1	I65	I65-Q67 HydrophobicContact CG2-CB 4.16Å
68	W	51.6	Low	52.3	Low	60 Å²	60	84.2 Å²	84.2	23%	0.227	41%	0.412	C	S	.	.			trans	-111	138.6	-174.1	171.8	43.4	0	0	0	109.1	H44 V70 E74	H44-W68 HydrophobicContact CB-CB 4.14Å; H44-W68 HydrophobicContact CB-CD2 4.28Å; H44-W68 HydrophobicContact CB-CE3 3.88Å; H44-W68 HydrophobicContact CB-CG 4.45Å; H44-W68 WeakPolarHBondContact CB-O 3.48Å; H44-W68 AromaticContact ND1-CE3 3.62Å; H44-W68 AromaticContact ND1-CZ3 3.54Å; H44-W68 WeakPolarHBondContact O-CA 3.47Å; H44-W68 WeakPolarHBondContact O-CB 3.15Å; H44-W68 PolarHBondContact O-N 3.46Å; W68-V70 HydrophobicContact CD2-CG2 4.44Å; W68-V70 HydrophobicContact CH2-CG1 4.46Å; W68-V70 HydrophobicContact CH2-CG2 4Å; W68-V70 HydrophobicContact CZ2-CB 4.09Å; W68-V70 HydrophobicContact CZ2-CG1 3.92Å; W68-V70 HydrophobicContact CZ2-CG2 3.82Å; W68-V70 HydrophobicContact CZ3-CG2 4.41Å; W68-E74 HydrophobicContact CZ2-CG 3.66Å; W68-E74 VanDerWaalsContact CZ2-OE1 3.3Å; W68-E74 WeakPolarHBondContact CZ2-OE1 3.23Å
69	N	45.6	Very low	53.4	Low	128 Å²	128	81.8 Å²	81.8	68%	0.684	41%	0.405	S	S	*	.			trans	-113.7	119.3	161.5	-91.6	-17.3	0	0	0	106	I71	N69-I71 PolarHBondContact O-N 3.1Å; N69-I71 VanDerWaalsContact O-N 3.09Å
70	V	42.3	Very low	54.6	Low	62 Å²	62	76.6 Å²	76.6	38%	0.376	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-35.3	-169.3	-176.3	0	0	0	0	113.4	H44 W68 T72	H44-V70 WeakPolarHBondContact CE1-CG2 3.39Å; H44-V70 WeakPolarHBondContact ND1-CG2 3.48Å; W68-V70 HydrophobicContact CD2-CG2 4.44Å; W68-V70 HydrophobicContact CH2-CG1 4.46Å; W68-V70 HydrophobicContact CH2-CG2 4Å; W68-V70 HydrophobicContact CZ2-CB 4.09Å; W68-V70 HydrophobicContact CZ2-CG1 3.92Å; W68-V70 HydrophobicContact CZ2-CG2 3.82Å; W68-V70 HydrophobicContact CZ3-CG2 4.41Å; V70-T72 PolarHBondContact O-N 3.45Å
71	I	47.6	Very low	55.4	Low	161 Å²	161	76.7 Å²	76.7	83%	0.826	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-16.4	-157.9	-55.1	175.5	0	0	0	114.6	N69	N69-I71 PolarHBondContact O-N 3.1Å; N69-I71 VanDerWaalsContact O-N 3.09Å
72	T	48.5	Very low	56	Low	108 Å²	108	80.1 Å²	80.1	66%	0.663	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-145.7	-5.5	-171.9	48.4	0	0	0	0	119.8	V70	V70-T72 PolarHBondContact O-N 3.45Å
73	N	50.8	Low	56.5	Low	36 Å²	36	80 Å²	80	19%	0.193	40%	0.399	C	S	.	.			trans	-141.6	26.4	-161	-83	-46.1	0	0	0	118.4	E75 K76 Y77	N73-E75 PolarHBondContact O-N 2.94Å; N73-K76 PolarHBondContact O-N 3.23Å; N73-K76 VanDerWaalsContact OD1-CD 3.24Å; N73-K76 WeakPolarHBondContact OD1-CD 3.44Å; N73-K76 WeakPolarHBondContact OD1-CE 3.32Å; N73-K76 PolarHBondContact OD1-NZ 3.42Å; N73-Y77 PolarHBondContact O-N 3.38Å
74	E	57.1	Low	57	Low	109 Å²	109	78 Å²	78	51%	0.509	39%	0.389	S	S	.	.	H	α-helix	trans	-59.5	-44.9	179	-73.5	-166.4	156.8	0	0	114.6	W68 K76 Y77 L78	W68-E74 HydrophobicContact CZ2-CG 3.66Å; W68-E74 VanDerWaalsContact CZ2-OE1 3.3Å; W68-E74 WeakPolarHBondContact CZ2-OE1 3.23Å; E74-K76 PolarHBondContact O-N 3.33Å; E74-Y77 WeakPolarHBondContact O-CB 3.47Å; E74-Y77 PolarHBondContact O-N 3.28Å; E74-Y77 VanDerWaalsContact O-N 3.11Å; E74-L78 PolarHBondContact O-N 2.93Å
75	E	62.9	Low	57.5	Low	167 Å²	167	80.6 Å²	80.6	78%	0.78	41%	0.405	S	S	*	.	H	α-helix	trans	-56.8	-38.6	178.7	-72.6	-166.7	141.8	0	0	112.5	N73 L78 K79	N73-E75 PolarHBondContact O-N 2.94Å; E75-L78 PolarHBondContact O-N 2.9Å; E75-K79 VanDerWaalsContact O-CB 3.26Å; E75-K79 WeakPolarHBondContact O-CB 3.43Å; E75-K79 PolarHBondContact O-N 3.41Å
76	K	59.9	Low	58.1	Low	78 Å²	78	84.5 Å²	84.5	34%	0.339	43%	0.426	S	S	.	.	H	α-helix	trans	-72.5	-32.6	-179	-59.9	-175.6	-163.8	154.7	0	111.7	N73 E74 F80 D116	N73-K76 PolarHBondContact O-N 3.23Å; N73-K76 VanDerWaalsContact OD1-CD 3.24Å; N73-K76 WeakPolarHBondContact OD1-CD 3.44Å; N73-K76 WeakPolarHBondContact OD1-CE 3.32Å; N73-K76 PolarHBondContact OD1-NZ 3.42Å; E74-K76 PolarHBondContact O-N 3.33Å; K76-F80 WeakPolarHBondContact O-CB 3.26Å; K76-F80 PolarHBondContact O-N 3.3Å; K76-D116 VanDerWaalsContact CD-OD1 3.22Å; K76-D116 WeakPolarHBondContact CD-OD1 3.38Å; K76-D116 WeakPolarHBondContact CE-OD1 3.45Å; K76-D116 IonicContact NZ-OD1 3.48Å; K76-D116 PolarHBondContact NZ-OD1 2.86Å; K76-D116 IonicContact NZ-OD2 2.73Å; K76-D116 PolarHBondContact NZ-OD2 3.48Å
77	Y	57.9	Low	58.7	Low	50 Å²	50	88.1 Å²	88.1	20%	0.196	45%	0.445	C	S	.	.	H	α-helix	trans	-66.4	-48.1	171.2	166.3	-101.6	0	0	0	111.6	A46 I66 N73 E74 K79 F80 L81	A46-Y77 HydrophobicContact CB-CE2 4.43Å; I66-Y77 HydrophobicContact CG2-CD2 4.29Å; N73-Y77 PolarHBondContact O-N 3.38Å; E74-Y77 WeakPolarHBondContact O-CB 3.47Å; E74-Y77 PolarHBondContact O-N 3.28Å; E74-Y77 VanDerWaalsContact O-N 3.11Å; Y77-K79 VanDerWaalsContact C-N 3.32Å; Y77-K79 PolarHBondContact O-N 3.14Å; Y77-F80 WeakPolarHBondContact O-CB 3.45Å; Y77-F80 PolarHBondContact O-N 2.79Å; Y77-F80 VanDerWaalsContact O-N 3.16Å; Y77-L81 HydrophobicContact CD1-CD1 4.49Å; Y77-L81 HydrophobicContact CD2-CG 4.5Å; Y77-L81 HydrophobicContact CE1-CD1 3.74Å; Y77-L81 HydrophobicContact CE2-CD1 3.85Å; Y77-L81 HydrophobicContact CE2-CG 4.08Å; Y77-L81 PolarHBondContact O-N 3.37Å; Y77-L81 WeakPolarHBondContact OH-CD1 3.49Å
78	L	60.4	Low	59.5	Low	99 Å²	99	82.6 Å²	82.6	52%	0.518	42%	0.421	S	S	.	.	H	α-helix	trans	-59.6	-43.8	175.1	-72	173.6	0	0	0	111.1	E74 E75 F80 L81 L82	E74-L78 PolarHBondContact O-N 2.93Å; E75-L78 PolarHBondContact O-N 2.9Å; L78-F80 VanDerWaalsContact C-N 3.33Å; L78-F80 PolarHBondContact O-N 3.34Å; L78-L81 PolarHBondContact O-N 3.36Å; L78-L82 VanDerWaalsContact O-CB 3.32Å; L78-L82 WeakPolarHBondContact O-CB 3.23Å; L78-L82 WeakPolarHBondContact O-CD1 3.42Å; L78-L82 WeakPolarHBondContact O-CG 3.47Å; L78-L82 PolarHBondContact O-N 2.87Å
79	K	63.9	Low	60.5	Low	141 Å²	141	81.8 Å²	81.8	61%	0.613	42%	0.418	S	S	*	.	H	α-helix	trans	-62.4	-36.7	175.4	-168.4	173	-174.7	174.8	0	112.9	E75 Y77 N83	E75-K79 VanDerWaalsContact O-CB 3.26Å; E75-K79 WeakPolarHBondContact O-CB 3.43Å; E75-K79 PolarHBondContact O-N 3.41Å; Y77-K79 VanDerWaalsContact C-N 3.32Å; Y77-K79 PolarHBondContact O-N 3.14Å; K79-N83 VanDerWaalsContact O-CB 3.31Å; K79-N83 WeakPolarHBondContact O-CB 3.49Å; K79-N83 PolarHBondContact O-N 2.74Å; K79-N83 VanDerWaalsContact O-N 3.15Å; K79-N83 PolarHBondContact O-ND2 2.87Å
80	F	65.4	Low	62	Low	8 Å²	8	75.7 Å²	75.7	4%	0.035	39%	0.385	C	S	.	.	H	α-helix	trans	-65.5	-48.3	173.2	179.7	-82	0	0	0	111.3	I48 I66 K76 Y77 L78 N83 C84 I92 F113 T118 I120	I48-F80 HydrophobicContact CD1-CE1 3.73Å; I66-F80 HydrophobicContact CD1-CD1 3.71Å; I66-F80 HydrophobicContact CD1-CE1 3.52Å; I66-F80 HydrophobicContact CD1-CZ 4.29Å; I66-F80 HydrophobicContact CG1-CE1 4.48Å; K76-F80 WeakPolarHBondContact O-CB 3.26Å; K76-F80 PolarHBondContact O-N 3.3Å; Y77-F80 WeakPolarHBondContact O-CB 3.45Å; Y77-F80 PolarHBondContact O-N 2.79Å; Y77-F80 VanDerWaalsContact O-N 3.16Å; L78-F80 VanDerWaalsContact C-N 3.33Å; L78-F80 PolarHBondContact O-N 3.34Å; F80-N83 CarbonylContact O-C 3.29Å; F80-N83 PolarHBondContact O-N 2.83Å; F80-C84 HydrophobicContact CE1-CB 4.38Å; F80-C84 VanDerWaalsContact O-CB 3.3Å; F80-C84 WeakPolarHBondContact O-CB 3.43Å; F80-C84 PolarHBondContact O-N 2.96Å; F80-C84 VanDerWaalsContact O-N 3.11Å; F80-I92 HydrophobicContact CE2-CG2 4.27Å; F80-I92 HydrophobicContact CZ-CD1 4.07Å; F80-F113 HydrophobicContact CB-CE2 4.28Å; F80-F113 AromaticContact CD2-CD2 3.54Å; F80-F113 HydrophobicContact CD2-CD2 3.54Å; F80-F113 AromaticContact CD2-CE2 3.31Å; F80-F113 HydrophobicContact CD2-CE2 3.31Å; F80-F113 HydrophobicContact CD2-CZ 4.34Å; F80-F113 AromaticContact CE2-CD2 3.56Å; F80-F113 HydrophobicContact CE2-CD2 3.56Å; F80-F113 AromaticContact CE2-CE2 3.84Å; F80-F113 HydrophobicContact CE2-CE2 3.84Å; F80-F113 HydrophobicContact CG-CD2 4.24Å; F80-F113 AromaticContact CG-CE2 3.93Å; F80-F113 HydrophobicContact CG-CE2 3.93Å; F80-F113 HydrophobicContact CZ-CD2 4.32Å; F80-T118 HydrophobicContact CE2-CG2 4.07Å; F80-I120 HydrophobicContact CD1-CD1 4.06Å; F80-I120 HydrophobicContact CD2-CD1 3.58Å; F80-I120 HydrophobicContact CD2-CG1 3.75Å; F80-I120 HydrophobicContact CE1-CD1 3.87Å; F80-I120 HydrophobicContact CE2-CD1 3.44Å; F80-I120 VanDerWaalsContact CE2-CD1 3.44Å; F80-I120 HydrophobicContact CE2-CG1 3.57Å; F80-I120 HydrophobicContact CG-CD1 3.91Å; F80-I120 HydrophobicContact CZ-CD1 3.59Å; F80-I120 HydrophobicContact CZ-CG1 4.17Å; F80-I120 VanDerWaalsContact O-CD1 3.25Å; F80-I120 WeakPolarHBondContact O-CD1 3.29Å
81	L	66.2	Low	63.8	Low	64 Å²	64	77.6 Å²	77.6	34%	0.335	39%	0.385	S	S	.	.	H	α-helix	trans	-66.1	-41.3	179.5	-73.1	-172.5	0	0	0	113.1	I48 Y77 L78 N83 C84	I48-L81 HydrophobicContact CD1-CD2 3.99Å; Y77-L81 HydrophobicContact CD1-CD1 4.49Å; Y77-L81 HydrophobicContact CD2-CG 4.5Å; Y77-L81 HydrophobicContact CE1-CD1 3.74Å; Y77-L81 HydrophobicContact CE2-CD1 3.85Å; Y77-L81 HydrophobicContact CE2-CG 4.08Å; Y77-L81 PolarHBondContact O-N 3.37Å; Y77-L81 WeakPolarHBondContact OH-CD1 3.49Å; L78-L81 PolarHBondContact O-N 3.36Å; L81-N83 PolarHBondContact O-N 3.3Å; L81-C84 CarbonylContact O-C 3.6Å; L81-C84 WeakPolarHBondContact O-CA 3.47Å; L81-C84 PolarHBondContact O-N 3.31Å
82	L	65.8	Low	65.3	Low	137 Å²	137	69.9 Å²	69.9	72%	0.717	35%	0.346	S	S	*	.	H	α-helix	trans	-60.9	-34.6	174.9	-73.2	165.8	0	0	0	111.8	L78 C84	L78-L82 VanDerWaalsContact O-CB 3.32Å; L78-L82 WeakPolarHBondContact O-CB 3.23Å; L78-L82 WeakPolarHBondContact O-CD1 3.42Å; L78-L82 WeakPolarHBondContact O-CG 3.47Å; L78-L82 PolarHBondContact O-N 2.87Å; L82-C84 VanDerWaalsContact C-N 3.29Å
83	N	67.3	Low	66.8	Low	73 Å²	73	66 Å²	66	39%	0.39	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	1.5	173.7	-66.9	-11.2	0	0	0	113.7	K79 F80 L81 P85 I120 T122	K79-N83 VanDerWaalsContact O-CB 3.31Å; K79-N83 WeakPolarHBondContact O-CB 3.49Å; K79-N83 PolarHBondContact O-N 2.74Å; K79-N83 VanDerWaalsContact O-N 3.15Å; K79-N83 PolarHBondContact O-ND2 2.87Å; F80-N83 CarbonylContact O-C 3.29Å; F80-N83 PolarHBondContact O-N 2.83Å; L81-N83 PolarHBondContact O-N 3.3Å; N83-P85 VanDerWaalsContact O-CD 3.26Å; N83-P85 WeakPolarHBondContact O-CD 3.4Å; N83-I120 HydrophobicContact CB-CB 4.25Å; N83-I120 HydrophobicContact CB-CD1 4.26Å; N83-I120 WeakPolarHBondContact O-CG2 3.38Å; N83-T122 PolarHBondContact O-OG1 3.17Å
84	C	70.7	Confident	68.3	Low	9 Å²	9	67 Å²	67	6%	0.061	33%	0.325	C	S	.	.	S	Bend	trans	-116.8	57	-179.9	-170.1	0	0	0	0	112	F80 L81 L82 I86 I90 I120	F80-C84 HydrophobicContact CE1-CB 4.38Å; F80-C84 VanDerWaalsContact O-CB 3.3Å; F80-C84 WeakPolarHBondContact O-CB 3.43Å; F80-C84 PolarHBondContact O-N 2.96Å; F80-C84 VanDerWaalsContact O-N 3.11Å; L81-C84 CarbonylContact O-C 3.6Å; L81-C84 WeakPolarHBondContact O-CA 3.47Å; L81-C84 PolarHBondContact O-N 3.31Å; L82-C84 VanDerWaalsContact C-N 3.29Å; C84-I86 PolarHBondContact O-N 3.34Å; C84-I90 VanDerWaalsContact SG-CD1 3.59Å; C84-I120 HydrophobicContact CB-CD1 3.58Å
85	P	65.2	Low	69.3	Low	53 Å²	53	61.8 Å²	61.8	34%	0.344	30%	0.301	S	S	.	.			trans	-62.4	137.4	-173.1	19.7	-26.6	0	0	0	112.6	N83 S88 T122	N83-P85 VanDerWaalsContact O-CD 3.26Å; N83-P85 WeakPolarHBondContact O-CD 3.4Å; P85-S88 WeakPolarHBondContact CG-OG 3.34Å; P85-S88 WeakPolarHBondContact O-CB 3.22Å; P85-S88 PolarHBondContact O-N 2.97Å; P85-S88 PolarHBondContact O-OG 3.5Å; P85-T122 HydrophobicContact CG-CG2 4.06Å
86	I	66.1	Low	69.8	Low	99 Å²	99	58.5 Å²	58.5	51%	0.508	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	145.8	173.9	-58.1	171.4	0	0	0	108.9	I34 C84 S88	I34-I86 HydrophobicContact CG1-CG2 4.35Å; C84-I86 PolarHBondContact O-N 3.34Å; I86-S88 VanDerWaalsContact C-N 3.29Å; I86-S88 PolarHBondContact O-N 2.96Å
87	N	64.4	Low	70.2	Confident	80 Å²	80	57.6 Å²	57.6	43%	0.428	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.6	30.6	-176.1	-68.4	-34.2	0	0	0	114.8	Y30 V31	Y30-N87 VanDerWaalsContact OH-CA 3.25Å; Y30-N87 WeakPolarHBondContact OH-CA 3.05Å; Y30-N87 VanDerWaalsContact OH-CB 3.24Å; Y30-N87 WeakPolarHBondContact OH-CB 3.37Å; Y30-N87 PolarHBondContact OH-O 2.88Å; Y30-N87 PolarHBondContact OH-OD1 3.31Å; Y30-N87 VanDerWaalsContact OH-OD1 3.11Å; V31-N87 PolarHBondContact O-N 3.09Å
88	S	69.1	Low	70.3	Confident	13 Å²	13	57.2 Å²	57.2	9%	0.091	29%	0.286	C	S	.	.			trans	-119.1	159	174.7	76.6	0	0	0	0	112.8	Y30 V31 P85 I86 I90	Y30-S88 WeakPolarHBondContact CA-O 3.32Å; Y30-S88 WeakPolarHBondContact CD2-O 3.27Å; V31-S88 PolarHBondContact N-O 3.15Å; P85-S88 WeakPolarHBondContact CG-OG 3.34Å; P85-S88 WeakPolarHBondContact O-CB 3.22Å; P85-S88 PolarHBondContact O-N 2.97Å; P85-S88 PolarHBondContact O-OG 3.5Å; I86-S88 VanDerWaalsContact C-N 3.29Å; I86-S88 PolarHBondContact O-N 2.96Å; S88-I90 WeakPolarHBondContact OG-CG2 3.47Å
89	W	74.2	Confident	70.2	Confident	43 Å²	43	58.9 Å²	58.9	16%	0.163	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	128.3	165.1	-74.7	87.8	0	0	0	108.9	G29 Y30 S52 L123 P126	G29-W89 WeakPolarHBondContact O-CA 3.44Å; Y30-W89 AromaticContact CD2-CD1 3.69Å; Y30-W89 HydrophobicContact CD2-CD2 4.22Å; Y30-W89 AromaticContact CD2-CE2 3.93Å; Y30-W89 HydrophobicContact CD2-CG 4.11Å; Y30-W89 AromaticContact CD2-NE1 3.56Å; S52-W89 WeakPolarHBondContact O-CH2 3.33Å; W89-L123 HydrophobicContact CB-CB 4.18Å; W89-L123 PolarHBondContact O-N 3.1Å; W89-P126 HydrophobicContact CD2-CG 4.34Å; W89-P126 HydrophobicContact CG-CG 4.36Å; W89-P126 HydrophobicContact CZ2-CG 4.47Å
90	I	75.7	Confident	69.7	Low	0 Å²	0	55 Å²	55	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	155.5	177.5	68.4	174.8	0	0	0	111.2	Y28 G29 V31 I50 C84 S88 I92 I120 E121	Y28-I90 WeakPolarHBondContact CA-O 3.43Å; G29-I90 PolarHBondContact N-O 3.37Å; G29-I90 VanDerWaalsContact N-O 3.09Å; G29-I90 PolarHBondContact O-N 2.97Å; V31-I90 HydrophobicContact CG2-CD1 3.38Å; V31-I90 HydrophobicContact CG2-CG1 3.65Å; V31-I90 HydrophobicContact CG2-CG2 4.13Å; I50-I90 HydrophobicContact CD1-CD1 3.85Å; I50-I90 HydrophobicContact CD1-CG1 4.12Å; C84-I90 VanDerWaalsContact SG-CD1 3.59Å; S88-I90 WeakPolarHBondContact OG-CG2 3.47Å; I90-I92 HydrophobicContact CD1-CD1 3.62Å; I90-I92 HydrophobicContact CD1-CG1 3.7Å; I90-I92 HydrophobicContact CG1-CD1 4.46Å; I90-I92 HydrophobicContact CG1-CG1 4.22Å; I90-I120 HydrophobicContact CB-CG2 3.86Å; I90-I120 HydrophobicContact CD1-CG2 4.05Å; I90-I120 HydrophobicContact CG1-CG2 4.46Å; I90-I120 HydrophobicContact CG2-CG2 4.17Å; I90-E121 WeakPolarHBondContact CA-O 3.26Å
91	R	80.7	Confident	68.7	Low	101 Å²	101	60.2 Å²	60.2	38%	0.381	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	126	161.2	-177.6	-179.8	-83.1	168.9	-11.7	108.6	I27 H93 I120 E121 L123	I27-R91 CarbonylContact O-C 3.6Å; I27-R91 VanDerWaalsContact O-CA 3.31Å; I27-R91 WeakPolarHBondContact O-CA 3.47Å; R91-H93 VanDerWaalsContact CD-CE1 3.44Å; R91-H93 WeakPolarHBondContact CD-CE1 3.34Å; R91-H93 WeakPolarHBondContact CD-NE2 3.19Å; R91-H93 WeakPolarHBondContact CG-NE2 3.46Å; R91-I120 WeakPolarHBondContact O-CA 3.23Å; R91-E121 PolarHBondContact N-O 3.09Å; R91-E121 PolarHBondContact O-N 2.86Å; R91-L123 HydrophobicContact CB-CD1 4.19Å; R91-L123 HydrophobicContact CB-CG 4.38Å
92	I	79.1	Confident	66.9	Low	0 Å²	0	64.9 Å²	64.9	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	126.8	175.3	-54.8	168.9	0	0	0	107.9	S26 I27 I50 I64 F80 I90 L95 T118 I120	S26-I92 CarbonylContact C-O 3.59Å; S26-I92 WeakPolarHBondContact CA-O 3.25Å; I27-I92 PolarHBondContact N-O 3.21Å; I27-I92 PolarHBondContact O-N 3.33Å; I50-I92 HydrophobicContact CD1-CD1 3.6Å; I64-I92 HydrophobicContact CD1-CD1 3.4Å; I64-I92 VanDerWaalsContact CD1-CD1 3.4Å; F80-I92 HydrophobicContact CE2-CG2 4.27Å; F80-I92 HydrophobicContact CZ-CD1 4.07Å; I90-I92 HydrophobicContact CD1-CD1 3.62Å; I90-I92 HydrophobicContact CD1-CG1 3.7Å; I90-I92 HydrophobicContact CG1-CD1 4.46Å; I90-I92 HydrophobicContact CG1-CG1 4.22Å; I92-L95 HydrophobicContact CB-CD1 3.95Å; I92-L95 HydrophobicContact CB-CG 4.46Å; I92-L95 HydrophobicContact CG2-CD1 3.75Å; I92-L95 HydrophobicContact CG2-CD2 3.93Å; I92-L95 HydrophobicContact CG2-CG 3.76Å; I92-T118 HydrophobicContact CG2-CG2 3.42Å; I92-T118 VanDerWaalsContact CG2-CG2 3.42Å; I92-I120 HydrophobicContact CG1-CG1 4.16Å; I92-I120 HydrophobicContact CG1-CG2 4.08Å
93	H	79.8	Confident	65.3	Low	26 Å²	26	61 Å²	61	12%	0.12	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	155.9	-178.1	-68.7	-94.5	0	0	0	112	S26 R91 L95 T118 Y119 E121	S26-H93 PolarHBondContact OG-ND1 3.17Å; R91-H93 VanDerWaalsContact CD-CE1 3.44Å; R91-H93 WeakPolarHBondContact CD-CE1 3.34Å; R91-H93 WeakPolarHBondContact CD-NE2 3.19Å; R91-H93 WeakPolarHBondContact CG-NE2 3.46Å; H93-L95 PolarHBondContact O-N 3.34Å; H93-T118 WeakPolarHBondContact O-CA 3.45Å; H93-T118 WeakPolarHBondContact O-CG2 3.44Å; H93-Y119 HydrophobicContact CB-CD1 3.99Å; H93-Y119 HydrophobicContact CB-CD2 4.37Å; H93-Y119 HydrophobicContact CB-CE1 3.55Å; H93-Y119 HydrophobicContact CB-CE2 3.97Å; H93-Y119 HydrophobicContact CB-CG 4.37Å; H93-Y119 AromaticContact CD2-CE2 3.31Å; H93-Y119 WeakPolarHBondContact CD2-CE2 3.45Å; H93-Y119 AromaticContact CD2-CZ 3.57Å; H93-Y119 AromaticContact CG-CE2 3.71Å; H93-Y119 AromaticContact CG-CZ 3.46Å; H93-Y119 VanDerWaalsContact CG-CZ 3.46Å; H93-Y119 PolarHBondContact N-O 2.94Å; H93-Y119 AromaticContact NE2-CE2 3.99Å; H93-E121 IonicContact NE2-OE2 3.21Å
94	N	82.6	Confident	63.6	Low	57 Å²	57	64.5 Å²	64.5	31%	0.305	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	58.6	40.8	174.4	-53.4	-27.3	0	0	0	114.4	Y24 T25 Q117 T118	Y24-N94 HydrophobicContact CD1-CB 4.22Å; T25-N94 PolarHBondContact O-N 2.98Å; T25-N94 VanDerWaalsContact O-N 3.09Å; N94-Q117 HydrophobicContact CB-CB 4.47Å; N94-Q117 WeakPolarHBondContact CB-O 3.15Å; N94-Q117 PolarHBondContact ND2-O 3.2Å; N94-T118 PolarHBondContact O-OG1 3.3Å; N94-T118 VanDerWaalsContact O-OG1 3.14Å
95	L	77.2	Confident	62.1	Low	0 Å²	0	72.4 Å²	72.4	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	149.5	169	-69.3	170.6	0	0	0	110.7	Y24 T25 I27 I64 I92 H93 W111 L112 T118	Y24-L95 WeakPolarHBondContact CA-O 3.48Å; T25-L95 PolarHBondContact N-O 2.88Å; T25-L95 PolarHBondContact O-N 3.37Å; I27-L95 HydrophobicContact CB-CD1 4.27Å; I27-L95 HydrophobicContact CD1-CD1 3.49Å; I27-L95 VanDerWaalsContact CD1-CD1 3.49Å; I27-L95 HydrophobicContact CG1-CD1 3.91Å; I64-L95 HydrophobicContact CD1-CD1 3.76Å; I64-L95 HydrophobicContact CG1-CD1 4.44Å; I64-L95 HydrophobicContact CG2-CD2 4.32Å; I92-L95 HydrophobicContact CB-CD1 3.95Å; I92-L95 HydrophobicContact CB-CG 4.46Å; I92-L95 HydrophobicContact CG2-CD1 3.75Å; I92-L95 HydrophobicContact CG2-CD2 3.93Å; I92-L95 HydrophobicContact CG2-CG 3.76Å; H93-L95 PolarHBondContact O-N 3.34Å; L95-W111 HydrophobicContact CB-CB 4.21Å; L95-W111 HydrophobicContact CB-CE3 4.46Å; L95-W111 HydrophobicContact CD1-CB 4.16Å; L95-L112 WeakPolarHBondContact CD2-O 3.5Å; L95-T118 HydrophobicContact CD2-CG2 3.75Å; L95-T118 HydrophobicContact CG-CG2 4.32Å
96	K	73.4	Confident	61	Low	98 Å²	98	80.4 Å²	80.4	43%	0.426	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	127.8	175.3	174.6	175	179	179	0	110.8	W111 L112 I114	K96-W111 WeakPolarHBondContact O-CA 3.24Å; K96-L112 HydrophobicContact CB-CB 4.49Å; K96-L112 PolarHBondContact N-O 2.92Å; K96-L112 VanDerWaalsContact N-O 3.15Å; K96-L112 PolarHBondContact O-N 3.22Å; K96-I114 HydrophobicContact CB-CD1 3.56Å; K96-I114 HydrophobicContact CB-CG1 4.33Å; K96-I114 HydrophobicContact CD-CD1 4.02Å; K96-I114 HydrophobicContact CG-CD1 4.43Å
97	E	68.7	Low	59.7	Low	59 Å²	59	80.6 Å²	80.6	28%	0.276	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	138.9	176.2	-155.2	175.9	145	0	0	111.4	K109 W111	E97-K109 VanDerWaalsContact OE1-CD 3.26Å; E97-K109 WeakPolarHBondContact OE1-CD 3.24Å; E97-K109 WeakPolarHBondContact OE1-CE 3.22Å; E97-K109 IonicContact OE1-NZ 2.75Å; E97-K109 PolarHBondContact OE1-NZ 3.14Å; E97-K109 IonicContact OE2-NZ 2.65Å; E97-K109 PolarHBondContact OE2-NZ 3.24Å; E97-W111 HydrophobicContact CB-CE3 3.78Å; E97-W111 HydrophobicContact CB-CH2 3.96Å; E97-W111 HydrophobicContact CB-CZ3 3.39Å; E97-W111 HydrophobicContact CG-CD2 4.33Å; E97-W111 HydrophobicContact CG-CE3 3.96Å; E97-W111 HydrophobicContact CG-CH2 3.66Å; E97-W111 HydrophobicContact CG-CZ2 4.08Å; E97-W111 HydrophobicContact CG-CZ3 3.58Å; E97-W111 VanDerWaalsContact OE2-CH2 3.26Å; E97-W111 WeakPolarHBondContact OE2-CH2 3.49Å
98	S	60.4	Low	58.9	Low	41 Å²	41	79.1 Å²	79.1	29%	0.287	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	175	178.1	-167.4	0	0	0	0	111.1	V110	S98-V110 CarbonylContact C-O 3.44Å; S98-V110 VanDerWaalsContact C-O 3.29Å; S98-V110 VanDerWaalsContact CA-O 3.3Å; S98-V110 WeakPolarHBondContact CA-O 3.38Å; S98-V110 WeakPolarHBondContact CB-O 3.42Å; S98-V110 PolarHBondContact N-O 2.86Å; S98-V110 PolarHBondContact O-N 3.42Å
99	R	58.2	Low	58.4	Low	134 Å²	134	84 Å²	84	51%	0.506	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	126.8	-179.6	-54.8	-175.7	-169.1	-173.4	4.2	109	E107	R99-E107 IonicContact CZ-OE1 2.82Å; R99-E107 IonicContact CZ-OE2 3.44Å; R99-E107 IonicContact NH1-OE1 2.83Å; R99-E107 PolarHBondContact NH1-OE1 3.05Å; R99-E107 IonicContact NH1-OE2 2.73Å; R99-E107 PolarHBondContact NH1-OE2 3.45Å
100	I	53.4	Low	57.9	Low	61 Å²	61	82.1 Å²	82.1	31%	0.313	37%	0.369	S	S	.	.	S	Bend	trans	-81.5	-41.7	175.2	-56.7	173.7	0	0	0	110.8	F47 I65 V110	F47-I100 HydrophobicContact CE1-CD1 3.56Å; F47-I100 HydrophobicContact CZ-CD1 3.92Å; I65-I100 HydrophobicContact CD1-CD1 3.51Å; I65-I100 HydrophobicContact CD1-CG1 3.5Å; I65-I100 HydrophobicContact CG1-CD1 4.37Å; I100-V110 HydrophobicContact CD1-CB 4.27Å; I100-V110 HydrophobicContact CD1-CG1 4.17Å; I100-V110 HydrophobicContact CD1-CG2 3.67Å; I100-V110 HydrophobicContact CG1-CB 4.16Å; I100-V110 HydrophobicContact CG1-CG1 4.42Å; I100-V110 HydrophobicContact CG1-CG2 3.79Å
101	Y	44	Very low	57.5	Low	116 Å²	116	83 Å²	83	46%	0.455	37%	0.372	S	S	.	.			trans	-107.1	86	-167.7	-55	-66.2	0	0	0	109.9
102	Y	28.8	Very low	56.8	Low	162 Å²	162	80 Å²	80	64%	0.635	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	124.7	167.7	-163.7	-119	0	0	0	109
103	K	31.8	Very low	56.3	Low	56 Å²	56	81.1 Å²	81.1	24%	0.243	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.8	49.1	174	-57.7	-171.5	170.8	-173.7	0	117.6	L1193 D1195	K103-L1193 HydrophobicContact CB-CD1 4.39Å; K103-L1193 HydrophobicContact CD-CB 4.29Å; K103-L1193 HydrophobicContact CD-CD1 3.7Å; K103-D1195 WeakPolarHBondContact CE-OD1 3.5Å; K103-D1195 IonicContact NZ-OD1 3.83Å; K103-D1195 PolarHBondContact NZ-OD1 2.94Å; K103-D1195 IonicContact NZ-OD2 2.91Å
104	Q	32.5	Very low	55.9	Low	147 Å²	147	81.5 Å²	81.5	69%	0.687	37%	0.371	S	S	*	.	S	Bend	trans	-125.7	152.6	149.4	-71.2	-168.5	-5.7	0	0	110	R106	Q104-R106 PolarHBondContact O-N 3.45Å
105	N	39.4	Very low	55	Low	175 Å²	175	81.1 Å²	81.1	94%	0.936	37%	0.372	S	S	*	.	S	Bend	trans	-59.3	5.3	-170.1	-74.2	5.8	0	0	0	117.2
106	R	40.7	Very low	54.7	Low	220 Å²	220	86.8 Å²	86.8	83%	0.83	40%	0.402	S	S	*	.	S	Bend	trans	-138.5	84.9	174.8	-68.4	-173	178	178	-0.4	109.7	Q104 S108	Q104-R106 PolarHBondContact O-N 3.45Å; R106-S108 PolarHBondContact O-N 3.11Å; R106-S108 VanDerWaalsContact O-N 3.16Å
107	E	39.8	Very low	54.7	Low	103 Å²	103	86.2 Å²	86.2	48%	0.481	40%	0.401	S	S	.	.			trans	-58.4	118.3	170	-66.3	-157.1	130.7	0	0	109.9	R99	R99-E107 IonicContact CZ-OE1 2.82Å; R99-E107 IonicContact CZ-OE2 3.44Å; R99-E107 IonicContact NH1-OE1 2.83Å; R99-E107 PolarHBondContact NH1-OE1 3.05Å; R99-E107 IonicContact NH1-OE2 2.73Å; R99-E107 PolarHBondContact NH1-OE2 3.45Å
108	S	47.7	Very low	54.9	Low	50 Å²	50	84.1 Å²	84.1	35%	0.35	39%	0.392	S	S	.	.			trans	-100.2	115.3	169.1	-63.9	0	0	0	0	108.7	R106 V110	R106-S108 PolarHBondContact O-N 3.11Å; R106-S108 VanDerWaalsContact O-N 3.16Å; S108-V110 WeakPolarHBondContact O-CG2 3.46Å
109	K	58.9	Low	55.6	Low	116 Å²	116	88.1 Å²	88.1	50%	0.504	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	133.8	172.4	-69.5	-172.8	171.1	-135.6	0	109.8	E97	E97-K109 VanDerWaalsContact OE1-CD 3.26Å; E97-K109 WeakPolarHBondContact OE1-CD 3.24Å; E97-K109 WeakPolarHBondContact OE1-CE 3.22Å; E97-K109 IonicContact OE1-NZ 2.75Å; E97-K109 PolarHBondContact OE1-NZ 3.14Å; E97-K109 IonicContact OE2-NZ 2.65Å; E97-K109 PolarHBondContact OE2-NZ 3.24Å
110	V	63.3	Low	56.5	Low	2 Å²	2	82.7 Å²	82.7	1%	0.012	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	140.5	-179.8	-170.1	0	0	0	0	109.7	N63 I65 S98 I100 S108	N63-V110 HydrophobicContact CB-CG1 4.16Å; N63-V110 HydrophobicContact CB-CG2 4.24Å; N63-V110 WeakPolarHBondContact O-CA 3.41Å; N63-V110 WeakPolarHBondContact O-CG1 3.43Å; I65-V110 HydrophobicContact CB-CG1 4.12Å; I65-V110 HydrophobicContact CD1-CB 4.4Å; I65-V110 HydrophobicContact CD1-CG1 3.6Å; I65-V110 HydrophobicContact CG1-CG1 3.58Å; S98-V110 CarbonylContact C-O 3.44Å; S98-V110 VanDerWaalsContact C-O 3.29Å; S98-V110 VanDerWaalsContact CA-O 3.3Å; S98-V110 WeakPolarHBondContact CA-O 3.38Å; S98-V110 WeakPolarHBondContact CB-O 3.42Å; S98-V110 PolarHBondContact N-O 2.86Å; S98-V110 PolarHBondContact O-N 3.42Å; I100-V110 HydrophobicContact CD1-CB 4.27Å; I100-V110 HydrophobicContact CD1-CG1 4.17Å; I100-V110 HydrophobicContact CD1-CG2 3.67Å; I100-V110 HydrophobicContact CG1-CB 4.16Å; I100-V110 HydrophobicContact CG1-CG1 4.42Å; I100-V110 HydrophobicContact CG1-CG2 3.79Å; S108-V110 WeakPolarHBondContact O-CG2 3.46Å
111	W	66.2	Low	57.7	Low	19 Å²	19	84.3 Å²	84.3	7%	0.072	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	127.7	-169.5	-56.8	89.5	0	0	0	110.4	T25 I27 Y62 N63 I64 I65 L95 K96 E97	T25-W111 HydrophobicContact CG2-CH2 3.85Å; T25-W111 HydrophobicContact CG2-CZ3 3.55Å; T25-W111 VanDerWaalsContact OG1-CE3 3.22Å; T25-W111 WeakPolarHBondContact OG1-CZ3 3.38Å; I27-W111 HydrophobicContact CD1-CB 3.83Å; I27-W111 HydrophobicContact CD1-CD2 3.53Å; I27-W111 HydrophobicContact CD1-CE3 4.27Å; I27-W111 HydrophobicContact CD1-CG 3.28Å; I27-W111 HydrophobicContact CG1-CD2 4.46Å; Y62-W111 AromaticContact CD1-NE1 3.81Å; N63-W111 PolarHBondContact O-N 3.27Å; I64-W111 CarbonylContact C-O 3.49Å; I64-W111 VanDerWaalsContact CA-O 3.31Å; I64-W111 WeakPolarHBondContact CA-O 3.46Å; I64-W111 HydrophobicContact CG1-CB 4.33Å; I64-W111 WeakPolarHBondContact CG2-O 3.24Å; I65-W111 PolarHBondContact N-O 2.88Å; L95-W111 HydrophobicContact CB-CB 4.21Å; L95-W111 HydrophobicContact CB-CE3 4.46Å; L95-W111 HydrophobicContact CD1-CB 4.16Å; K96-W111 WeakPolarHBondContact O-CA 3.24Å; E97-W111 HydrophobicContact CB-CE3 3.78Å; E97-W111 HydrophobicContact CB-CH2 3.96Å; E97-W111 HydrophobicContact CB-CZ3 3.39Å; E97-W111 HydrophobicContact CG-CD2 4.33Å; E97-W111 HydrophobicContact CG-CE3 3.96Å; E97-W111 HydrophobicContact CG-CH2 3.66Å; E97-W111 HydrophobicContact CG-CZ2 4.08Å; E97-W111 HydrophobicContact CG-CZ3 3.58Å; E97-W111 VanDerWaalsContact OE2-CH2 3.26Å; E97-W111 WeakPolarHBondContact OE2-CH2 3.49Å
112	L	67.8	Low	59.2	Low	37 Å²	37	82.2 Å²	82.2	19%	0.194	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	127.9	-179.4	-68.3	170.5	0	0	0	110.6	I65 L95 K96	I65-L112 HydrophobicContact CB-CD2 3.88Å; I65-L112 HydrophobicContact CG2-CD2 3.58Å; I65-L112 WeakPolarHBondContact O-CA 3.33Å; L95-L112 WeakPolarHBondContact CD2-O 3.5Å; K96-L112 HydrophobicContact CB-CB 4.49Å; K96-L112 PolarHBondContact N-O 2.92Å; K96-L112 VanDerWaalsContact N-O 3.15Å; K96-L112 PolarHBondContact O-N 3.22Å
113	F	67.8	Low	61.2	Low	24 Å²	24	76.8 Å²	76.8	11%	0.105	37%	0.37	C	S	.	.			trans	-64.1	132.6	161.5	170.8	-96.2	0	0	0	110.2	I65 I66 F80 P115 T118	I65-F113 PolarHBondContact O-N 3.35Å; I66-F113 HydrophobicContact CB-CB 4.27Å; I66-F113 HydrophobicContact CG1-CB 3.89Å; I66-F113 HydrophobicContact CG1-CG 4.37Å; I66-F113 HydrophobicContact CG2-CB 4.24Å; I66-F113 HydrophobicContact CG2-CD1 3.86Å; I66-F113 HydrophobicContact CG2-CG 4.2Å; F80-F113 HydrophobicContact CB-CE2 4.28Å; F80-F113 AromaticContact CD2-CD2 3.54Å; F80-F113 HydrophobicContact CD2-CD2 3.54Å; F80-F113 AromaticContact CD2-CE2 3.31Å; F80-F113 HydrophobicContact CD2-CE2 3.31Å; F80-F113 HydrophobicContact CD2-CZ 4.34Å; F80-F113 AromaticContact CE2-CD2 3.56Å; F80-F113 HydrophobicContact CE2-CD2 3.56Å; F80-F113 AromaticContact CE2-CE2 3.84Å; F80-F113 HydrophobicContact CE2-CE2 3.84Å; F80-F113 HydrophobicContact CG-CD2 4.24Å; F80-F113 AromaticContact CG-CE2 3.93Å; F80-F113 HydrophobicContact CG-CE2 3.93Å; F80-F113 HydrophobicContact CZ-CD2 4.32Å; F113-P115 HydrophobicContact CD1-CG 4.36Å; F113-P115 HydrophobicContact CE1-CB 4.26Å; F113-P115 HydrophobicContact CE1-CG 3.88Å; F113-T118 HydrophobicContact CD2-CG2 3.64Å; F113-T118 HydrophobicContact CE2-CG2 4.05Å
114	I	70.9	Confident	62.6	Low	35 Å²	35	79.6 Å²	79.6	18%	0.179	39%	0.394	C	S	.	.			trans	-113.6	117.1	172.8	-65.7	172.5	0	0	0	108.1	Y24 K96 Q117 T118	Y24-I114 HydrophobicContact CD1-CD1 4.49Å; Y24-I114 HydrophobicContact CE1-CD1 3.72Å; K96-I114 HydrophobicContact CB-CD1 3.56Å; K96-I114 HydrophobicContact CB-CG1 4.33Å; K96-I114 HydrophobicContact CD-CD1 4.02Å; K96-I114 HydrophobicContact CG-CD1 4.43Å; I114-Q117 HydrophobicContact CB-CB 4.32Å; I114-Q117 HydrophobicContact CG2-CB 3.92Å; I114-Q117 HydrophobicContact CG2-CG 3.99Å; I114-Q117 PolarHBondContact O-N 3.19Å; I114-T118 PolarHBondContact N-OG1 2.73Å; I114-T118 WeakPolarHBondContact O-CB 3.38Å; I114-T118 PolarHBondContact O-N 3.25Å; I114-T118 PolarHBondContact O-OG1 2.84Å; I114-T118 VanDerWaalsContact O-OG1 3.07Å
115	P	65.1	Low	63.5	Low	48 Å²	48	78.3 Å²	78.3	31%	0.312	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.5	144.5	173.6	-25.1	32.7	0	0	0	112	F113 Q117	F113-P115 HydrophobicContact CD1-CG 4.36Å; F113-P115 HydrophobicContact CE1-CB 4.26Å; F113-P115 HydrophobicContact CE1-CG 3.88Å; P115-Q117 PolarHBondContact O-N 3.03Å
116	D	69.6	Low	63.5	Low	119 Å²	119	73.5 Å²	73.5	64%	0.636	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.5	-19.5	-179.7	-59.4	-56.3	0	0	0	117.2	K76	K76-D116 VanDerWaalsContact CD-OD1 3.22Å; K76-D116 WeakPolarHBondContact CD-OD1 3.38Å; K76-D116 WeakPolarHBondContact CE-OD1 3.45Å; K76-D116 IonicContact NZ-OD1 3.48Å; K76-D116 PolarHBondContact NZ-OD1 2.86Å; K76-D116 IonicContact NZ-OD2 2.73Å; K76-D116 PolarHBondContact NZ-OD2 3.48Å
117	Q	72.9	Confident	63.1	Low	86 Å²	86	73.6 Å²	73.6	40%	0.402	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	-37.8	178.8	-61.2	-175.2	-7.7	0	0	112.7	Y24 N94 I114 P115	Y24-Q117 PolarHBondContact OH-OE1 2.86Å; N94-Q117 HydrophobicContact CB-CB 4.47Å; N94-Q117 WeakPolarHBondContact CB-O 3.15Å; N94-Q117 PolarHBondContact ND2-O 3.2Å; I114-Q117 HydrophobicContact CB-CB 4.32Å; I114-Q117 HydrophobicContact CG2-CB 3.92Å; I114-Q117 HydrophobicContact CG2-CG 3.99Å; I114-Q117 PolarHBondContact O-N 3.19Å; P115-Q117 PolarHBondContact O-N 3.03Å
118	T	73.7	Confident	62.6	Low	15 Å²	15	76.7 Å²	76.7	9%	0.092	38%	0.384	C	S	.	.			trans	-80.9	126.4	-178.1	-53.6	0	0	0	0	111.3	F80 I92 H93 N94 L95 F113 I114	F80-T118 HydrophobicContact CE2-CG2 4.07Å; I92-T118 HydrophobicContact CG2-CG2 3.42Å; I92-T118 VanDerWaalsContact CG2-CG2 3.42Å; H93-T118 WeakPolarHBondContact O-CA 3.45Å; H93-T118 WeakPolarHBondContact O-CG2 3.44Å; N94-T118 PolarHBondContact O-OG1 3.3Å; N94-T118 VanDerWaalsContact O-OG1 3.14Å; L95-T118 HydrophobicContact CD2-CG2 3.75Å; L95-T118 HydrophobicContact CG-CG2 4.32Å; F113-T118 HydrophobicContact CD2-CG2 3.64Å; F113-T118 HydrophobicContact CE2-CG2 4.05Å; I114-T118 PolarHBondContact N-OG1 2.73Å; I114-T118 WeakPolarHBondContact O-CB 3.38Å; I114-T118 PolarHBondContact O-N 3.25Å; I114-T118 PolarHBondContact O-OG1 2.84Å; I114-T118 VanDerWaalsContact O-OG1 3.07Å
119	Y	76.1	Confident	61.5	Low	126 Å²	126	81.1 Å²	81.1	49%	0.494	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	155.6	172.1	69.9	-90.8	0	0	0	111.3	H93	H93-Y119 HydrophobicContact CB-CD1 3.99Å; H93-Y119 HydrophobicContact CB-CD2 4.37Å; H93-Y119 HydrophobicContact CB-CE1 3.55Å; H93-Y119 HydrophobicContact CB-CE2 3.97Å; H93-Y119 HydrophobicContact CB-CG 4.37Å; H93-Y119 AromaticContact CD2-CE2 3.31Å; H93-Y119 WeakPolarHBondContact CD2-CE2 3.45Å; H93-Y119 AromaticContact CD2-CZ 3.57Å; H93-Y119 AromaticContact CG-CE2 3.71Å; H93-Y119 AromaticContact CG-CZ 3.46Å; H93-Y119 VanDerWaalsContact CG-CZ 3.46Å; H93-Y119 PolarHBondContact N-O 2.94Å; H93-Y119 AromaticContact NE2-CE2 3.99Å
120	I	76.3	Confident	60.1	Low	20 Å²	20	80.5 Å²	80.5	10%	0.103	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	136.3	-179.9	-42.7	-175.3	0	0	0	109.6	F80 N83 C84 I90 R91 I92	F80-I120 HydrophobicContact CD1-CD1 4.06Å; F80-I120 HydrophobicContact CD2-CD1 3.58Å; F80-I120 HydrophobicContact CD2-CG1 3.75Å; F80-I120 HydrophobicContact CE1-CD1 3.87Å; F80-I120 HydrophobicContact CE2-CD1 3.44Å; F80-I120 VanDerWaalsContact CE2-CD1 3.44Å; F80-I120 HydrophobicContact CE2-CG1 3.57Å; F80-I120 HydrophobicContact CG-CD1 3.91Å; F80-I120 HydrophobicContact CZ-CD1 3.59Å; F80-I120 HydrophobicContact CZ-CG1 4.17Å; F80-I120 VanDerWaalsContact O-CD1 3.25Å; F80-I120 WeakPolarHBondContact O-CD1 3.29Å; N83-I120 HydrophobicContact CB-CB 4.25Å; N83-I120 HydrophobicContact CB-CD1 4.26Å; N83-I120 WeakPolarHBondContact O-CG2 3.38Å; C84-I120 HydrophobicContact CB-CD1 3.58Å; I90-I120 HydrophobicContact CB-CG2 3.86Å; I90-I120 HydrophobicContact CD1-CG2 4.05Å; I90-I120 HydrophobicContact CG1-CG2 4.46Å; I90-I120 HydrophobicContact CG2-CG2 4.17Å; R91-I120 WeakPolarHBondContact O-CA 3.23Å; I92-I120 HydrophobicContact CG1-CG1 4.16Å; I92-I120 HydrophobicContact CG1-CG2 4.08Å
121	E	78.3	Confident	58.3	Low	94 Å²	94	87.2 Å²	87.2	44%	0.439	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	114.9	164.5	-176	-178.9	-161.7	0	0	108.4	I90 R91 H93 L123	I90-E121 WeakPolarHBondContact CA-O 3.26Å; R91-E121 PolarHBondContact N-O 3.09Å; R91-E121 PolarHBondContact O-N 2.86Å; H93-E121 IonicContact NE2-OE2 3.21Å; E121-L123 HydrophobicContact CG-CD2 4.13Å; E121-L123 PolarHBondContact O-N 2.95Å
122	T	75.5	Confident	56.2	Low	72 Å²	72	91.5 Å²	91.5	44%	0.442	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	111.9	170.8	-49.9	0	0	0	0	108.3	N83 P85	N83-T122 PolarHBondContact O-OG1 3.17Å; P85-T122 HydrophobicContact CG-CG2 4.06Å
123	L	70.8	Confident	54.2	Low	48 Å²	48	97 Å²	97	25%	0.251	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	138.2	-179.4	-61.3	175.9	0	0	0	109.1	W89 R91 E121 H125	W89-L123 HydrophobicContact CB-CB 4.18Å; W89-L123 PolarHBondContact O-N 3.1Å; R91-L123 HydrophobicContact CB-CD1 4.19Å; R91-L123 HydrophobicContact CB-CG 4.38Å; E121-L123 HydrophobicContact CG-CD2 4.13Å; E121-L123 PolarHBondContact O-N 2.95Å; L123-H125 PolarHBondContact O-N 3.47Å
124	P	62	Low	52.1	Low	115 Å²	115	103.2 Å²	103.2	75%	0.747	54%	0.54	S	S	*	.			trans	-56.8	136.2	168.8	25.9	-33.2	0	0	0	108.4	P126	P124-P126 VanDerWaalsContact O-N 3.11Å
125	H	51.4	Low	49.8	Very low	120 Å²	120	109.2 Å²	109.2	56%	0.556	57%	0.567	S	S	*	*			trans	-44.1	123.6	176.5	-122	80.9	0	0	0	108.4	L123 R127	L123-H125 PolarHBondContact O-N 3.47Å; H125-R127 VanDerWaalsContact C-N 3.32Å; H125-R127 PolarHBondContact O-N 3.27Å
126	P	38.8	Very low	47.8	Very low	74 Å²	74	112.9 Å²	112.9	48%	0.481	59%	0.592	S	S	.	*			trans	-63	98.5	-171.9	23	-31.7	0	0	0	108.4	W89 P124 I128	W89-P126 HydrophobicContact CD2-CG 4.34Å; W89-P126 HydrophobicContact CG-CG 4.36Å; W89-P126 HydrophobicContact CZ2-CG 4.47Å; P124-P126 VanDerWaalsContact O-N 3.11Å; P126-I128 PolarHBondContact O-N 3.12Å; P126-I128 VanDerWaalsContact O-N 3.13Å
127	R	31.8	Very low	45.5	Very low	223 Å²	223	113 Å²	113	84%	0.842	60%	0.601	S	S	*	*			trans	-49.6	124.8	165.4	-73.6	-177.2	176.4	176.4	-0.9	104.9	H125 L129	H125-R127 VanDerWaalsContact C-N 3.32Å; H125-R127 PolarHBondContact O-N 3.27Å; R127-L129 PolarHBondContact O-N 3.19Å
128	I	29.3	Very low	43.2	Very low	168 Å²	168	116.6 Å²	116.6	86%	0.862	62%	0.622	S	S	*	*			trans	-64.5	82.3	-170.8	-57.6	167.8	0	0	0	108.3	P126 S130	P126-I128 PolarHBondContact O-N 3.12Å; P126-I128 VanDerWaalsContact O-N 3.13Å; I128-S130 VanDerWaalsContact C-N 3.35Å; I128-S130 PolarHBondContact O-N 3.16Å; I128-S130 VanDerWaalsContact O-N 3.12Å
129	L	24.5	Very low	40.8	Very low	143 Å²	143	121.4 Å²	121.4	75%	0.749	65%	0.654	S	S	*	*			trans	-84.5	88.3	-179.4	-102.5	153.8	0	0	0	105.8	R127 N131	R127-L129 PolarHBondContact O-N 3.19Å; L129-N131 PolarHBondContact O-N 3.07Å
130	S	29.4	Very low	38.2	Very low	102 Å²	102	124.8 Å²	124.8	71%	0.713	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62	14.7	-164.7	47	0	0	0	0	116.8	I128	I128-S130 VanDerWaalsContact C-N 3.35Å; I128-S130 PolarHBondContact O-N 3.16Å; I128-S130 VanDerWaalsContact O-N 3.12Å
131	N	25.7	Very low	35.6	Very low	143 Å²	143	130.7 Å²	130.7	77%	0.765	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.1	5.9	-169.9	-83.9	-34.1	0	0	0	116.5	L129 N133	L129-N131 PolarHBondContact O-N 3.07Å; N131-N133 PolarHBondContact O-N 3.02Å
132	C	22.5	Very low	33.1	Very low	110 Å²	110	135.2 Å²	135.2	74%	0.743	72%	0.724	S	S	*	*			trans	-95.6	70.3	175.2	-71.8	0	0	0	0	112.7	H134	C132-H134 PolarHBondContact O-N 2.89Å
133	N	26.3	Very low	30.8	Very low	153 Å²	153	137.2 Å²	137.2	82%	0.818	74%	0.738	S	S	*	*			trans	-72.4	98.1	162.9	-72.3	-34.1	0	0	0	109.4	N131	N131-N133 PolarHBondContact O-N 3.02Å
134	H	23.2	Very low	29.4	Very low	154 Å²	154	140.7 Å²	140.7	71%	0.713	76%	0.763	S	S	*	*			trans	-139.5	104.5	169.5	-89.4	-74.2	0	0	0	113.3	C132	C132-H134 PolarHBondContact O-N 2.89Å
135	E	23.6	Very low	27.7	Very low	161 Å²	161	140.4 Å²	140.4	75%	0.752	76%	0.764	S	S	*	*				49.6	80.2	127.8	-61.9	170.9	132	0	0	119	C137	E135-C137 PolarHBondContact O-N 3.01Å
136	C	22.9	Very low	26.4	Very low	124 Å²	124	139.8 Å²	139.8	84%	0.838	77%	0.773	S	S	*	*			trans	-75.4	113	143.5	-92.5	0	0	0	0	109	L138	C136-L138 PolarHBondContact O-N 2.83Å
137	C	21.5	Very low	25.7	Very low	123 Å²	123	141 Å²	141	83%	0.831	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-57.5	119.8	-172.2	-62.6	0	0	0	0	114	E135	E135-C137 PolarHBondContact O-N 3.01Å
138	L	23.6	Very low	25.3	Very low	160 Å²	160	135.7 Å²	135.7	84%	0.838	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-80.1	135.8	147.9	-83.1	163.9	0	0	0	108.2	C136 Q140	C136-L138 PolarHBondContact O-N 2.83Å; L138-Q140 PolarHBondContact O-N 3.29Å
139	P	23	Very low	25.2	Very low	116 Å²	116	133.5 Å²	133.5	75%	0.753	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-65.1	132.6	179.7	25.6	-32.4	0	0	0	111.1	L141	P139-L141 PolarHBondContact O-N 3.34Å
140	Q	22	Very low	25.3	Very low	197 Å²	197	132.6 Å²	132.6	92%	0.921	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-58.1	125.9	-171.1	-63.7	164.9	-27.4	0	0	113.2	L138	L138-Q140 PolarHBondContact O-N 3.29Å
141	L	22.9	Very low	25.2	Very low	145 Å²	145	133.2 Å²	133.2	76%	0.759	79%	0.79	S	S	*	*			trans	-143	105.2	161	-95.7	155.1	0	0	0	109.9	P139	P139-L141 PolarHBondContact O-N 3.34Å
142	F	24.5	Very low	25.2	Very low	189 Å²	189	132 Å²	132	83%	0.829	79%	0.793	S	S	*	*			trans	76.2	128	167.6	-59	-71	0	0	0	120.9
143	P	27.4	Very low	25.4	Very low	113 Å²	113	132.4 Å²	132.4	73%	0.734	80%	0.797	S	S	*	*			trans	-101.3	-173.3	170.3	42	-35.7	0	0	0	111.8
144	P	42	Very low	25.4	Very low	121 Å²	121	129.8 Å²	129.8	79%	0.786	79%	0.791	S	S	*	*			cis	-132.5	155.7	-42.5	33.9	-18.4	0	0	0	113.2
145	S	25.3	Very low	25.6	Very low	109 Å²	109	127.9 Å²	127.9	76%	0.762	79%	0.79	S	S	*	*			trans	-158.5	110.4	153.7	60.6	0	0	0	0	113.6
146	S	24.1	Very low	25.9	Very low	108 Å²	108	124.6 Å²	124.6	76%	0.755	79%	0.785	S	S	*	*			trans	21.8	145.4	147.6	54.9	0	0	0	0	123.3
147	S	24.9	Very low	26.3	Very low	100 Å²	100	124.6 Å²	124.6	70%	0.699	77%	0.771	S	S	*	*			trans	72.5	88.7	151.4	54.1	0	0	0	0	119.9
148	S	23.9	Very low	26.9	Very low	111 Å²	111	121.6 Å²	121.6	78%	0.776	75%	0.75	S	S	*	*				38	105.4	116.9	62.7	0	0	0	0	119.5
149	S	27.1	Very low	27.6	Very low	122 Å²	122	117 Å²	117	85%	0.853	73%	0.729	S	S	*	*				-168.9	142.1	115.1	40.9	0	0	0	0	110.6	S151	S149-S151 PolarHBondContact O-N 3.33Å
150	S	26.4	Very low	28.4	Very low	124 Å²	124	111.7 Å²	111.7	87%	0.867	70%	0.695	S	S	*	*			trans	-77.7	102.4	-169.6	50.4	0	0	0	0	112.7	S152	S150-S152 PolarHBondContact O-N 3.18Å
151	S	26.5	Very low	29.5	Very low	115 Å²	115	104.2 Å²	104.2	80%	0.804	66%	0.661	S	S	*	*			trans	-81.9	108.4	164.3	58.3	0	0	0	0	110.2	S149 S153	S149-S151 PolarHBondContact O-N 3.33Å; S151-S153 PolarHBondContact O-N 3.43Å
152	S	26.3	Very low	30.8	Very low	118 Å²	118	98.5 Å²	98.5	83%	0.825	63%	0.631	S	S	*	*			trans	-62.6	109.9	178.2	52.6	0	0	0	0	112.1	S150 S154	S150-S152 PolarHBondContact O-N 3.18Å; S152-S154 PolarHBondContact O-N 3.28Å
153	S	27.1	Very low	31.8	Very low	118 Å²	118	92.7 Å²	92.7	83%	0.825	61%	0.612	S	S	*	*			trans	-76.3	98.8	174.6	55.2	0	0	0	0	111	S151	S151-S153 PolarHBondContact O-N 3.43Å
154	S	26.4	Very low	33.2	Very low	98 Å²	98	89.9 Å²	89.9	69%	0.685	60%	0.595	S	S	*	*			trans	-63.4	134.5	172.3	53	0	0	0	0	111.4	S152 S156	S152-S154 PolarHBondContact O-N 3.28Å; S154-S156 PolarHBondContact O-N 3.17Å
155	T	26.8	Very low	34	Very low	114 Å²	114	84.2 Å²	84.2	70%	0.699	56%	0.558	S	S	*	*			trans	-57.3	106.2	172.8	47.4	0	0	0	0	111.2	F157	T155-F157 PolarHBondContact O-N 3.47Å
156	S	28.8	Very low	36	Very low	92 Å²	92	80.8 Å²	80.8	64%	0.643	53%	0.531	S	S	*	.			trans	-77.6	101.4	176.3	56.3	0	0	0	0	110.5	S154	S154-S156 PolarHBondContact O-N 3.17Å
157	F	32.1	Very low	38.3	Very low	123 Å²	123	75.7 Å²	75.7	54%	0.539	50%	0.495	S	S	.	.	P	Polyproline II helix	trans	-62.5	154.5	159.7	-72.9	-84.8	0	0	0	110	T155 V159	T155-F157 PolarHBondContact O-N 3.47Å; F157-V159 PolarHBondContact O-N 2.58Å
158	P	34.9	Very low	40.4	Very low	61 Å²	61	71.5 Å²	71.5	40%	0.396	47%	0.466	S	S	.	.	P	Polyproline II helix	trans	-55.3	133	173	-22.5	33.2	0	0	0	111.1	G160 L161 W223	P158-G160 PolarHBondContact O-N 3.23Å; P158-L161 HydrophobicContact CB-CB 4.37Å; P158-L161 HydrophobicContact CG-CD2 4.34Å; P158-L161 WeakPolarHBondContact O-CB 3.41Å; P158-L161 PolarHBondContact O-N 3.33Å; P158-W223 HydrophobicContact CB-CH2 3.46Å; P158-W223 VanDerWaalsContact CB-CH2 3.46Å; P158-W223 HydrophobicContact CB-CZ2 4.13Å; P158-W223 HydrophobicContact CB-CZ3 4.12Å; P158-W223 HydrophobicContact CG-CH2 4.43Å
159	V	36.6	Very low	42.5	Very low	64 Å²	64	66.8 Å²	66.8	39%	0.388	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	120.6	-173.7	-171	0	0	0	0	110.3	F157 W223 P275 V277	F157-V159 PolarHBondContact O-N 2.58Å; V159-W223 WeakPolarHBondContact O-CZ3 3.28Å; V159-P275 HydrophobicContact CG1-CB 4.25Å; V159-P275 HydrophobicContact CG1-CG 4.2Å; V159-P275 HydrophobicContact CG2-CG 4.23Å; V159-V277 HydrophobicContact CB-CG2 4.39Å; V159-V277 HydrophobicContact CG1-CG2 3.78Å
160	G	40.1	Very low	44.4	Very low	4 Å²	4	62.2 Å²	62.2	4%	0.041	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	92	-4.2	-178	0	0	0	0	0	116.2	P158 I162 W223 S224 P275	P158-G160 PolarHBondContact O-N 3.23Å; G160-I162 PolarHBondContact O-N 3.13Å; G160-W223 WeakPolarHBondContact O-CA 3.29Å; G160-S224 PolarHBondContact O-N 3.22Å; G160-S224 PolarHBondContact O-OG 3.32Å; G160-P275 PolarHBondContact N-O 2.85Å
161	L	44.9	Very low	46	Very low	39 Å²	39	57.9 Å²	57.9	20%	0.204	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	115.6	171.4	-177.6	70.4	0	0	0	110.8	P158 N221 W223	P158-L161 HydrophobicContact CB-CB 4.37Å; P158-L161 HydrophobicContact CG-CD2 4.34Å; P158-L161 WeakPolarHBondContact O-CB 3.41Å; P158-L161 PolarHBondContact O-N 3.33Å; L161-N221 HydrophobicContact CD1-CB 4.46Å; L161-W223 HydrophobicContact CB-CD2 4.49Å; L161-W223 HydrophobicContact CD1-CD2 4.35Å; L161-W223 HydrophobicContact CD1-CG 4.37Å; L161-W223 HydrophobicContact CD1-CZ2 4.49Å
162	I	50.7	Low	47.4	Very low	26 Å²	26	55.5 Å²	55.5	13%	0.133	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	116.8	171	-55.4	-175.1	0	0	0	109.1	G160 S164 I165 N221 V222 S224	G160-I162 PolarHBondContact O-N 3.13Å; I162-S164 WeakPolarHBondContact CG2-O 3.12Å; I162-S164 PolarHBondContact O-N 3.18Å; I162-I165 HydrophobicContact CD1-CD1 4.2Å; I162-I165 HydrophobicContact CG2-CB 4.1Å; I162-N221 CarbonylContact O-C 3.53Å; I162-N221 VanDerWaalsContact O-CA 3.31Å; I162-N221 WeakPolarHBondContact O-CA 3.06Å; I162-N221 PolarHBondContact O-N 3.06Å; I162-V222 PolarHBondContact N-O 2.92Å; I162-V222 PolarHBondContact O-N 2.91Å; I162-S224 WeakPolarHBondContact CD1-OG 3.42Å
163	P	46.7	Very low	48.4	Very low	66 Å²	66	53 Å²	53	43%	0.429	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	-30.4	-178.2	26.8	-33.8	0	0	0	113.4	F220 N221	P163-F220 CarbonylContact O-C 3.53Å; P163-F220 WeakPolarHBondContact O-CA 3.31Å; P163-F220 WeakPolarHBondContact O-CB 3.1Å; P163-N221 PolarHBondContact O-N 2.81Å
164	S	56	Low	49.1	Very low	54 Å²	54	49.8 Å²	49.8	38%	0.378	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	142	171.1	57.9	0	0	0	0	112.3	I162 L219	I162-S164 WeakPolarHBondContact CG2-O 3.12Å; I162-S164 PolarHBondContact O-N 3.18Å; S164-L219 CarbonylContact C-O 3.58Å; S164-L219 VanDerWaalsContact CA-O 3.3Å; S164-L219 WeakPolarHBondContact CA-O 3.32Å
165	I	59.5	Low	50	Low	2 Å²	2	52.9 Å²	52.9	1%	0.01	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	131.6	175	-168.6	168.8	0	0	0	111.5	I162 L167 Y196 K218 L219 V222	I162-I165 HydrophobicContact CD1-CD1 4.2Å; I162-I165 HydrophobicContact CG2-CB 4.1Å; I165-L167 HydrophobicContact CD1-CD2 3.87Å; I165-L167 HydrophobicContact CD1-CG 4.37Å; I165-L167 HydrophobicContact CG1-CD2 3.93Å; I165-L167 HydrophobicContact CG1-CG 4.02Å; I165-L167 HydrophobicContact CG2-CD1 3.92Å; I165-L167 HydrophobicContact CG2-CG 4.16Å; I165-Y196 HydrophobicContact CD1-CD1 4.22Å; I165-Y196 HydrophobicContact CD1-CD2 4.39Å; I165-Y196 HydrophobicContact CD1-CE1 3.83Å; I165-Y196 HydrophobicContact CD1-CE2 4.02Å; I165-Y196 HydrophobicContact CD1-CG 4.48Å; I165-K218 WeakPolarHBondContact O-CA 3.1Å; I165-L219 HydrophobicContact CG2-CB 4.08Å; I165-L219 PolarHBondContact N-O 3.4Å; I165-L219 PolarHBondContact O-N 2.86Å; I165-V222 HydrophobicContact CG2-CG2 4.35Å
166	D	66.2	Low	50.8	Low	38 Å²	38	47.6 Å²	47.6	20%	0.203	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	128.4	175.6	-40.4	-56.6	0	0	0	109.8	T184 N185 K218	D166-T184 WeakPolarHBondContact CB-OG1 3.15Å; D166-T184 PolarHBondContact O-N 2.9Å; D166-N185 PolarHBondContact OD2-ND2 2.8Å; D166-K218 WeakPolarHBondContact OD1-CD 3.49Å; D166-K218 WeakPolarHBondContact OD1-CG 3.47Å
167	L	72.6	Confident	51.6	Low	0 Å²	0	46.6 Å²	46.6	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	129.7	-165.6	-70.6	177.4	0	0	0	112	I165 F181 E182 R183 Y196 T216 I217 L219 L248	I165-L167 HydrophobicContact CD1-CD2 3.87Å; I165-L167 HydrophobicContact CD1-CG 4.37Å; I165-L167 HydrophobicContact CG1-CD2 3.93Å; I165-L167 HydrophobicContact CG1-CG 4.02Å; I165-L167 HydrophobicContact CG2-CD1 3.92Å; I165-L167 HydrophobicContact CG2-CG 4.16Å; L167-F181 HydrophobicContact CB-CB 3.85Å; L167-F181 HydrophobicContact CB-CD1 3.84Å; L167-F181 HydrophobicContact CB-CG 4Å; L167-F181 HydrophobicContact CD1-CB 4.28Å; L167-F181 HydrophobicContact CD1-CG 4.3Å; L167-F181 HydrophobicContact CD2-CB 4.05Å; L167-F181 HydrophobicContact CG-CB 4.28Å; L167-E182 CarbonylContact C-O 3.54Å; L167-E182 VanDerWaalsContact CA-O 3.28Å; L167-E182 WeakPolarHBondContact CA-O 2.93Å; L167-R183 HydrophobicContact CD2-CB 4.44Å; L167-Y196 HydrophobicContact CD2-CD2 3.6Å; L167-Y196 HydrophobicContact CD2-CE2 4.28Å; L167-Y196 HydrophobicContact CD2-CG 3.91Å; L167-T216 CarbonylContact O-C 3.59Å; L167-T216 VanDerWaalsContact O-CA 3.27Å; L167-T216 WeakPolarHBondContact O-CA 3.45Å; L167-I217 HydrophobicContact CB-CG1 4.09Å; L167-I217 PolarHBondContact N-O 3.48Å; L167-I217 WeakPolarHBondContact O-CG1 3.48Å; L167-I217 PolarHBondContact O-N 2.95Å; L167-L219 HydrophobicContact CD1-CD1 3.83Å; L167-L219 HydrophobicContact CD1-CG 4.37Å; L167-L248 HydrophobicContact CD1-CD1 3.49Å; L167-L248 VanDerWaalsContact CD1-CD1 3.49Å
168	S	68.1	Low	52.5	Low	13 Å²	13	41.2 Å²	41.2	9%	0.091	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	127.4	173.3	47.6	0	0	0	0	111.8	I170 F181 E182 T184 Q215	S168-I170 PolarHBondContact O-N 3.28Å; S168-F181 CarbonylContact O-C 3.55Å; S168-F181 VanDerWaalsContact O-CA 3.25Å; S168-F181 WeakPolarHBondContact O-CA 3.48Å; S168-E182 PolarHBondContact N-O 2.99Å; S168-E182 PolarHBondContact O-N 2.97Å; S168-E182 PolarHBondContact OG-O 3.34Å; S168-T184 VanDerWaalsContact CB-CG2 3.45Å; S168-T184 VanDerWaalsContact OG-CG2 3.29Å; S168-T184 WeakPolarHBondContact OG-CG2 3.26Å; S168-Q215 WeakPolarHBondContact CA-O 3.42Å
169	L	67.8	Low	53.5	Low	11 Å²	11	38.5 Å²	38.5	6%	0.058	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	119.1	-177.3	-177.4	68.6	0	0	0	111.5	L179 F181 L211 R214 Q215	L169-L179 HydrophobicContact CD1-CB 3.88Å; L169-L179 HydrophobicContact CD1-CD2 4.11Å; L169-L179 HydrophobicContact CD1-CG 4.43Å; L169-F181 VanDerWaalsContact CA-CD1 3.46Å; L169-F181 HydrophobicContact CB-CD1 4Å; L169-F181 HydrophobicContact CB-CE1 3.75Å; L169-F181 HydrophobicContact CD1-CD1 4.17Å; L169-F181 HydrophobicContact CD1-CE1 3.74Å; L169-F181 HydrophobicContact CD1-CE2 4.26Å; L169-F181 HydrophobicContact CD1-CZ 3.79Å; L169-F181 HydrophobicContact CG-CE1 4.35Å; L169-L211 HydrophobicContact CD2-CB 3.95Å; L169-R214 WeakPolarHBondContact O-CA 3.48Å; L169-R214 PolarHBondContact O-N 3.18Å; L169-Q215 PolarHBondContact N-O 3.4Å; L169-Q215 VanDerWaalsContact N-O 3.12Å
170	I	68.1	Low	54.9	Low	27 Å²	27	36.7 Å²	36.7	14%	0.138	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	-51.1	171.5	-52.1	175.2	0	0	0	109.9	S168 E180 E182 H195 Y213	S168-I170 PolarHBondContact O-N 3.28Å; I170-E180 WeakPolarHBondContact CA-O 3.43Å; I170-E180 HydrophobicContact CB-CG 4.4Å; I170-E180 HydrophobicContact CD1-CG 4.47Å; I170-E180 PolarHBondContact N-O 3.27Å; I170-E182 HydrophobicContact CD1-CB 3.67Å; I170-E182 HydrophobicContact CD1-CG 4.05Å; I170-E182 HydrophobicContact CG1-CB 3.87Å; I170-H195 WeakPolarHBondContact CD1-ND1 3.31Å; I170-Y213 WeakPolarHBondContact O-CD2 3.47Å; I170-Y213 WeakPolarHBondContact O-CE2 3.31Å
171	S	61	Low	56.3	Low	33 Å²	33	36.5 Å²	36.5	23%	0.231	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	157.8	-172.4	19.9	0	0	0	0	113.5	E180	S171-E180 PolarHBondContact N-O 2.78Å; S171-E180 VanDerWaalsContact N-O 3.09Å; S171-E180 PolarHBondContact O-N 3.37Å; S171-E180 PolarHBondContact OG-OE2 3.34Å
172	S	55.1	Low	57.7	Low	64 Å²	64	37.6 Å²	37.6	45%	0.448	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	119.6	177.2	179.4	0	0	0	0	109.1	G176 L179	S172-G176 WeakPolarHBondContact OG-CA 3.32Å; S172-G176 PolarHBondContact OG-N 3.34Å; S172-L179 WeakPolarHBondContact OG-CD2 3.32Å
173	H	47	Very low	58.5	Low	66 Å²	66	39.4 Å²	39.4	31%	0.306	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	149	-176.4	-60.8	-72.1	0	0	0	110.3	N175 G176 I177 F178 E180	H173-N175 PolarHBondContact O-N 2.86Å; H173-G176 PolarHBondContact O-N 3.45Å; H173-G176 VanDerWaalsContact O-N 3.14Å; H173-I177 PolarHBondContact O-N 2.73Å; H173-F178 HydrophobicContact CB-CB 4.05Å; H173-F178 PolarHBondContact N-O 3.04Å; H173-F178 PolarHBondContact O-N 3.23Å; H173-E180 IonicContact CD2-OE2 2.96Å; H173-E180 IonicContact CE1-OE2 3.58Å; H173-E180 IonicContact NE2-OE2 3.7Å; H173-E180 PolarHBondContact NE2-OE2 3.06Å
174	C	42.1	Very low	59.1	Low	50 Å²	50	39 Å²	39	34%	0.338	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	50.1	50.4	176.8	-57.9	0	0	0	0	113.6	G176 I177	C174-G176 VanDerWaalsContact C-N 3.34Å; C174-G176 PolarHBondContact O-N 2.92Å; C174-I177 HydrophobicContact CB-CB 4.36Å; C174-I177 WeakPolarHBondContact O-CD1 3.35Å; C174-I177 VanDerWaalsContact O-CG1 3.31Å; C174-I177 WeakPolarHBondContact O-CG1 3.46Å; C174-I177 PolarHBondContact O-N 3.47Å
175	N	45.4	Very low	59.3	Low	164 Å²	164	39.1 Å²	39.1	88%	0.877	21%	0.212	S	C	*	.	G	3₁₀ helix	trans	56.7	38.4	-178.2	-61.1	2.5	0	0	0	114.3	H173	H173-N175 PolarHBondContact O-N 2.86Å
176	G	43.3	Very low	58.6	Low	2 Å²	2	43.5 Å²	43.5	2%	0.021	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	83	9.8	175	0	0	0	0	0	115.5	S172 H173 C174 N200	S172-G176 WeakPolarHBondContact OG-CA 3.32Å; S172-G176 PolarHBondContact OG-N 3.34Å; H173-G176 PolarHBondContact O-N 3.45Å; H173-G176 VanDerWaalsContact O-N 3.14Å; C174-G176 VanDerWaalsContact C-N 3.34Å; C174-G176 PolarHBondContact O-N 2.92Å; G176-N200 PolarHBondContact O-ND2 3.37Å
177	I	46.6	Very low	57.7	Low	71 Å²	71	47.1 Å²	47.1	36%	0.364	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-37.5	169.5	-64.8	172.1	0	0	0	110.5	H173 C174 L199 N200	H173-I177 PolarHBondContact O-N 2.73Å; C174-I177 HydrophobicContact CB-CB 4.36Å; C174-I177 WeakPolarHBondContact O-CD1 3.35Å; C174-I177 VanDerWaalsContact O-CG1 3.31Å; C174-I177 WeakPolarHBondContact O-CG1 3.46Å; C174-I177 PolarHBondContact O-N 3.47Å; I177-L199 HydrophobicContact CG2-CD1 4.28Å; I177-N200 PolarHBondContact O-N 2.94Å
178	F	49	Very low	56.3	Low	11 Å²	11	52.9 Å²	52.9	5%	0.048	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	127.8	172.2	-77.8	-77.4	0	0	0	109.4	H173 L198 L199 L247 F295 L298	H173-F178 HydrophobicContact CB-CB 4.05Å; H173-F178 PolarHBondContact N-O 3.04Å; H173-F178 PolarHBondContact O-N 3.23Å; F178-L198 WeakPolarHBondContact CA-O 3.47Å; F178-L199 HydrophobicContact CD1-CD1 4.17Å; F178-L199 HydrophobicContact CE1-CB 4.18Å; F178-L199 HydrophobicContact CE1-CD1 3.57Å; F178-L199 HydrophobicContact CE1-CG 4.43Å; F178-L199 HydrophobicContact CE2-CD1 4.05Å; F178-L199 HydrophobicContact CZ-CD1 3.51Å; F178-L247 HydrophobicContact CE1-CD1 4.1Å; F178-F295 HydrophobicContact CE2-CD2 4.49Å; F178-F295 HydrophobicContact CE2-CE2 4.03Å; F178-L298 HydrophobicContact CE2-CD2 3.88Å; F178-L298 HydrophobicContact CZ-CD2 3.73Å
179	L	57.7	Low	55	Low	3 Å²	3	56.8 Å²	56.8	2%	0.016	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	123.7	174.5	-62.6	177.6	0	0	0	108.2	L169 S172 F181 L197 L198 I205 L211	L169-L179 HydrophobicContact CD1-CB 3.88Å; L169-L179 HydrophobicContact CD1-CD2 4.11Å; L169-L179 HydrophobicContact CD1-CG 4.43Å; S172-L179 WeakPolarHBondContact OG-CD2 3.32Å; L179-F181 HydrophobicContact CB-CD2 4.21Å; L179-F181 HydrophobicContact CB-CE2 3.39Å; L179-F181 HydrophobicContact CB-CZ 3.84Å; L179-F181 HydrophobicContact CD1-CE2 4.32Å; L179-F181 HydrophobicContact CD1-CZ 4.09Å; L179-F181 WeakPolarHBondContact O-CD2 2.88Å; L179-L197 CarbonylContact O-C 3.51Å; L179-L198 HydrophobicContact CB-CB 4.39Å; L179-L198 PolarHBondContact N-O 3.4Å; L179-L198 VanDerWaalsContact N-O 3.07Å; L179-L198 PolarHBondContact O-N 3Å; L179-I205 HydrophobicContact CD1-CD1 3.83Å; L179-L211 HydrophobicContact CD1-CD1 4.4Å
180	E	65.4	Low	53.7	Low	26 Å²	26	65.3 Å²	65.3	12%	0.121	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	127.4	179.8	-177.8	175.3	-164.7	0	0	109.2	I170 S171 H173 Y196 L197	I170-E180 WeakPolarHBondContact CA-O 3.43Å; I170-E180 HydrophobicContact CB-CG 4.4Å; I170-E180 HydrophobicContact CD1-CG 4.47Å; I170-E180 PolarHBondContact N-O 3.27Å; S171-E180 PolarHBondContact N-O 2.78Å; S171-E180 VanDerWaalsContact N-O 3.09Å; S171-E180 PolarHBondContact O-N 3.37Å; S171-E180 PolarHBondContact OG-OE2 3.34Å; H173-E180 IonicContact CD2-OE2 2.96Å; H173-E180 IonicContact CE1-OE2 3.58Å; H173-E180 IonicContact NE2-OE2 3.7Å; H173-E180 PolarHBondContact NE2-OE2 3.06Å; E180-Y196 CarbonylContact C-O 3.47Å; E180-Y196 WeakPolarHBondContact CA-O 3.22Å; E180-L197 HydrophobicContact CB-CD2 3.98Å; E180-L197 HydrophobicContact CG-CD2 4.37Å
181	F	69.9	Low	52.5	Low	0 Å²	0	74 Å²	74	0%	0	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	143.5	-175.1	-66	-91.6	0	0	0	112.1	L167 S168 L169 L179 H195 Y196 L198 I217	L167-F181 HydrophobicContact CB-CB 3.85Å; L167-F181 HydrophobicContact CB-CD1 3.84Å; L167-F181 HydrophobicContact CB-CG 4Å; L167-F181 HydrophobicContact CD1-CB 4.28Å; L167-F181 HydrophobicContact CD1-CG 4.3Å; L167-F181 HydrophobicContact CD2-CB 4.05Å; L167-F181 HydrophobicContact CG-CB 4.28Å; S168-F181 CarbonylContact O-C 3.55Å; S168-F181 VanDerWaalsContact O-CA 3.25Å; S168-F181 WeakPolarHBondContact O-CA 3.48Å; L169-F181 VanDerWaalsContact CA-CD1 3.46Å; L169-F181 HydrophobicContact CB-CD1 4Å; L169-F181 HydrophobicContact CB-CE1 3.75Å; L169-F181 HydrophobicContact CD1-CD1 4.17Å; L169-F181 HydrophobicContact CD1-CE1 3.74Å; L169-F181 HydrophobicContact CD1-CE2 4.26Å; L169-F181 HydrophobicContact CD1-CZ 3.79Å; L169-F181 HydrophobicContact CG-CE1 4.35Å; L179-F181 HydrophobicContact CB-CD2 4.21Å; L179-F181 HydrophobicContact CB-CE2 3.39Å; L179-F181 HydrophobicContact CB-CZ 3.84Å; L179-F181 HydrophobicContact CD1-CE2 4.32Å; L179-F181 HydrophobicContact CD1-CZ 4.09Å; L179-F181 WeakPolarHBondContact O-CD2 2.88Å; F181-H195 CarbonylContact O-C 3.51Å; F181-H195 WeakPolarHBondContact O-CA 3.15Å; F181-Y196 PolarHBondContact N-O 2.83Å; F181-Y196 PolarHBondContact O-N 2.93Å; F181-L198 HydrophobicContact CD2-CB 4.11Å; F181-L198 HydrophobicContact CE2-CB 3.71Å; F181-L198 HydrophobicContact CE2-CD2 3.91Å; F181-L198 HydrophobicContact CE2-CG 4.45Å; F181-L198 HydrophobicContact CZ-CD2 4.41Å; F181-I217 HydrophobicContact CD1-CD1 4.15Å; F181-I217 HydrophobicContact CD1-CG1 4.23Å; F181-I217 HydrophobicContact CE1-CD1 3.3Å; F181-I217 HydrophobicContact CE1-CG1 3.74Å; F181-I217 HydrophobicContact CE2-CD1 4.31Å; F181-I217 HydrophobicContact CZ-CD1 3.41Å; F181-I217 VanDerWaalsContact CZ-CD1 3.41Å; F181-I217 HydrophobicContact CZ-CG1 4.34Å
182	E	73.7	Confident	51.8	Low	62 Å²	62	73.6 Å²	73.6	29%	0.29	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	149.6	165.1	-141.4	175.5	166.5	0	0	109.1	L167 S168 I170	L167-E182 CarbonylContact C-O 3.54Å; L167-E182 VanDerWaalsContact CA-O 3.28Å; L167-E182 WeakPolarHBondContact CA-O 2.93Å; S168-E182 PolarHBondContact N-O 2.99Å; S168-E182 PolarHBondContact O-N 2.97Å; S168-E182 PolarHBondContact OG-O 3.34Å; I170-E182 HydrophobicContact CD1-CB 3.67Å; I170-E182 HydrophobicContact CD1-CG 4.05Å; I170-E182 HydrophobicContact CG1-CB 3.87Å
183	R	67	Low	51.6	Low	65 Å²	65	73.7 Å²	73.7	25%	0.245	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	119.2	171.3	-171	175.6	-171.1	165.4	3.7	111.2	L167 N185 Q194 Y196	L167-R183 HydrophobicContact CD2-CB 4.44Å; R183-N185 PolarHBondContact O-N 3.09Å; R183-Q194 HydrophobicContact CB-CB 4.3Å; R183-Q194 PolarHBondContact N-O 3.39Å; R183-Q194 VanDerWaalsContact N-O 3.1Å; R183-Y196 HydrophobicContact CB-CD2 4.28Å; R183-Y196 HydrophobicContact CB-CE2 3.81Å; R183-Y196 HydrophobicContact CG-CE2 4.43Å; R183-Y196 PolarHBondContact NH1-OH 3.01Å
184	T	60.5	Low	52	Low	56 Å²	56	71.6 Å²	71.6	34%	0.344	35%	0.352	S	S	.	.			trans	-77.3	-17.1	-175.5	51.6	0	0	0	0	114.7	D166 S168 P186 T216	D166-T184 WeakPolarHBondContact CB-OG1 3.15Å; D166-T184 PolarHBondContact O-N 2.9Å; S168-T184 VanDerWaalsContact CB-CG2 3.45Å; S168-T184 VanDerWaalsContact OG-CG2 3.29Å; S168-T184 WeakPolarHBondContact OG-CG2 3.26Å; T184-P186 VanDerWaalsContact O-CD 3.31Å; T184-P186 WeakPolarHBondContact O-CD 3.26Å; T184-T216 HydrophobicContact CG2-CG2 3.83Å
185	N	59.5	Low	52.7	Low	57 Å²	57	70 Å²	70	31%	0.305	34%	0.339	S	S	.	.			trans	-95.1	104.7	-168.7	-159.2	-35.7	0	0	0	111.6	D166 R183 N187	D166-N185 PolarHBondContact OD2-ND2 2.8Å; R183-N185 PolarHBondContact O-N 3.09Å; N185-N187 VanDerWaalsContact C-N 3.29Å; N185-N187 PolarHBondContact O-N 3.34Å
186	P	45.4	Very low	53.6	Low	95 Å²	95	62.2 Å²	62.2	62%	0.617	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-2.8	-163.9	33.5	-38.3	0	0	0	114.8	T184 Y188	T184-P186 VanDerWaalsContact O-CD 3.31Å; T184-P186 WeakPolarHBondContact O-CD 3.26Å; P186-Y188 PolarHBondContact O-N 2.78Å; P186-Y188 VanDerWaalsContact O-N 3.09Å
187	N	46.1	Very low	54.4	Low	113 Å²	113	62.5 Å²	62.5	60%	0.604	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-9.4	-173.3	-74.1	-23.5	0	0	0	114.3	N185	N185-N187 VanDerWaalsContact C-N 3.29Å; N185-N187 PolarHBondContact O-N 3.34Å
188	Y	43.3	Very low	55	Low	121 Å²	121	59.3 Å²	59.3	48%	0.475	28%	0.282	S	S	.	.	S	Bend	trans	-115	92.2	173.9	-83.3	-93.6	0	0	0	111.4	P186	P186-Y188 PolarHBondContact O-N 2.78Å; P186-Y188 VanDerWaalsContact O-N 3.09Å
189	H	40.3	Very low	55.2	Low	95 Å²	95	59.7 Å²	59.7	44%	0.44	29%	0.285	S	S	.	.			trans	73.1	93.6	175.3	-56.7	-71.4	0	0	0	116.9	R191 V192	H189-R191 PolarHBondContact O-N 2.9Å; H189-V192 HydrophobicContact CB-CB 4.4Å; H189-V192 HydrophobicContact CB-CG2 4.38Å; H189-V192 PolarHBondContact O-N 3.46Å
190	Q	41	Very low	54.8	Low	191 Å²	191	60 Å²	60	89%	0.893	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	12.3	171.3	-79.2	-178	-27.9	0	0	117.5
191	R	43.3	Very low	53.6	Low	208 Å²	208	64.3 Å²	64.3	79%	0.785	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-144.8	12.5	-175	-64.6	-168.6	-178.6	179.4	2.1	115.1	H189	H189-R191 PolarHBondContact O-N 2.9Å
192	V	46.8	Very low	52.2	Low	25 Å²	25	70.7 Å²	70.7	15%	0.152	34%	0.343	C	S	.	.			trans	-136.6	113.2	-175.8	177.7	0	0	0	0	108.6	H189 Q194 L244	H189-V192 HydrophobicContact CB-CB 4.4Å; H189-V192 HydrophobicContact CB-CG2 4.38Å; H189-V192 PolarHBondContact O-N 3.46Å; V192-Q194 HydrophobicContact CG1-CG 4.05Å; V192-L244 HydrophobicContact CG1-CB 3.77Å; V192-L244 HydrophobicContact CG1-CD1 3.6Å; V192-L244 HydrophobicContact CG1-CG 4.26Å
193	N	50.4	Low	50.4	Low	66 Å²	66	74.9 Å²	74.9	35%	0.353	36%	0.361	S	S	.	.			trans	-76.5	127.1	169	-72.4	7.2	0	0	0	107.7	D243 L244	N193-D243 VanDerWaalsContact CB-OD1 3.29Å; N193-D243 WeakPolarHBondContact CB-OD1 3.38Å; N193-L244 PolarHBondContact O-N 3.02Å
194	Q	55.4	Low	49.1	Very low	22 Å²	22	75.9 Å²	75.9	10%	0.103	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	114.4	-178.1	-64.1	179.8	-6	0	0	109.2	R183 V192 Y196 L244	R183-Q194 HydrophobicContact CB-CB 4.3Å; R183-Q194 PolarHBondContact N-O 3.39Å; R183-Q194 VanDerWaalsContact N-O 3.1Å; V192-Q194 HydrophobicContact CG1-CG 4.05Å; Q194-Y196 HydrophobicContact CB-CD2 4.34Å; Q194-Y196 HydrophobicContact CB-CE2 3.52Å; Q194-Y196 WeakPolarHBondContact O-CD2 3.3Å; Q194-Y196 PolarHBondContact OE1-OH 3.08Å; Q194-L244 CarbonylContact C-O 3.49Å; Q194-L244 WeakPolarHBondContact CA-O 3.46Å; Q194-L244 HydrophobicContact CG-CB 4.5Å
195	H	57.1	Low	48	Very low	17 Å²	17	73.9 Å²	73.9	8%	0.079	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	130.4	-178.5	-62.1	-83.3	0	0	0	110.1	I170 F181 D243 L244 Y245 A246	I170-H195 WeakPolarHBondContact CD1-ND1 3.31Å; F181-H195 CarbonylContact O-C 3.51Å; F181-H195 WeakPolarHBondContact O-CA 3.15Å; H195-D243 IonicContact CD2-OD1 3.96Å; H195-D243 PolarHBondContact CD2-OD1 2.76Å; H195-D243 IonicContact CE1-OD1 3.99Å; H195-D243 IonicContact NE2-OD1 2.66Å; H195-D243 PolarHBondContact NE2-OD1 3.2Å; H195-L244 PolarHBondContact N-O 3.18Å; H195-Y245 HydrophobicContact CB-CD1 3.56Å; H195-Y245 HydrophobicContact CB-CE1 3.47Å; H195-Y245 VanDerWaalsContact CB-CE1 3.47Å; H195-Y245 HydrophobicContact CB-CG 4.24Å; H195-Y245 AromaticContact CG-CE1 3.97Å; H195-Y245 CarbonylContact O-C 3.54Å; H195-Y245 VanDerWaalsContact O-CA 3.26Å; H195-Y245 WeakPolarHBondContact O-CA 3.39Å; H195-A246 PolarHBondContact O-N 3.41Å
196	Y	63.7	Low	47.1	Very low	0 Å²	0	79.8 Å²	79.8	0%	0	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	116.2	-172.9	-70.5	-88.1	0	0	0	110.4	I165 L167 E180 F181 R183 Q194 Y226 A246 L248	I165-Y196 HydrophobicContact CD1-CD1 4.22Å; I165-Y196 HydrophobicContact CD1-CD2 4.39Å; I165-Y196 HydrophobicContact CD1-CE1 3.83Å; I165-Y196 HydrophobicContact CD1-CE2 4.02Å; I165-Y196 HydrophobicContact CD1-CG 4.48Å; L167-Y196 HydrophobicContact CD2-CD2 3.6Å; L167-Y196 HydrophobicContact CD2-CE2 4.28Å; L167-Y196 HydrophobicContact CD2-CG 3.91Å; E180-Y196 CarbonylContact C-O 3.47Å; E180-Y196 WeakPolarHBondContact CA-O 3.22Å; F181-Y196 PolarHBondContact N-O 2.83Å; F181-Y196 PolarHBondContact O-N 2.93Å; R183-Y196 HydrophobicContact CB-CD2 4.28Å; R183-Y196 HydrophobicContact CB-CE2 3.81Å; R183-Y196 HydrophobicContact CG-CE2 4.43Å; R183-Y196 PolarHBondContact NH1-OH 3.01Å; Q194-Y196 HydrophobicContact CB-CD2 4.34Å; Q194-Y196 HydrophobicContact CB-CE2 3.52Å; Q194-Y196 WeakPolarHBondContact O-CD2 3.3Å; Q194-Y196 PolarHBondContact OE1-OH 3.08Å; Y196-Y226 PolarHBondContact OH-OH 2.99Å; Y196-A246 CarbonylContact C-O 3.6Å; Y196-A246 VanDerWaalsContact CA-O 3.29Å; Y196-A246 WeakPolarHBondContact CA-O 3.38Å; Y196-A246 HydrophobicContact CD1-CB 3.66Å; Y196-A246 HydrophobicContact CE1-CB 3.69Å; Y196-L248 HydrophobicContact CD1-CD1 3.83Å; Y196-L248 HydrophobicContact CD1-CD2 3.72Å; Y196-L248 HydrophobicContact CD1-CG 3.72Å; Y196-L248 HydrophobicContact CE1-CD2 4.26Å; Y196-L248 HydrophobicContact CG-CD1 4.02Å; Y196-L248 HydrophobicContact CG-CG 4.29Å
197	L	59.6	Low	46.7	Very low	9 Å²	9	78 Å²	78	5%	0.047	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	110	174.8	-77.7	161.7	0	0	0	109.8	L179 E180 A246 L247 L248 F286	L179-L197 CarbonylContact O-C 3.51Å; E180-L197 HydrophobicContact CB-CD2 3.98Å; E180-L197 HydrophobicContact CG-CD2 4.37Å; L197-A246 PolarHBondContact N-O 3.4Å; L197-L247 HydrophobicContact CB-CD1 4.22Å; L197-L247 CarbonylContact O-C 3.48Å; L197-L247 WeakPolarHBondContact O-CA 3.37Å; L197-L247 WeakPolarHBondContact O-CD1 3.44Å; L197-L248 PolarHBondContact O-N 2.83Å; L197-F286 HydrophobicContact CD1-CD2 4.27Å; L197-F286 HydrophobicContact CD1-CE1 4.1Å; L197-F286 HydrophobicContact CD1-CE2 3.53Å; L197-F286 HydrophobicContact CD1-CZ 3.44Å; L197-F286 VanDerWaalsContact CD1-CZ 3.44Å
198	L	60.1	Low	46.2	Very low	3 Å²	3	75.1 Å²	75.1	2%	0.016	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	126.5	174.2	-171.1	74.7	0	0	0	110.5	F178 L179 F181 I205 L219 L248 P250	F178-L198 WeakPolarHBondContact CA-O 3.47Å; L179-L198 HydrophobicContact CB-CB 4.39Å; L179-L198 PolarHBondContact N-O 3.4Å; L179-L198 VanDerWaalsContact N-O 3.07Å; L179-L198 PolarHBondContact O-N 3Å; F181-L198 HydrophobicContact CD2-CB 4.11Å; F181-L198 HydrophobicContact CE2-CB 3.71Å; F181-L198 HydrophobicContact CE2-CD2 3.91Å; F181-L198 HydrophobicContact CE2-CG 4.45Å; F181-L198 HydrophobicContact CZ-CD2 4.41Å; L198-I205 HydrophobicContact CD2-CD1 3.77Å; L198-L219 HydrophobicContact CD1-CD1 3.78Å; L198-L219 HydrophobicContact CD2-CD1 4.12Å; L198-L248 HydrophobicContact CD1-CB 3.72Å; L198-P250 HydrophobicContact CD1-CG 4.11Å
199	L	53.1	Low	46	Very low	19 Å²	19	77.3 Å²	77.3	10%	0.099	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	109.1	172.9	-179.1	69.6	0	0	0	110.5	I177 F178 I201 L248	I177-L199 HydrophobicContact CG2-CD1 4.28Å; F178-L199 HydrophobicContact CD1-CD1 4.17Å; F178-L199 HydrophobicContact CE1-CB 4.18Å; F178-L199 HydrophobicContact CE1-CD1 3.57Å; F178-L199 HydrophobicContact CE1-CG 4.43Å; F178-L199 HydrophobicContact CE2-CD1 4.05Å; F178-L199 HydrophobicContact CZ-CD1 3.51Å; L199-I201 HydrophobicContact CD2-CD1 3.77Å; L199-I201 HydrophobicContact CD2-CG1 3.77Å; L199-I201 HydrophobicContact CG-CD1 4.24Å; L199-I201 HydrophobicContact CG-CG1 3.67Å; L199-I201 PolarHBondContact O-N 3.21Å; L199-L248 PolarHBondContact N-O 3.4Å
200	N	48.6	Very low	46.1	Very low	10 Å²	10	78.8 Å²	78.8	5%	0.053	39%	0.386	C	S	.	.			trans	-96.7	71.7	-174.7	-173.5	18.9	0	0	0	111.5	G176 I177 V204 I208	G176-N200 PolarHBondContact O-ND2 3.37Å; I177-N200 PolarHBondContact O-N 2.94Å; N200-V204 PolarHBondContact OD1-N 3.16Å; N200-I208 WeakPolarHBondContact ND2-CD1 3.33Å
201	I	41.5	Very low	46.2	Very low	116 Å²	116	71.1 Å²	71.1	60%	0.595	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-54.4	-170.9	-52.9	-179	0	0	0	112.5	L199	L199-I201 HydrophobicContact CD2-CD1 3.77Å; L199-I201 HydrophobicContact CD2-CG1 3.77Å; L199-I201 HydrophobicContact CG-CD1 4.24Å; L199-I201 HydrophobicContact CG-CG1 3.67Å; L199-I201 PolarHBondContact O-N 3.21Å
202	D	39.1	Very low	46.3	Very low	134 Å²	134	65.8 Å²	65.8	72%	0.717	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.4	23.7	-166.5	-67.3	-40.6	0	0	0	114.1	V204	D202-V204 HydrophobicContact CB-CG2 4.06Å; D202-V204 PolarHBondContact O-N 3.05Å; D202-V204 VanDerWaalsContact O-N 3.11Å
203	K	36.9	Very low	46.5	Very low	150 Å²	150	72 Å²	72	65%	0.652	36%	0.359	S	S	*	.			trans	49.8	33.5	-171.2	-55.9	179.7	180	177.7	0	112.8	I205 Q206	K203-I205 CarbonylContact O-C 3.6Å; K203-I205 PolarHBondContact O-N 2.81Å; K203-I205 VanDerWaalsContact O-N 3.13Å; K203-Q206 WeakPolarHBondContact O-CG 3.47Å; K203-Q206 PolarHBondContact O-N 3.48Å
204	V	39.9	Very low	46.6	Very low	87 Å²	87	77.7 Å²	77.7	53%	0.527	38%	0.376	S	S	.	.	S	Bend	trans	-55.1	-36	-179.1	-178.8	0	0	0	0	110.3	N200 D202 Q206	N200-V204 PolarHBondContact OD1-N 3.16Å; D202-V204 HydrophobicContact CB-CG2 4.06Å; D202-V204 PolarHBondContact O-N 3.05Å; D202-V204 VanDerWaalsContact O-N 3.11Å; V204-Q206 VanDerWaalsContact C-N 3.33Å; V204-Q206 PolarHBondContact O-N 3.22Å; V204-Q206 VanDerWaalsContact O-N 3.17Å
205	I	37.7	Very low	46.6	Very low	13 Å²	13	78.8 Å²	78.8	7%	0.067	38%	0.381	C	S	.	.			trans	-81.5	80.4	162.7	-52.2	173.4	0	0	0	107.9	L179 L198 K203 S207 I208 L211 I261	L179-I205 HydrophobicContact CD1-CD1 3.83Å; L198-I205 HydrophobicContact CD2-CD1 3.77Å; K203-I205 CarbonylContact O-C 3.6Å; K203-I205 PolarHBondContact O-N 2.81Å; K203-I205 VanDerWaalsContact O-N 3.13Å; I205-S207 PolarHBondContact O-N 3.32Å; I205-I208 HydrophobicContact CG2-CG1 4.24Å; I205-I208 WeakPolarHBondContact O-CG1 3.36Å; I205-L211 HydrophobicContact CD1-CD1 4.49Å; I205-L211 HydrophobicContact CG2-CD1 3.67Å; I205-I261 HydrophobicContact CG1-CD1 4.44Å
206	Q	39.2	Very low	46.7	Very low	181 Å²	181	81 Å²	81	85%	0.846	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-12.6	174.3	-69.7	-169.9	-10.3	0	0	112.4	K203 V204	K203-Q206 WeakPolarHBondContact O-CG 3.47Å; K203-Q206 PolarHBondContact O-N 3.48Å; V204-Q206 VanDerWaalsContact C-N 3.33Å; V204-Q206 PolarHBondContact O-N 3.22Å; V204-Q206 VanDerWaalsContact O-N 3.17Å
207	S	38.1	Very low	46.3	Very low	58 Å²	58	81.4 Å²	81.4	41%	0.406	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.6	33.9	-178.4	64.8	0	0	0	0	114.1	I205 D209 K210 L211	I205-S207 PolarHBondContact O-N 3.32Å; S207-D209 PolarHBondContact O-N 3.34Å; S207-K210 PolarHBondContact O-N 3.15Å; S207-L211 PolarHBondContact O-N 2.84Å
208	I	35.2	Very low	46.2	Very low	52 Å²	52	83 Å²	83	27%	0.267	40%	0.404	S	S	.	.	G	3₁₀ helix	trans	-52.7	-43	176.3	-70.3	158.6	0	0	0	110.7	N200 I205 K210 L211	N200-I208 WeakPolarHBondContact ND2-CD1 3.33Å; I205-I208 HydrophobicContact CG2-CG1 4.24Å; I205-I208 WeakPolarHBondContact O-CG1 3.36Å; I208-K210 PolarHBondContact O-N 2.91Å; I208-L211 PolarHBondContact O-N 3.27Å; I208-L211 VanDerWaalsContact O-N 3.16Å
209	D	39.8	Very low	46.1	Very low	167 Å²	167	83.5 Å²	83.5	89%	0.893	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-60.2	-6.3	177.4	-62.9	-5.1	0	0	0	114.6	S207	S207-D209 PolarHBondContact O-N 3.34Å
210	K	42.4	Very low	45.9	Very low	126 Å²	126	85.3 Å²	85.3	55%	0.548	41%	0.414	S	S	.	.	G	3₁₀ helix	trans	-117.3	-8.2	-179.2	-59.5	-172.5	179.9	-178.2	0	114.5	S207 I208 L212 Q215	S207-K210 PolarHBondContact O-N 3.15Å; I208-K210 PolarHBondContact O-N 2.91Å; K210-L212 PolarHBondContact O-N 2.76Å; K210-Q215 PolarHBondContact O-OE1 3.45Å
211	L	43	Very low	46	Very low	31 Å²	31	89.4 Å²	89.4	16%	0.162	44%	0.436	C	S	.	.			trans	-82.8	109.7	177.3	-79.7	172	0	0	0	109.8	L169 L179 I205 S207 I208 Q215 I217	L169-L211 HydrophobicContact CD2-CB 3.95Å; L179-L211 HydrophobicContact CD1-CD1 4.4Å; I205-L211 HydrophobicContact CD1-CD1 4.49Å; I205-L211 HydrophobicContact CG2-CD1 3.67Å; S207-L211 PolarHBondContact O-N 2.84Å; I208-L211 PolarHBondContact O-N 3.27Å; I208-L211 VanDerWaalsContact O-N 3.16Å; L211-Q215 HydrophobicContact CD2-CG 4.46Å; L211-I217 HydrophobicContact CD2-CG2 3.8Å
212	L	45.6	Very low	46.5	Very low	95 Å²	95	83.9 Å²	83.9	50%	0.497	41%	0.407	S	S	.	.			trans	-84.3	153.7	178	-70.5	170.6	0	0	0	111.7	K210 R214 Q215 Y616	K210-L212 PolarHBondContact O-N 2.76Å; L212-R214 PolarHBondContact O-N 3.48Å; L212-Q215 VanDerWaalsContact N-OE1 3.11Å; L212-Q215 WeakPolarHBondContact O-CB 3.2Å; L212-Q215 PolarHBondContact O-N 3.02Å; L212-Y616 WeakPolarHBondContact CD1-OH 3.46Å
213	Y	50.4	Low	47	Very low	157 Å²	157	80.4 Å²	80.4	62%	0.616	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.7	134.2	169.9	-169.6	-83.1	0	0	0	110.2	I170 Q215	I170-Y213 WeakPolarHBondContact O-CD2 3.47Å; I170-Y213 WeakPolarHBondContact O-CE2 3.31Å; Y213-Q215 VanDerWaalsContact C-N 3.27Å; Y213-Q215 PolarHBondContact O-N 3.35Å
214	R	52.8	Low	47.8	Very low	185 Å²	185	73.3 Å²	73.3	70%	0.698	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.4	7.2	-171.4	-71.5	171.9	174.4	-174.3	-2.1	117.4	L169 L212 T216	L169-R214 WeakPolarHBondContact O-CA 3.48Å; L169-R214 PolarHBondContact O-N 3.18Å; L212-R214 PolarHBondContact O-N 3.48Å; R214-T216 PolarHBondContact O-N 3.01Å
215	Q	55.7	Low	48.4	Very low	45 Å²	45	70.5 Å²	70.5	21%	0.21	33%	0.334	C	S	.	.			trans	-68.3	122.9	175.8	-175.3	172.5	-8.9	0	0	111.6	S168 L169 K210 L211 L212 Y213	S168-Q215 WeakPolarHBondContact CA-O 3.42Å; L169-Q215 PolarHBondContact N-O 3.4Å; L169-Q215 VanDerWaalsContact N-O 3.12Å; K210-Q215 PolarHBondContact O-OE1 3.45Å; L211-Q215 HydrophobicContact CD2-CG 4.46Å; L212-Q215 VanDerWaalsContact N-OE1 3.11Å; L212-Q215 WeakPolarHBondContact O-CB 3.2Å; L212-Q215 PolarHBondContact O-N 3.02Å; Y213-Q215 VanDerWaalsContact C-N 3.27Å; Y213-Q215 PolarHBondContact O-N 3.35Å
216	T	57.9	Low	48.9	Very low	64 Å²	64	71.7 Å²	71.7	39%	0.393	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	134	174.8	-42.2	0	0	0	0	111.5	L167 T184 R214	L167-T216 CarbonylContact O-C 3.59Å; L167-T216 VanDerWaalsContact O-CA 3.27Å; L167-T216 WeakPolarHBondContact O-CA 3.45Å; T184-T216 HydrophobicContact CG2-CG2 3.83Å; R214-T216 PolarHBondContact O-N 3.01Å
217	I	57	Low	49.1	Very low	7 Å²	7	63.6 Å²	63.6	4%	0.036	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	149.2	170.3	64.8	170.6	0	0	0	109.4	L167 F181 L211 L219 I261	L167-I217 HydrophobicContact CB-CG1 4.09Å; L167-I217 PolarHBondContact N-O 3.48Å; L167-I217 WeakPolarHBondContact O-CG1 3.48Å; L167-I217 PolarHBondContact O-N 2.95Å; F181-I217 HydrophobicContact CD1-CD1 4.15Å; F181-I217 HydrophobicContact CD1-CG1 4.23Å; F181-I217 HydrophobicContact CE1-CD1 3.3Å; F181-I217 HydrophobicContact CE1-CG1 3.74Å; F181-I217 HydrophobicContact CE2-CD1 4.31Å; F181-I217 HydrophobicContact CZ-CD1 3.41Å; F181-I217 VanDerWaalsContact CZ-CD1 3.41Å; F181-I217 HydrophobicContact CZ-CG1 4.34Å; L211-I217 HydrophobicContact CD2-CG2 3.8Å; I217-L219 HydrophobicContact CD1-CD1 4.19Å; I217-L219 HydrophobicContact CD1-CD2 3.9Å; I217-L219 HydrophobicContact CD1-CG 3.97Å; I217-L219 HydrophobicContact CG1-CG 4.39Å; I217-I261 HydrophobicContact CB-CG2 4.13Å; I217-I261 HydrophobicContact CG2-CG2 4.49Å
218	K	57.1	Low	49.2	Very low	43 Å²	43	61.6 Å²	61.6	19%	0.187	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	123.5	169.9	-160.5	166.6	-176.4	-179.2	0	108.8	I165 D166 F220 I261 D262	I165-K218 WeakPolarHBondContact O-CA 3.1Å; D166-K218 WeakPolarHBondContact OD1-CD 3.49Å; D166-K218 WeakPolarHBondContact OD1-CG 3.47Å; K218-F220 HydrophobicContact CB-CE2 4.11Å; K218-F220 HydrophobicContact CD-CE2 3.93Å; K218-F220 HydrophobicContact CD-CZ 3.74Å; K218-F220 HydrophobicContact CG-CD2 4.36Å; K218-F220 HydrophobicContact CG-CE2 3.68Å; K218-F220 HydrophobicContact CG-CZ 3.91Å; K218-I261 WeakPolarHBondContact O-CA 3.4Å; K218-D262 WeakPolarHBondContact CB-O 3.39Å; K218-D262 PolarHBondContact N-O 2.88Å
219	L	56.9	Low	49.5	Very low	13 Å²	13	62.7 Å²	62.7	7%	0.068	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	134.7	176	-60.9	-179	0	0	0	109.8	S164 I165 L167 L198 I217 V222 I261	S164-L219 CarbonylContact C-O 3.58Å; S164-L219 VanDerWaalsContact CA-O 3.3Å; S164-L219 WeakPolarHBondContact CA-O 3.32Å; I165-L219 HydrophobicContact CG2-CB 4.08Å; I165-L219 PolarHBondContact N-O 3.4Å; I165-L219 PolarHBondContact O-N 2.86Å; L167-L219 HydrophobicContact CD1-CD1 3.83Å; L167-L219 HydrophobicContact CD1-CG 4.37Å; L198-L219 HydrophobicContact CD1-CD1 3.78Å; L198-L219 HydrophobicContact CD2-CD1 4.12Å; I217-L219 HydrophobicContact CD1-CD1 4.19Å; I217-L219 HydrophobicContact CD1-CD2 3.9Å; I217-L219 HydrophobicContact CD1-CG 3.97Å; I217-L219 HydrophobicContact CG1-CG 4.39Å; L219-V222 HydrophobicContact CB-CG2 3.43Å; L219-V222 VanDerWaalsContact CB-CG2 3.43Å; L219-V222 HydrophobicContact CD1-CG2 4.39Å; L219-I261 HydrophobicContact CD2-CD1 4.17Å; L219-I261 HydrophobicContact CD2-CG1 4.05Å
220	F	50	Low	49.4	Very low	58 Å²	58	58.5 Å²	58.5	25%	0.254	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	148.1	-179.8	-63.1	-105.9	0	0	0	111.7	P163 K218 V222 I260 D262	P163-F220 CarbonylContact O-C 3.53Å; P163-F220 WeakPolarHBondContact O-CA 3.31Å; P163-F220 WeakPolarHBondContact O-CB 3.1Å; K218-F220 HydrophobicContact CB-CE2 4.11Å; K218-F220 HydrophobicContact CD-CE2 3.93Å; K218-F220 HydrophobicContact CD-CZ 3.74Å; K218-F220 HydrophobicContact CG-CD2 4.36Å; K218-F220 HydrophobicContact CG-CE2 3.68Å; K218-F220 HydrophobicContact CG-CZ 3.91Å; F220-V222 PolarHBondContact O-N 3.23Å; F220-I260 WeakPolarHBondContact CD2-O 3.42Å; F220-I260 WeakPolarHBondContact CE2-O 3.3Å; F220-D262 HydrophobicContact CE2-CB 4.09Å; F220-D262 HydrophobicContact CZ-CB 4.42Å
221	N	49.2	Very low	49.1	Very low	95 Å²	95	58.9 Å²	58.9	51%	0.508	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	52.3	47.8	178.5	-58.3	-50.6	0	0	0	114	L161 I162 P163	L161-N221 HydrophobicContact CD1-CB 4.46Å; I162-N221 CarbonylContact O-C 3.53Å; I162-N221 VanDerWaalsContact O-CA 3.31Å; I162-N221 WeakPolarHBondContact O-CA 3.06Å; I162-N221 PolarHBondContact O-N 3.06Å; P163-N221 PolarHBondContact O-N 2.81Å
222	V	52.2	Low	48.7	Very low	1 Å²	1	63.2 Å²	63.2	1%	0.006	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	136.4	-177.5	-164.2	0	0	0	0	110.3	I162 I165 L219 F220 L248	I162-V222 PolarHBondContact N-O 2.92Å; I162-V222 PolarHBondContact O-N 2.91Å; I165-V222 HydrophobicContact CG2-CG2 4.35Å; L219-V222 HydrophobicContact CB-CG2 3.43Å; L219-V222 VanDerWaalsContact CB-CG2 3.43Å; L219-V222 HydrophobicContact CD1-CG2 4.39Å; F220-V222 PolarHBondContact O-N 3.23Å; V222-L248 HydrophobicContact CG1-CB 3.75Å; V222-L248 HydrophobicContact CG1-CD1 4.34Å; V222-L248 HydrophobicContact CG1-CD2 3.89Å; V222-L248 HydrophobicContact CG1-CG 4.19Å
223	W	51	Low	48.3	Very low	61 Å²	61	63.5 Å²	63.5	23%	0.231	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	128.3	171.7	-70.2	78.5	0	0	0	110.4	P158 V159 G160 L161 F225 L248 I249 I252	P158-W223 HydrophobicContact CB-CH2 3.46Å; P158-W223 VanDerWaalsContact CB-CH2 3.46Å; P158-W223 HydrophobicContact CB-CZ2 4.13Å; P158-W223 HydrophobicContact CB-CZ3 4.12Å; P158-W223 HydrophobicContact CG-CH2 4.43Å; V159-W223 WeakPolarHBondContact O-CZ3 3.28Å; G160-W223 WeakPolarHBondContact O-CA 3.29Å; L161-W223 HydrophobicContact CB-CD2 4.49Å; L161-W223 HydrophobicContact CD1-CD2 4.35Å; L161-W223 HydrophobicContact CD1-CG 4.37Å; L161-W223 HydrophobicContact CD1-CZ2 4.49Å; W223-F225 HydrophobicContact CB-CE2 4.02Å; W223-F225 HydrophobicContact CB-CZ 4.44Å; W223-L248 WeakPolarHBondContact O-CA 3.31Å; W223-I249 PolarHBondContact N-O 2.81Å; W223-I249 PolarHBondContact O-N 2.92Å; W223-I252 HydrophobicContact CG-CD1 4.22Å
224	S	53.3	Low	47.6	Very low	0 Å²	0	64.6 Å²	64.6	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	133.3	178.5	72.1	0	0	0	0	112.6	G160 I162 L247	G160-S224 PolarHBondContact O-N 3.22Å; G160-S224 PolarHBondContact O-OG 3.32Å; I162-S224 WeakPolarHBondContact CD1-OG 3.42Å; S224-L247 WeakPolarHBondContact CA-O 3.37Å
225	F	52.6	Low	46.8	Very low	28 Å²	28	60.5 Å²	60.5	12%	0.123	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	113.4	173.4	-56.5	-89.1	0	0	0	108.3	W223 A246 L247 I249 V277	W223-F225 HydrophobicContact CB-CE2 4.02Å; W223-F225 HydrophobicContact CB-CZ 4.44Å; F225-A246 CarbonylContact O-C 3.39Å; F225-A246 VanDerWaalsContact O-CA 3.23Å; F225-A246 WeakPolarHBondContact O-CA 3.44Å; F225-L247 HydrophobicContact CB-CB 4.49Å; F225-L247 PolarHBondContact N-O 3.47Å; F225-L247 PolarHBondContact O-N 3.33Å; F225-I249 HydrophobicContact CD2-CD1 4.44Å; F225-I249 HydrophobicContact CE2-CD1 3.88Å; F225-I249 HydrophobicContact CE2-CG1 4.27Å; F225-V277 HydrophobicContact CD1-CB 4.36Å
226	Y	47.2	Very low	46.3	Very low	39 Å²	39	67.4 Å²	67.4	15%	0.153	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	137.1	179.9	-78.1	-90.4	0	0	0	110.4	Y196 L244 A246 T276 V277 C279	Y196-Y226 PolarHBondContact OH-OH 2.99Å; Y226-L244 HydrophobicContact CD1-CD2 4.06Å; Y226-A246 HydrophobicContact CD1-CB 3.91Å; Y226-A246 HydrophobicContact CE1-CB 4.13Å; Y226-A246 HydrophobicContact CG-CB 4.22Å; Y226-T276 HydrophobicContact CD2-CG2 4.2Å; Y226-T276 HydrophobicContact CE2-CG2 3.83Å; Y226-V277 PolarHBondContact N-O 3.09Å; Y226-C279 WeakPolarHBondContact O-CA 3.5Å; Y226-C279 WeakPolarHBondContact O-CB 3.39Å; Y226-C279 PolarHBondContact O-N 3.45Å
227	I	43.8	Very low	45.7	Very low	10 Å²	10	73.5 Å²	73.5	5%	0.051	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	98.9	178.8	-64.5	170.9	0	0	0	106.4	Y245 L247 C279 F284	I227-Y245 CarbonylContact C-O 3.51Å; I227-Y245 PolarHBondContact N-O 2.94Å; I227-Y245 VanDerWaalsContact O-O 3.12Å; I227-L247 HydrophobicContact CD1-CB 4.05Å; I227-C279 WeakPolarHBondContact CA-O 3.49Å; I227-F284 HydrophobicContact CB-CD2 4.39Å; I227-F284 HydrophobicContact CD1-CD1 4.3Å; I227-F284 HydrophobicContact CD1-CD2 3.75Å; I227-F284 HydrophobicContact CD1-CE1 4.46Å; I227-F284 HydrophobicContact CD1-CE2 3.93Å; I227-F284 HydrophobicContact CD1-CG 3.95Å; I227-F284 HydrophobicContact CD1-CZ 4.29Å; I227-F284 HydrophobicContact CG1-CD2 3.82Å; I227-F284 HydrophobicContact CG1-CE2 3.97Å; I227-F284 HydrophobicContact CG1-CG 4.47Å; I227-F284 HydrophobicContact CG2-CB 3.83Å; I227-F284 HydrophobicContact CG2-CD2 3.68Å; I227-F284 HydrophobicContact CG2-CG 4.07Å
228	G	40.6	Very low	44.9	Very low	17 Å²	17	75.7 Å²	75.7	18%	0.175	36%	0.362	C	S	.	.	S	Bend	trans	169.3	136.5	-177.5	0	0	0	0	0	114.5	N230 C279 S281	G228-N230 PolarHBondContact O-N 3.27Å; G228-C279 PolarHBondContact N-O 2.89Å; G228-S281 WeakPolarHBondContact CA-OG 3.32Å
229	D	41.8	Very low	44	Very low	74 Å²	74	84 Å²	84	40%	0.396	40%	0.398	S	S	.	.			trans	-81.5	103	174.4	-66.4	-58.8	0	0	0	109.9	N231 P280 S281	D229-N231 PolarHBondContact O-N 2.91Å; D229-P280 WeakPolarHBondContact OD1-CB 3.41Å; D229-S281 VanDerWaalsContact CG-OG 3.25Å; D229-S281 PolarHBondContact N-OG 2.93Å; D229-S281 WeakPolarHBondContact OD2-CB 3.09Å; D229-S281 PolarHBondContact OD2-N 2.9Å; D229-S281 PolarHBondContact OD2-OG 3.06Å
230	N	36.5	Very low	42.9	Very low	80 Å²	80	91 Å²	91	43%	0.428	43%	0.431	S	S	.	.	G	3₁₀ helix	trans	-66.3	9.2	-173.9	-116.9	24.1	0	0	0	115.5	G228 Q278	G228-N230 PolarHBondContact O-N 3.27Å; N230-Q278 PolarHBondContact ND2-NE2 2.75Å
231	N	36.8	Very low	42.2	Very low	133 Å²	133	91.9 Å²	91.9	71%	0.711	44%	0.443	S	S	*	.	G	3₁₀ helix	trans	-76.2	-28	-175.2	-77.1	-13.3	0	0	0	113.3	D229 Y233	D229-N231 PolarHBondContact O-N 2.91Å; N231-Y233 PolarHBondContact O-N 3.19Å
232	D	35.1	Very low	41.9	Very low	122 Å²	122	91.1 Å²	91.1	65%	0.652	44%	0.438	S	S	*	.	G	3₁₀ helix	trans	-83.2	6.2	-178.5	-71.5	-13.5	0	0	0	114	Y234 I242	D232-Y234 PolarHBondContact O-N 3.17Å; D232-I242 HydrophobicContact CB-CD1 4.43Å; D232-I242 WeakPolarHBondContact O-CD1 3.27Å
233	Y	36.4	Very low	41.5	Very low	101 Å²	101	94.8 Å²	94.8	40%	0.396	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-2.1	178	-146.1	-89.4	0	0	0	114.3	N231	N231-Y233 PolarHBondContact O-N 3.19Å
234	Y	35	Very low	41.4	Very low	181 Å²	181	93 Å²	93	71%	0.71	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134.9	20.7	-172.3	-82.7	-67.1	0	0	0	116.7	D232 K236	D232-Y234 PolarHBondContact O-N 3.17Å; Y234-K236 VanDerWaalsContact C-N 3.27Å; Y234-K236 PolarHBondContact O-N 3.41Å
235	D	37.1	Very low	41.2	Very low	98 Å²	98	96.4 Å²	96.4	52%	0.524	47%	0.466	S	S	.	.			trans	-73	88.4	161	-164.7	-7.4	0	0	0	110.7	K237 S238	D235-K237 PolarHBondContact O-N 3.29Å; D235-K237 PolarHBondContact OD1-N 3.16Å; D235-K237 VanDerWaalsContact OD1-N 3.1Å; D235-S238 PolarHBondContact O-N 3.46Å
236	K	45.4	Very low	41.4	Very low	190 Å²	190	95 Å²	95	83%	0.826	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-3.8	179.7	-77.8	-179.3	174.8	175.2	0	114.2	Y234	Y234-K236 VanDerWaalsContact C-N 3.27Å; Y234-K236 PolarHBondContact O-N 3.41Å
237	K	44.4	Very low	41.9	Very low	192 Å²	192	93.6 Å²	93.6	84%	0.835	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.5	-25.5	-177	-70.6	-175.7	176.1	179.2	0	114.8	D235	D235-K237 PolarHBondContact O-N 3.29Å; D235-K237 PolarHBondContact OD1-N 3.16Å; D235-K237 VanDerWaalsContact OD1-N 3.1Å
238	S	39.5	Very low	42.6	Very low	53 Å²	53	93.1 Å²	93.1	37%	0.371	45%	0.452	S	S	.	.			trans	-86.7	114.7	177.8	49.5	0	0	0	0	110.8	D235 Q240	D235-S238 PolarHBondContact O-N 3.46Å; S238-Q240 PolarHBondContact O-N 3.48Å; S238-Q240 VanDerWaalsContact O-N 3.13Å
239	K	38.5	Very low	43.1	Very low	217 Å²	217	93.7 Å²	93.7	94%	0.943	45%	0.451	S	S	*	.			trans	-79.2	28.8	170.9	-75.2	-173.8	175.2	-179.6	0	112.5
240	Q	34.4	Very low	43.3	Very low	162 Å²	162	92.2 Å²	92.2	76%	0.757	45%	0.446	S	S	*	.	P	Polyproline II helix	trans	-93.2	130.8	176.7	-76.9	175	-48.3	0	0	108.9	S238 I242	S238-Q240 PolarHBondContact O-N 3.48Å; S238-Q240 VanDerWaalsContact O-N 3.13Å; Q240-I242 PolarHBondContact O-N 2.88Å
241	C	34.6	Very low	43.5	Very low	75 Å²	75	90 Å²	90	51%	0.507	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-61	134.2	168.6	-72.1	0	0	0	0	108.6
242	I	42.9	Very low	43.4	Very low	80 Å²	80	86.5 Å²	86.5	41%	0.41	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-94	119.5	172.4	-60	172.8	0	0	0	106.7	D232 Q240	D232-I242 HydrophobicContact CB-CD1 4.43Å; D232-I242 WeakPolarHBondContact O-CD1 3.27Å; Q240-I242 PolarHBondContact O-N 2.88Å
243	D	45.3	Very low	43.2	Very low	77 Å²	77	89.6 Å²	89.6	41%	0.412	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-73.3	124.1	174.1	-71	-51.2	0	0	0	109.8	N193 H195 Y245	N193-D243 VanDerWaalsContact CB-OD1 3.29Å; N193-D243 WeakPolarHBondContact CB-OD1 3.38Å; H195-D243 IonicContact CD2-OD1 3.96Å; H195-D243 PolarHBondContact CD2-OD1 2.76Å; H195-D243 IonicContact CE1-OD1 3.99Å; H195-D243 IonicContact NE2-OD1 2.66Å; H195-D243 PolarHBondContact NE2-OD1 3.2Å; D243-Y245 HydrophobicContact CB-CE2 4.05Å
244	L	48	Very low	42.7	Very low	25 Å²	25	87.6 Å²	87.6	13%	0.131	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	111.5	-174.8	-122.6	162.9	0	0	0	109.9	V192 N193 Q194 H195 Y226	V192-L244 HydrophobicContact CG1-CB 3.77Å; V192-L244 HydrophobicContact CG1-CD1 3.6Å; V192-L244 HydrophobicContact CG1-CG 4.26Å; N193-L244 PolarHBondContact O-N 3.02Å; Q194-L244 CarbonylContact C-O 3.49Å; Q194-L244 WeakPolarHBondContact CA-O 3.46Å; Q194-L244 HydrophobicContact CG-CB 4.5Å; H195-L244 PolarHBondContact N-O 3.18Å; Y226-L244 HydrophobicContact CD1-CD2 4.06Å
245	Y	48.6	Very low	42.4	Very low	70 Å²	70	85.2 Å²	85.2	28%	0.275	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	148.5	-175.7	-73.5	-88.8	0	0	0	112.7	H195 I227 D243	H195-Y245 HydrophobicContact CB-CD1 3.56Å; H195-Y245 HydrophobicContact CB-CE1 3.47Å; H195-Y245 VanDerWaalsContact CB-CE1 3.47Å; H195-Y245 HydrophobicContact CB-CG 4.24Å; H195-Y245 AromaticContact CG-CE1 3.97Å; H195-Y245 CarbonylContact O-C 3.54Å; H195-Y245 VanDerWaalsContact O-CA 3.26Å; H195-Y245 WeakPolarHBondContact O-CA 3.39Å; I227-Y245 CarbonylContact C-O 3.51Å; I227-Y245 PolarHBondContact N-O 2.94Å; I227-Y245 VanDerWaalsContact O-O 3.12Å; D243-Y245 HydrophobicContact CB-CE2 4.05Å
246	A	57.4	Low	41.9	Very low	0 Å²	0	83.6 Å²	83.6	0%	0	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	143.7	171	0	0	0	0	0	112.1	H195 Y196 L197 F225 Y226	H195-A246 PolarHBondContact O-N 3.41Å; Y196-A246 CarbonylContact C-O 3.6Å; Y196-A246 VanDerWaalsContact CA-O 3.29Å; Y196-A246 WeakPolarHBondContact CA-O 3.38Å; Y196-A246 HydrophobicContact CD1-CB 3.66Å; Y196-A246 HydrophobicContact CE1-CB 3.69Å; L197-A246 PolarHBondContact N-O 3.4Å; F225-A246 CarbonylContact O-C 3.39Å; F225-A246 VanDerWaalsContact O-CA 3.23Å; F225-A246 WeakPolarHBondContact O-CA 3.44Å; Y226-A246 HydrophobicContact CD1-CB 3.91Å; Y226-A246 HydrophobicContact CE1-CB 4.13Å; Y226-A246 HydrophobicContact CG-CB 4.22Å
247	L	57	Low	41.1	Very low	8 Å²	8	81 Å²	81	4%	0.042	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	133	172.1	-173.3	77.3	0	0	0	110.2	F178 L197 S224 F225 I227 I249 L302	F178-L247 HydrophobicContact CE1-CD1 4.1Å; L197-L247 HydrophobicContact CB-CD1 4.22Å; L197-L247 CarbonylContact O-C 3.48Å; L197-L247 WeakPolarHBondContact O-CA 3.37Å; L197-L247 WeakPolarHBondContact O-CD1 3.44Å; S224-L247 WeakPolarHBondContact CA-O 3.37Å; F225-L247 HydrophobicContact CB-CB 4.49Å; F225-L247 PolarHBondContact N-O 3.47Å; F225-L247 PolarHBondContact O-N 3.33Å; I227-L247 HydrophobicContact CD1-CB 4.05Å; L247-I249 HydrophobicContact CD2-CD1 4.41Å; L247-I249 HydrophobicContact CD2-CG1 4.38Å; L247-L302 HydrophobicContact CD2-CD2 3.52Å
248	L	58.8	Low	40.3	Very low	0 Å²	0	74.8 Å²	74.8	0%	0	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	129.2	175.3	-68	-174	0	0	0	111.2	L167 Y196 L197 L198 L199 V222 W223	L167-L248 HydrophobicContact CD1-CD1 3.49Å; L167-L248 VanDerWaalsContact CD1-CD1 3.49Å; Y196-L248 HydrophobicContact CD1-CD1 3.83Å; Y196-L248 HydrophobicContact CD1-CD2 3.72Å; Y196-L248 HydrophobicContact CD1-CG 3.72Å; Y196-L248 HydrophobicContact CE1-CD2 4.26Å; Y196-L248 HydrophobicContact CG-CD1 4.02Å; Y196-L248 HydrophobicContact CG-CG 4.29Å; L197-L248 PolarHBondContact O-N 2.83Å; L198-L248 HydrophobicContact CD1-CB 3.72Å; L199-L248 PolarHBondContact N-O 3.4Å; V222-L248 HydrophobicContact CG1-CB 3.75Å; V222-L248 HydrophobicContact CG1-CD1 4.34Å; V222-L248 HydrophobicContact CG1-CD2 3.89Å; V222-L248 HydrophobicContact CG1-CG 4.19Å; W223-L248 WeakPolarHBondContact O-CA 3.31Å
249	I	52.2	Low	39.7	Very low	29 Å²	29	74.5 Å²	74.5	15%	0.149	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	113.3	173.6	-49.9	-178.6	0	0	0	109.5	W223 F225 L247 I252	W223-I249 PolarHBondContact N-O 2.81Å; W223-I249 PolarHBondContact O-N 2.92Å; F225-I249 HydrophobicContact CD2-CD1 4.44Å; F225-I249 HydrophobicContact CE2-CD1 3.88Å; F225-I249 HydrophobicContact CE2-CG1 4.27Å; L247-I249 HydrophobicContact CD2-CD1 4.41Å; L247-I249 HydrophobicContact CD2-CG1 4.38Å; I249-I252 HydrophobicContact CB-CD1 4.28Å; I249-I252 HydrophobicContact CG2-CD1 3.85Å; I249-I252 HydrophobicContact CG2-CG1 3.83Å
250	P	44.6	Very low	39.3	Very low	43 Å²	43	68.7 Å²	68.7	28%	0.279	40%	0.396	S	S	.	.			trans	-80.5	149.5	174	32.5	-31.8	0	0	0	111.6	L198 I252	L198-P250 HydrophobicContact CD1-CG 4.11Å; P250-I252 PolarHBondContact O-N 3.39Å
251	G	41.3	Very low	39.1	Very low	34 Å²	34	64.2 Å²	64.2	35%	0.351	38%	0.377	S	S	.	.			trans	82.1	7	152.3	0	0	0	0	0	119.9	Y253 S254	G251-Y253 PolarHBondContact O-N 2.81Å; G251-S254 WeakPolarHBondContact CA-OG 3.35Å; G251-S254 PolarHBondContact O-N 3.25Å; G251-S254 VanDerWaalsContact O-N 3.12Å; G251-S254 PolarHBondContact O-OG 3.21Å
252	I	35.3	Very low	38.9	Very low	59 Å²	59	63.3 Å²	63.3	30%	0.303	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.2	-24.1	-172.7	-56.6	-179.9	0	0	0	114.6	W223 I249 P250	W223-I252 HydrophobicContact CG-CD1 4.22Å; I249-I252 HydrophobicContact CB-CD1 4.28Å; I249-I252 HydrophobicContact CG2-CD1 3.85Å; I249-I252 HydrophobicContact CG2-CG1 3.83Å; P250-I252 PolarHBondContact O-N 3.39Å
253	Y	30.3	Very low	38.2	Very low	187 Å²	187	64.2 Å²	64.2	73%	0.733	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.6	19.6	176.1	-67.3	-72.1	0	0	0	115.4	G251 S255	G251-Y253 PolarHBondContact O-N 2.81Å; Y253-S255 PolarHBondContact O-N 2.86Å; Y253-S255 VanDerWaalsContact O-N 3.09Å
254	S	27	Very low	37.7	Very low	59 Å²	59	65.1 Å²	65.1	41%	0.413	38%	0.377	S	S	.	.			trans	-85.4	74.9	179.6	58.8	0	0	0	0	112.4	G251 S256	G251-S254 WeakPolarHBondContact CA-OG 3.35Å; G251-S254 PolarHBondContact O-N 3.25Å; G251-S254 VanDerWaalsContact O-N 3.12Å; G251-S254 PolarHBondContact O-OG 3.21Å; S254-S256 PolarHBondContact O-N 3.12Å; S254-S256 VanDerWaalsContact O-N 3.11Å
255	S	27.6	Very low	36.7	Very low	131 Å²	131	71.3 Å²	71.3	92%	0.916	41%	0.41	S	S	*	.			trans	-75.1	15.9	169.1	68.6	0	0	0	0	113.7	Y253	Y253-S255 PolarHBondContact O-N 2.86Å; Y253-S255 VanDerWaalsContact O-N 3.09Å
256	S	26.4	Very low	35.7	Very low	64 Å²	64	75 Å²	75	45%	0.448	43%	0.427	S	S	.	.	S	Bend	trans	-133.1	131.6	169.2	53.7	0	0	0	0	107.4	S254 S258	S254-S256 PolarHBondContact O-N 3.12Å; S254-S256 VanDerWaalsContact O-N 3.11Å; S256-S258 PolarHBondContact O-N 2.64Å
257	S	29.6	Very low	34.2	Very low	137 Å²	137	80.1 Å²	80.1	96%	0.958	46%	0.463	S	S	*	.	S	Bend	trans	-72.7	60.5	-167.4	52.4	0	0	0	0	113.9
258	S	27	Very low	32.6	Very low	61 Å²	61	85.1 Å²	85.1	43%	0.427	50%	0.498	S	S	.	.			trans	-143.9	48.5	-173.2	68.9	0	0	0	0	112.9	S256 I260	S256-S258 PolarHBondContact O-N 2.64Å; S258-I260 PolarHBondContact O-N 2.98Å
259	S	27.8	Very low	30.8	Very low	47 Å²	47	91.4 Å²	91.4	33%	0.329	53%	0.532	S	S	.	.			trans	-75.4	78.8	141.1	58.7	0	0	0	0	106.7	I261	S259-I261 PolarHBondContact O-N 3.43Å; S259-I261 VanDerWaalsContact O-N 3.1Å
260	I	30.2	Very low	29.4	Very low	95 Å²	95	96.4 Å²	96.4	49%	0.487	56%	0.558	S	S	.	*			trans	-66.4	111.1	177.8	-59.5	173.9	0	0	0	106.1	F220 S258 D262	F220-I260 WeakPolarHBondContact CD2-O 3.42Å; F220-I260 WeakPolarHBondContact CE2-O 3.3Å; S258-I260 PolarHBondContact O-N 2.98Å; I260-D262 VanDerWaalsContact C-N 3.3Å; I260-D262 WeakPolarHBondContact CG2-OD1 3.48Å; I260-D262 WeakPolarHBondContact CG2-OD2 3.29Å; I260-D262 PolarHBondContact O-N 2.96Å
261	I	29.3	Very low	28.2	Very low	68 Å²	68	99.1 Å²	99.1	35%	0.349	58%	0.577	S	S	.	*			trans	-83.8	85.8	169.8	-56.4	179.1	0	0	0	106	I205 I217 K218 L219 S259	I205-I261 HydrophobicContact CG1-CD1 4.44Å; I217-I261 HydrophobicContact CB-CG2 4.13Å; I217-I261 HydrophobicContact CG2-CG2 4.49Å; K218-I261 WeakPolarHBondContact O-CA 3.4Å; L219-I261 HydrophobicContact CD2-CD1 4.17Å; L219-I261 HydrophobicContact CD2-CG1 4.05Å; S259-I261 PolarHBondContact O-N 3.43Å; S259-I261 VanDerWaalsContact O-N 3.1Å
262	D	31.5	Very low	27.5	Very low	55 Å²	55	106.1 Å²	106.1	29%	0.294	60%	0.595	S	S	.	*			trans	-70.3	140.2	170.2	-78.3	-40.9	0	0	0	109.8	K218 F220 I260 D264	K218-D262 WeakPolarHBondContact CB-O 3.39Å; K218-D262 PolarHBondContact N-O 2.88Å; F220-D262 HydrophobicContact CE2-CB 4.09Å; F220-D262 HydrophobicContact CZ-CB 4.42Å; I260-D262 VanDerWaalsContact C-N 3.3Å; I260-D262 WeakPolarHBondContact CG2-OD1 3.48Å; I260-D262 WeakPolarHBondContact CG2-OD2 3.29Å; I260-D262 PolarHBondContact O-N 2.96Å; D262-D264 HydrophobicContact CB-CB 4.29Å
263	I	27.3	Very low	27.1	Very low	100 Å²	100	108.2 Å²	108.2	51%	0.513	62%	0.615	S	S	.	*			trans	-113.7	60.9	173.4	-50.8	176.4	0	0	0	105.4
264	D	35.4	Very low	27.1	Very low	96 Å²	96	110 Å²	110	51%	0.513	62%	0.62	S	S	.	*			trans	-88.6	135.3	-164.3	-88.9	-9.3	0	0	0	114	D262	D262-D264 HydrophobicContact CB-CB 4.29Å
265	D	27	Very low	27.2	Very low	154 Å²	154	110.9 Å²	110.9	82%	0.824	63%	0.625	S	S	*	*			trans	-81.2	145.1	160.6	-87.4	-49.2	0	0	0	111.5
266	K	27	Very low	27.3	Very low	149 Å²	149	108 Å²	108	65%	0.648	60%	0.602	S	S	*	*	S	Bend	trans	69.7	148.7	171.3	-61.3	-171.8	173.7	-171.3	0	117	E594	K266-E594 IonicContact NZ-OE1 2.67Å; K266-E594 PolarHBondContact NZ-OE1 3.44Å; K266-E594 IonicContact NZ-OE2 3.43Å; K266-E594 PolarHBondContact NZ-OE2 2.75Å
267	S	25.9	Very low	27.5	Very low	106 Å²	106	107.9 Å²	107.9	74%	0.741	60%	0.598	S	S	*	*			trans	-118.7	143.5	-154.5	49.4	0	0	0	0	113
268	S	22.8	Very low	27.6	Very low	113 Å²	113	105.2 Å²	105.2	79%	0.79	57%	0.57	S	S	*	*			trans	-122.1	117.2	164.1	48.3	0	0	0	0	109.6
269	N	21.9	Very low	27.9	Very low	133 Å²	133	103.1 Å²	103.1	71%	0.711	56%	0.556	S	S	*	*			trans	-83.7	115.7	-176.3	-75.4	-38.6	0	0	0	110.8
270	I	22	Very low	28.1	Very low	134 Å²	134	101.5 Å²	101.5	69%	0.687	54%	0.544	S	S	*	.			trans	-133.5	128.5	164	-50.7	-179.4	0	0	0	109.1	Y272	I270-Y272 HydrophobicContact CG2-CD2 4Å; I270-Y272 HydrophobicContact CG2-CE2 3.44Å; I270-Y272 VanDerWaalsContact CG2-CE2 3.44Å
271	S	20.5	Very low	28.2	Very low	99 Å²	99	99.2 Å²	99.2	69%	0.692	54%	0.536	S	S	*	.			trans	-98.8	131.6	-173.8	43.7	0	0	0	0	112.4
272	Y	26.8	Very low	28.5	Very low	181 Å²	181	100.5 Å²	100.5	71%	0.71	55%	0.547	S	S	*	.			trans	-144.4	161.1	176.8	-77.5	-67.7	0	0	0	112.7	I270	I270-Y272 HydrophobicContact CG2-CD2 4Å; I270-Y272 HydrophobicContact CG2-CE2 3.44Å; I270-Y272 VanDerWaalsContact CG2-CE2 3.44Å
273	S	26.4	Very low	28.6	Very low	104 Å²	104	101 Å²	101	73%	0.727	55%	0.554	S	S	*	*			trans	-108.4	151.6	-164.4	47.8	0	0	0	0	115.5
274	R	29.4	Very low	28.8	Very low	223 Å²	223	97.4 Å²	97.4	84%	0.842	54%	0.535	S	S	*	.			trans	-34	140.6	175.3	-65.8	174.6	176.2	173.4	-3.3	115.1
275	P	28.8	Very low	28.8	Very low	79 Å²	79	98.1 Å²	98.1	51%	0.513	54%	0.539	S	S	.	.				-143.6	158.1	69.9	36	-17.5	0	0	0	117.2	V159 G160	V159-P275 HydrophobicContact CG1-CB 4.25Å; V159-P275 HydrophobicContact CG1-CG 4.2Å; V159-P275 HydrophobicContact CG2-CG 4.23Å; G160-P275 PolarHBondContact N-O 2.85Å
276	T	30.9	Very low	29.1	Very low	71 Å²	71	94.1 Å²	94.1	44%	0.436	51%	0.514	S	S	.	.			trans	-130.9	153.3	-177.7	48.7	0	0	0	0	112.3	Y226	Y226-T276 HydrophobicContact CD2-CG2 4.2Å; Y226-T276 HydrophobicContact CE2-CG2 3.83Å
277	V	29.8	Very low	29.4	Very low	61 Å²	61	94.5 Å²	94.5	37%	0.37	52%	0.523	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	133.9	172.8	-173.8	0	0	0	0	109.5	V159 F225 Y226	V159-V277 HydrophobicContact CB-CG2 4.39Å; V159-V277 HydrophobicContact CG1-CG2 3.78Å; F225-V277 HydrophobicContact CD1-CB 4.36Å; Y226-V277 PolarHBondContact N-O 3.09Å
278	Q	32.6	Very low	29.7	Very low	80 Å²	80	95.4 Å²	95.4	37%	0.374	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	131.5	179.5	-64.6	-175.2	-56.7	0	0	111	N230	N230-Q278 PolarHBondContact ND2-NE2 2.75Å
279	C	33.3	Very low	30.2	Very low	18 Å²	18	98.5 Å²	98.5	12%	0.122	52%	0.518	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	139.3	164.5	-91.2	0	0	0	0	109.3	Y226 I227 G228 F284	Y226-C279 WeakPolarHBondContact O-CA 3.5Å; Y226-C279 WeakPolarHBondContact O-CB 3.39Å; Y226-C279 PolarHBondContact O-N 3.45Å; I227-C279 WeakPolarHBondContact CA-O 3.49Å; G228-C279 PolarHBondContact N-O 2.89Å; C279-F284 HydrophobicContact CB-CE2 4.42Å
280	P	31.9	Very low	30.7	Very low	13 Å²	13	95.3 Å²	95.3	8%	0.084	50%	0.5	C	S	.	.			trans	-61	148.3	173.4	-13.7	23.7	0	0	0	112	D229 V282 C283 F326	D229-P280 WeakPolarHBondContact OD1-CB 3.41Å; P280-V282 PolarHBondContact O-N 2.89Å; P280-C283 PolarHBondContact O-N 3.49Å; P280-F326 HydrophobicContact CG-CB 3.76Å; P280-F326 HydrophobicContact CG-CD2 4.27Å; P280-F326 HydrophobicContact CG-CG 4.4Å
281	S	32.7	Very low	31.3	Very low	46 Å²	46	92.2 Å²	92.2	32%	0.322	49%	0.488	S	S	.	.	G	3₁₀ helix	trans	-60.9	-32.4	174.3	0.3	0	0	0	0	112	G228 D229 C283 F284	G228-S281 WeakPolarHBondContact CA-OG 3.32Å; D229-S281 VanDerWaalsContact CG-OG 3.25Å; D229-S281 PolarHBondContact N-OG 2.93Å; D229-S281 WeakPolarHBondContact OD2-CB 3.09Å; D229-S281 PolarHBondContact OD2-N 2.9Å; D229-S281 PolarHBondContact OD2-OG 3.06Å; S281-C283 PolarHBondContact O-N 2.87Å; S281-C283 VanDerWaalsContact O-N 3.09Å; S281-F284 CarbonylContact O-C 3.21Å; S281-F284 PolarHBondContact O-N 3.31Å
282	V	33.6	Very low	31.8	Very low	95 Å²	95	96.4 Å²	96.4	58%	0.576	49%	0.494	S	S	*	.	G	3₁₀ helix	trans	-61	-20.9	-176.6	-166.1	0	0	0	0	113.1	P280 F284	P280-V282 PolarHBondContact O-N 2.89Å; V282-F284 PolarHBondContact O-N 3.37Å
283	C	34	Very low	32.3	Very low	66 Å²	66	96.1 Å²	96.1	45%	0.446	50%	0.496	S	S	.	.	G	3₁₀ helix	trans	-69.8	-15.9	172.8	-66.1	0	0	0	0	113.8	P280 S281	P280-C283 PolarHBondContact O-N 3.49Å; S281-C283 PolarHBondContact O-N 2.87Å; S281-C283 VanDerWaalsContact O-N 3.09Å
284	F	33	Very low	32.7	Very low	25 Å²	25	94.1 Å²	94.1	11%	0.11	48%	0.477	C	S	.	.			trans	-146.1	69.5	-167.9	-60.2	-84.5	0	0	0	111.8	I227 C279 S281 V282 F286 L298 L302	I227-F284 HydrophobicContact CB-CD2 4.39Å; I227-F284 HydrophobicContact CD1-CD1 4.3Å; I227-F284 HydrophobicContact CD1-CD2 3.75Å; I227-F284 HydrophobicContact CD1-CE1 4.46Å; I227-F284 HydrophobicContact CD1-CE2 3.93Å; I227-F284 HydrophobicContact CD1-CG 3.95Å; I227-F284 HydrophobicContact CD1-CZ 4.29Å; I227-F284 HydrophobicContact CG1-CD2 3.82Å; I227-F284 HydrophobicContact CG1-CE2 3.97Å; I227-F284 HydrophobicContact CG1-CG 4.47Å; I227-F284 HydrophobicContact CG2-CB 3.83Å; I227-F284 HydrophobicContact CG2-CD2 3.68Å; I227-F284 HydrophobicContact CG2-CG 4.07Å; C279-F284 HydrophobicContact CB-CE2 4.42Å; S281-F284 CarbonylContact O-C 3.21Å; S281-F284 PolarHBondContact O-N 3.31Å; V282-F284 PolarHBondContact O-N 3.37Å; F284-F286 HydrophobicContact CB-CD2 4.1Å; F284-F286 HydrophobicContact CB-CE2 3.58Å; F284-F286 HydrophobicContact CB-CZ 4.07Å; F284-F286 HydrophobicContact CD1-CE2 4.39Å; F284-F286 HydrophobicContact CD1-CZ 4.14Å; F284-F286 HydrophobicContact CG-CE2 4.3Å; F284-F286 HydrophobicContact CG-CZ 4.49Å; F284-F286 WeakPolarHBondContact O-CD2 3.44Å; F284-F286 PolarHBondContact O-N 2.82Å; F284-L298 HydrophobicContact CD1-CD1 3.36Å; F284-L298 HydrophobicContact CE1-CD1 3.43Å; F284-L298 VanDerWaalsContact CE1-CD1 3.43Å; F284-L302 HydrophobicContact CE1-CD2 4.22Å; F284-L302 HydrophobicContact CZ-CD2 4.12Å
285	N	33.6	Very low	32.9	Very low	111 Å²	111	86 Å²	86	59%	0.594	45%	0.448	S	S	*	.			trans	-77.8	86.3	178.3	-166.1	6.4	0	0	0	111.7	N287	N285-N287 VanDerWaalsContact C-N 3.29Å; N285-N287 PolarHBondContact O-N 2.8Å
286	F	35	Very low	33.3	Very low	69 Å²	69	86 Å²	86	30%	0.303	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-4.9	-177.5	-69.3	-68.6	0	0	0	115.3	L197 F284 E288 L290	L197-F286 HydrophobicContact CD1-CD2 4.27Å; L197-F286 HydrophobicContact CD1-CE1 4.1Å; L197-F286 HydrophobicContact CD1-CE2 3.53Å; L197-F286 HydrophobicContact CD1-CZ 3.44Å; L197-F286 VanDerWaalsContact CD1-CZ 3.44Å; F284-F286 HydrophobicContact CB-CD2 4.1Å; F284-F286 HydrophobicContact CB-CE2 3.58Å; F284-F286 HydrophobicContact CB-CZ 4.07Å; F284-F286 HydrophobicContact CD1-CE2 4.39Å; F284-F286 HydrophobicContact CD1-CZ 4.14Å; F284-F286 HydrophobicContact CG-CE2 4.3Å; F284-F286 HydrophobicContact CG-CZ 4.49Å; F284-F286 WeakPolarHBondContact O-CD2 3.44Å; F284-F286 PolarHBondContact O-N 2.82Å; F286-E288 PolarHBondContact O-N 2.93Å; F286-L290 HydrophobicContact CD1-CD1 4.26Å; F286-L290 HydrophobicContact CE1-CD1 4.36Å
287	N	32.2	Very low	33.6	Very low	158 Å²	158	87.7 Å²	87.7	85%	0.845	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-13.3	176.6	-74.5	-24	0	0	0	113.3	N285	N285-N287 VanDerWaalsContact C-N 3.29Å; N285-N287 PolarHBondContact O-N 2.8Å
288	E	32.1	Very low	34.1	Very low	124 Å²	124	85.7 Å²	85.7	58%	0.579	44%	0.443	S	S	*	.	S	Bend	trans	-95.2	138.8	170.4	-69.2	-170.7	172.6	0	0	111.7	F286 L290	F286-E288 PolarHBondContact O-N 2.93Å; E288-L290 PolarHBondContact O-N 2.99Å
289	Q	33.8	Very low	34.4	Very low	179 Å²	179	86 Å²	86	84%	0.836	45%	0.447	S	S	*	.			trans	-55	123.1	177.6	-153.7	177	30.1	0	0	110.4	T291	Q289-T291 VanDerWaalsContact C-N 3.34Å; Q289-T291 WeakPolarHBondContact O-CG2 3.31Å; Q289-T291 PolarHBondContact O-N 3.38Å
290	L	33.2	Very low	34.8	Very low	65 Å²	65	90.9 Å²	90.9	34%	0.34	47%	0.468	S	S	.	.			trans	-63.3	85.2	-172.8	-96.6	163.1	0	0	0	112.8	F286 E288	F286-L290 HydrophobicContact CD1-CD1 4.26Å; F286-L290 HydrophobicContact CE1-CD1 4.36Å; E288-L290 PolarHBondContact O-N 2.99Å
291	T	33	Very low	35.1	Very low	70 Å²	70	94 Å²	94	43%	0.429	48%	0.483	S	S	.	.			trans	-72.9	152.7	174.7	71.1	0	0	0	0	111.3	Q289 K293 N294 F295	Q289-T291 VanDerWaalsContact C-N 3.34Å; Q289-T291 WeakPolarHBondContact O-CG2 3.31Å; Q289-T291 PolarHBondContact O-N 3.38Å; T291-K293 PolarHBondContact O-N 2.6Å; T291-N294 PolarHBondContact O-N 2.73Å; T291-F295 PolarHBondContact O-N 3.28Å
292	K	32.4	Very low	35.5	Very low	186 Å²	186	92.9 Å²	92.9	81%	0.809	47%	0.474	S	S	*	.	H	α-helix	trans	-56.5	-23.1	-179.7	-162.4	171.8	-173.7	171.4	0	114	S296	K292-S296 PolarHBondContact O-N 3.16Å
293	K	35.9	Very low	35.8	Very low	175 Å²	175	92.7 Å²	92.7	76%	0.761	47%	0.47	S	S	*	.	H	α-helix	trans	-76.2	-46.1	175.4	-167.4	-179.7	179.2	-172.6	0	111.3	T291 F295 S296 L297	T291-K293 PolarHBondContact O-N 2.6Å; K293-F295 VanDerWaalsContact C-N 3.32Å; K293-F295 PolarHBondContact O-N 3.22Å; K293-S296 PolarHBondContact O-N 3.43Å; K293-S296 VanDerWaalsContact O-N 3.16Å; K293-L297 PolarHBondContact O-N 3.27Å
294	N	35.6	Very low	35.9	Very low	62 Å²	62	97.5 Å²	97.5	33%	0.332	48%	0.479	S	S	.	.	H	α-helix	trans	-64.4	-38.4	176.8	-64.9	5.3	0	0	0	110.7	T291 S296 L297 L298	T291-N294 PolarHBondContact O-N 2.73Å; N294-S296 VanDerWaalsContact C-N 3.32Å; N294-S296 PolarHBondContact O-N 2.84Å; N294-L297 PolarHBondContact O-N 2.99Å; N294-L297 VanDerWaalsContact O-N 3.16Å; N294-L298 WeakPolarHBondContact O-CB 3.31Å; N294-L298 PolarHBondContact O-N 3Å
295	F	33.5	Very low	36.2	Very low	53 Å²	53	98.8 Å²	98.8	23%	0.232	49%	0.487	C	S	.	.	H	α-helix	trans	-56.8	-40.6	171.9	-179.9	-91.7	0	0	0	113.2	F178 T291 K293 L297 L298 L299	F178-F295 HydrophobicContact CE2-CD2 4.49Å; F178-F295 HydrophobicContact CE2-CE2 4.03Å; T291-F295 PolarHBondContact O-N 3.28Å; K293-F295 VanDerWaalsContact C-N 3.32Å; K293-F295 PolarHBondContact O-N 3.22Å; F295-L297 VanDerWaalsContact C-N 3.33Å; F295-L297 PolarHBondContact O-N 3.44Å; F295-L298 WeakPolarHBondContact O-CB 3.47Å; F295-L298 PolarHBondContact O-N 2.89Å; F295-L299 HydrophobicContact CZ-CD1 4.5Å; F295-L299 WeakPolarHBondContact O-CB 3.1Å; F295-L299 PolarHBondContact O-N 3.25Å
296	S	36.9	Very low	36.4	Very low	79 Å²	79	98 Å²	98	55%	0.552	48%	0.479	S	S	*	.	H	α-helix	trans	-68.5	-32.8	177.9	-168.1	0	0	0	0	112.7	K292 K293 N294 H300	K292-S296 PolarHBondContact O-N 3.16Å; K293-S296 PolarHBondContact O-N 3.43Å; K293-S296 VanDerWaalsContact O-N 3.16Å; N294-S296 VanDerWaalsContact C-N 3.32Å; N294-S296 PolarHBondContact O-N 2.84Å; S296-H300 PolarHBondContact O-N 3.45Å; S296-H300 VanDerWaalsContact O-N 3.17Å
297	L	38.4	Very low	36.5	Very low	107 Å²	107	99 Å²	99	56%	0.56	49%	0.487	S	S	*	.	H	α-helix	trans	-73.8	-43.1	176.6	-160.7	77.6	0	0	0	110.8	K293 N294 F295 L299 H300 N301	K293-L297 PolarHBondContact O-N 3.27Å; N294-L297 PolarHBondContact O-N 2.99Å; N294-L297 VanDerWaalsContact O-N 3.16Å; F295-L297 VanDerWaalsContact C-N 3.33Å; F295-L297 PolarHBondContact O-N 3.44Å; L297-L299 PolarHBondContact O-N 2.72Å; L297-H300 PolarHBondContact O-N 3.41Å; L297-N301 PolarHBondContact O-N 3.46Å
298	L	39	Very low	36.5	Very low	19 Å²	19	95.4 Å²	95.4	10%	0.099	46%	0.464	C	S	.	.	H	α-helix	trans	-53.2	-51.5	172	-176	79.2	0	0	0	111	F178 F284 N294 F295 H300 N301 L302	F178-L298 HydrophobicContact CE2-CD2 3.88Å; F178-L298 HydrophobicContact CZ-CD2 3.73Å; F284-L298 HydrophobicContact CD1-CD1 3.36Å; F284-L298 HydrophobicContact CE1-CD1 3.43Å; F284-L298 VanDerWaalsContact CE1-CD1 3.43Å; N294-L298 WeakPolarHBondContact O-CB 3.31Å; N294-L298 PolarHBondContact O-N 3Å; F295-L298 WeakPolarHBondContact O-CB 3.47Å; F295-L298 PolarHBondContact O-N 2.89Å; L298-H300 VanDerWaalsContact C-N 3.32Å; L298-H300 PolarHBondContact O-N 3.01Å; L298-N301 PolarHBondContact O-N 3.26Å; L298-L302 HydrophobicContact CG-CD1 4.2Å; L298-L302 WeakPolarHBondContact O-CB 3.17Å; L298-L302 WeakPolarHBondContact O-CG 3.5Å; L298-L302 PolarHBondContact O-N 3.43Å
299	L	39.9	Very low	36.6	Very low	85 Å²	85	92.1 Å²	92.1	45%	0.445	45%	0.454	S	S	.	.	H	α-helix	trans	-62.9	-38.6	179.5	-153.9	79.8	0	0	0	111.6	F295 L297 N303	F295-L299 HydrophobicContact CZ-CD1 4.5Å; F295-L299 WeakPolarHBondContact O-CB 3.1Å; F295-L299 PolarHBondContact O-N 3.25Å; L297-L299 PolarHBondContact O-N 2.72Å; L299-N303 VanDerWaalsContact O-CB 3.31Å; L299-N303 WeakPolarHBondContact O-CB 3.42Å; L299-N303 PolarHBondContact O-N 3.02Å
300	H	40.7	Very low	36.6	Very low	122 Å²	122	87.9 Å²	87.9	57%	0.565	44%	0.437	S	S	*	.	H	α-helix	trans	-64.6	-44.4	175.8	-171	-12.2	0	0	0	112	S296 L297 L298 N303 Y304	S296-H300 PolarHBondContact O-N 3.45Å; S296-H300 VanDerWaalsContact O-N 3.17Å; L297-H300 PolarHBondContact O-N 3.41Å; L298-H300 VanDerWaalsContact C-N 3.32Å; L298-H300 PolarHBondContact O-N 3.01Å; H300-N303 PolarHBondContact O-N 3.23Å; H300-Y304 PolarHBondContact O-N 2.86Å
301	N	38.9	Very low	36.6	Very low	78 Å²	78	88.2 Å²	88.2	42%	0.417	45%	0.449	S	S	.	.	H	α-helix	trans	-65.4	-43.3	178.9	-71.4	-10.5	0	0	0	111.6	L297 L298 N303 Y304 L305	L297-N301 PolarHBondContact O-N 3.46Å; L298-N301 PolarHBondContact O-N 3.26Å; N301-N303 VanDerWaalsContact C-N 3.33Å; N301-N303 PolarHBondContact O-N 3.23Å; N301-Y304 PolarHBondContact O-N 3.23Å; N301-L305 WeakPolarHBondContact O-CB 3.42Å; N301-L305 PolarHBondContact O-N 2.96Å
302	L	41	Very low	36.5	Very low	23 Å²	23	92.8 Å²	92.8	12%	0.12	46%	0.46	C	S	.	.	H	α-helix	trans	-61.6	-41.2	174.5	-70.5	174.6	0	0	0	111.7	L247 F284 L298 Y304 L305 F306	L247-L302 HydrophobicContact CD2-CD2 3.52Å; F284-L302 HydrophobicContact CE1-CD2 4.22Å; F284-L302 HydrophobicContact CZ-CD2 4.12Å; L298-L302 HydrophobicContact CG-CD1 4.2Å; L298-L302 WeakPolarHBondContact O-CB 3.17Å; L298-L302 WeakPolarHBondContact O-CG 3.5Å; L298-L302 PolarHBondContact O-N 3.43Å; L302-Y304 VanDerWaalsContact C-N 3.34Å; L302-L305 PolarHBondContact O-N 3.16Å; L302-F306 VanDerWaalsContact O-CB 3.24Å; L302-F306 WeakPolarHBondContact O-CB 3.47Å; L302-F306 PolarHBondContact O-N 2.76Å
303	N	39.2	Very low	36.5	Very low	91 Å²	91	92 Å²	92	49%	0.487	46%	0.459	S	S	.	.	H	α-helix	trans	-68.7	-33.5	177.2	-146.1	-6.7	0	0	0	111.7	L299 H300 N301 N307	L299-N303 VanDerWaalsContact O-CB 3.31Å; L299-N303 WeakPolarHBondContact O-CB 3.42Å; L299-N303 PolarHBondContact O-N 3.02Å; H300-N303 PolarHBondContact O-N 3.23Å; N301-N303 VanDerWaalsContact C-N 3.33Å; N301-N303 PolarHBondContact O-N 3.23Å; N303-N307 WeakPolarHBondContact O-CB 3.32Å; N303-N307 PolarHBondContact O-N 2.87Å; N303-N307 PolarHBondContact O-ND2 3.48Å; N303-N307 PolarHBondContact OD1-ND2 2.9Å
304	Y	37.2	Very low	36.2	Very low	166 Å²	166	87.6 Å²	87.6	65%	0.651	44%	0.443	S	S	*	.	H	α-helix	trans	-68	-45.1	173.4	-163	-86.3	0	0	0	111.6	H300 N301 L302 F306 N307 F308	H300-Y304 PolarHBondContact O-N 2.86Å; N301-Y304 PolarHBondContact O-N 3.23Å; L302-Y304 VanDerWaalsContact C-N 3.34Å; Y304-F306 VanDerWaalsContact C-N 3.34Å; Y304-F306 PolarHBondContact O-N 3.06Å; Y304-N307 PolarHBondContact O-N 3.41Å; Y304-F308 WeakPolarHBondContact O-CB 3.46Å; Y304-F308 PolarHBondContact O-N 3.08Å
305	L	37.6	Very low	35.8	Very low	52 Å²	52	91 Å²	91	27%	0.272	46%	0.461	S	S	.	.	H	α-helix	trans	-60.5	-43.2	174.6	-172	72.2	0	0	0	111.5	N301 L302 F308 C309	N301-L305 WeakPolarHBondContact O-CB 3.42Å; N301-L305 PolarHBondContact O-N 2.96Å; L302-L305 PolarHBondContact O-N 3.16Å; L305-F308 PolarHBondContact O-N 3.13Å; L305-C309 WeakPolarHBondContact O-CB 3.5Å; L305-C309 PolarHBondContact O-N 3.48Å; L305-C309 PolarHBondContact O-SG 3.43Å; L305-C309 VanDerWaalsContact O-SG 3.34Å
306	F	38.3	Very low	35.5	Very low	95 Å²	95	92 Å²	92	42%	0.417	49%	0.486	S	S	.	.	H	α-helix	trans	-59.5	-48.2	176.2	-175.6	-103.2	0	0	0	111.7	L302 Y304 L310	L302-F306 VanDerWaalsContact O-CB 3.24Å; L302-F306 WeakPolarHBondContact O-CB 3.47Å; L302-F306 PolarHBondContact O-N 2.76Å; Y304-F306 VanDerWaalsContact C-N 3.34Å; Y304-F306 PolarHBondContact O-N 3.06Å; F306-L310 HydrophobicContact CD1-CD1 3.7Å; F306-L310 HydrophobicContact CE1-CD1 3.42Å; F306-L310 VanDerWaalsContact CE1-CD1 3.42Å; F306-L310 HydrophobicContact CG-CD1 4.4Å; F306-L310 HydrophobicContact CZ-CD1 3.91Å; F306-L310 WeakPolarHBondContact O-CB 3.4Å; F306-L310 WeakPolarHBondContact O-CG 3.43Å; F306-L310 PolarHBondContact O-N 2.67Å
307	N	36.9	Very low	34.9	Very low	90 Å²	90	93.1 Å²	93.1	48%	0.481	49%	0.485	S	S	.	.	H	α-helix	trans	-66.1	-36.3	175.7	-75.4	-60.2	0	0	0	112.8	N303 Y304 L310 A311	N303-N307 WeakPolarHBondContact O-CB 3.32Å; N303-N307 PolarHBondContact O-N 2.87Å; N303-N307 PolarHBondContact O-ND2 3.48Å; N303-N307 PolarHBondContact OD1-ND2 2.9Å; Y304-N307 PolarHBondContact O-N 3.41Å; N307-L310 PolarHBondContact O-N 3.37Å; N307-A311 VanDerWaalsContact O-CB 3.27Å; N307-A311 WeakPolarHBondContact O-CB 3.31Å; N307-A311 PolarHBondContact O-N 2.97Å
308	F	33.6	Very low	34.4	Very low	83 Å²	83	94.7 Å²	94.7	36%	0.364	49%	0.494	S	S	.	.	H	α-helix	trans	-64.4	-47.6	176.2	-178	-94.4	0	0	0	111.9	Y304 L305 L310 A311 Y312 I314	Y304-F308 WeakPolarHBondContact O-CB 3.46Å; Y304-F308 PolarHBondContact O-N 3.08Å; L305-F308 PolarHBondContact O-N 3.13Å; F308-L310 VanDerWaalsContact C-N 3.34Å; F308-L310 PolarHBondContact O-N 2.82Å; F308-A311 PolarHBondContact O-N 3.08Å; F308-Y312 HydrophobicContact CD2-CD2 4.12Å; F308-Y312 HydrophobicContact CD2-CE2 4.45Å; F308-Y312 AromaticContact CE2-CD2 3.93Å; F308-Y312 HydrophobicContact CE2-CD2 3.93Å; F308-Y312 HydrophobicContact CE2-CE2 4.16Å; F308-Y312 HydrophobicContact CZ-CD2 4.37Å; F308-Y312 PolarHBondContact O-N 3.31Å; F308-I314 HydrophobicContact CE1-CD1 4.35Å
309	C	33.8	Very low	34	Very low	55 Å²	55	102.3 Å²	102.3	37%	0.372	53%	0.529	S	S	.	.	H	α-helix	trans	-63	-38.3	175.8	-70.3	0	0	0	0	112.4	L305	L305-C309 WeakPolarHBondContact O-CB 3.5Å; L305-C309 PolarHBondContact O-N 3.48Å; L305-C309 PolarHBondContact O-SG 3.43Å; L305-C309 VanDerWaalsContact O-SG 3.34Å
310	L	34.3	Very low	33.3	Very low	90 Å²	90	104 Å²	104	47%	0.471	53%	0.534	S	S	.	.	H	α-helix	trans	-65.5	-41.5	173.6	-82.1	168.1	0	0	0	112.7	F306 N307 F308	F306-L310 HydrophobicContact CD1-CD1 3.7Å; F306-L310 HydrophobicContact CE1-CD1 3.42Å; F306-L310 VanDerWaalsContact CE1-CD1 3.42Å; F306-L310 HydrophobicContact CG-CD1 4.4Å; F306-L310 HydrophobicContact CZ-CD1 3.91Å; F306-L310 WeakPolarHBondContact O-CB 3.4Å; F306-L310 WeakPolarHBondContact O-CG 3.43Å; F306-L310 PolarHBondContact O-N 2.67Å; N307-L310 PolarHBondContact O-N 3.37Å; F308-L310 VanDerWaalsContact C-N 3.34Å; F308-L310 PolarHBondContact O-N 2.82Å
311	A	31.9	Very low	32.6	Very low	72 Å²	72	108.6 Å²	108.6	60%	0.595	55%	0.552	S	S	*	*	H	α-helix	trans	-70.1	-38.3	-175.2	0	0	0	0	0	113.4	N307 F308	N307-A311 VanDerWaalsContact O-CB 3.27Å; N307-A311 WeakPolarHBondContact O-CB 3.31Å; N307-A311 PolarHBondContact O-N 2.97Å; F308-A311 PolarHBondContact O-N 3.08Å
312	Y	31.6	Very low	31.9	Very low	166 Å²	166	110.9 Å²	110.9	65%	0.651	56%	0.561	S	S	*	*	S	Bend	trans	-99.9	5.4	-165	-88.1	-77.3	0	0	0	117	F308 I314	F308-Y312 HydrophobicContact CD2-CD2 4.12Å; F308-Y312 HydrophobicContact CD2-CE2 4.45Å; F308-Y312 AromaticContact CE2-CD2 3.93Å; F308-Y312 HydrophobicContact CE2-CD2 3.93Å; F308-Y312 HydrophobicContact CE2-CE2 4.16Å; F308-Y312 HydrophobicContact CZ-CD2 4.37Å; F308-Y312 PolarHBondContact O-N 3.31Å; Y312-I314 VanDerWaalsContact C-N 3.3Å; Y312-I314 PolarHBondContact O-N 2.87Å
313	Q	33.2	Very low	31.3	Very low	170 Å²	170	113.7 Å²	113.7	79%	0.794	58%	0.578	S	S	*	*			trans	36.6	55.9	172.7	-68.2	-167.5	-13.9	0	0	113.8	N315	Q313-N315 VanDerWaalsContact C-N 3.28Å; Q313-N315 PolarHBondContact O-N 3.42Å
314	I	27.9	Very low	30.6	Very low	81 Å²	81	114.2 Å²	114.2	42%	0.415	58%	0.58	S	S	.	*			trans	-73.4	75.5	-162.7	-48.3	176.7	0	0	0	112.3	F308 Y312 L317	F308-I314 HydrophobicContact CE1-CD1 4.35Å; Y312-I314 VanDerWaalsContact C-N 3.3Å; Y312-I314 PolarHBondContact O-N 2.87Å; I314-L317 HydrophobicContact CG2-CD1 4.1Å
315	N	29	Very low	30	Very low	134 Å²	134	112.8 Å²	112.8	72%	0.717	58%	0.579	S	S	*	*			trans	-107.5	-8.8	166.2	-77.4	-21.4	0	0	0	112.2	Q313	Q313-N315 VanDerWaalsContact C-N 3.28Å; Q313-N315 PolarHBondContact O-N 3.42Å
316	G	25.4	Very low	29.4	Very low	73 Å²	73	117.1 Å²	117.1	75%	0.753	60%	0.596	S	S	*	*			trans	-85	-19.2	-170.6	0	0	0	0	0	116.8	L318	G316-L318 PolarHBondContact O-N 3.46Å
317	L	26.1	Very low	28.7	Very low	104 Å²	104	121.6 Å²	121.6	55%	0.545	62%	0.615	S	S	.	*	G	3₁₀ helix	trans	-78.4	16.4	-173.7	-84.6	166.8	0	0	0	114.8	I314 Q319	I314-L317 HydrophobicContact CG2-CD1 4.1Å; L317-Q319 PolarHBondContact O-N 2.97Å; L317-Q319 VanDerWaalsContact O-N 3.11Å
318	L	28	Very low	28.2	Very low	140 Å²	140	123.6 Å²	123.6	73%	0.733	62%	0.622	S	S	*	*	G	3₁₀ helix	trans	-66	-9.9	-175.4	-90.2	166.1	0	0	0	115.8	G316	G316-L318 PolarHBondContact O-N 3.46Å
319	Q	28.9	Very low	27.7	Very low	179 Å²	179	124.6 Å²	124.6	84%	0.836	63%	0.631	S	S	*	*	G	3₁₀ helix	trans	-116.6	-9.2	-176.7	-72.4	-168.7	-13.5	0	0	116.5	L317	L317-Q319 PolarHBondContact O-N 2.97Å; L317-Q319 VanDerWaalsContact O-N 3.11Å
320	H	25.6	Very low	27.3	Very low	121 Å²	121	128.2 Å²	128.2	56%	0.56	65%	0.645	S	S	*	*			trans	-124.6	116.9	174.4	-72.1	-64.9	0	0	0	111.2	E322	H320-E322 HydrophobicContact CB-CG 4.39Å; H320-E322 PolarHBondContact O-N 3.16Å
321	K	26.9	Very low	26.8	Very low	218 Å²	218	132.2 Å²	132.2	95%	0.948	66%	0.659	S	S	*	*			trans	-72.5	48.4	174.2	-70.5	-178.3	174	176	0	112	V323	K321-V323 PolarHBondContact O-N 3.49Å
322	E	23.9	Very low	26.4	Very low	126 Å²	126	139.3 Å²	139.3	59%	0.589	67%	0.67	S	S	*	*			trans	-87.9	99.6	175.8	-69.8	-169	155.1	0	0	109.4	H320 I324 L345	H320-E322 HydrophobicContact CB-CG 4.39Å; H320-E322 PolarHBondContact O-N 3.16Å; E322-I324 PolarHBondContact O-N 3.44Å; E322-L345 VanDerWaalsContact OE2-CD1 3.23Å; E322-L345 WeakPolarHBondContact OE2-CD1 3.17Å
323	V	27.6	Very low	26.1	Very low	81 Å²	81	138.7 Å²	138.7	49%	0.491	68%	0.678	S	S	.	*			trans	-65.4	125.3	171.5	177.4	0	0	0	0	108.3	K321 H325	K321-V323 PolarHBondContact O-N 3.49Å; V323-H325 VanDerWaalsContact C-N 3.31Å; V323-H325 PolarHBondContact O-CD2 3.37Å; V323-H325 PolarHBondContact O-N 3.47Å
324	I	25.4	Very low	25.8	Very low	102 Å²	102	138.3 Å²	138.3	52%	0.523	68%	0.676	S	S	.	*			trans	-73.9	86.1	179.5	-53.8	176.8	0	0	0	109	E322 F326	E322-I324 PolarHBondContact O-N 3.44Å; I324-F326 HydrophobicContact CB-CE2 4.48Å; I324-F326 HydrophobicContact CG2-CD2 3.95Å; I324-F326 HydrophobicContact CG2-CE2 3.54Å; I324-F326 HydrophobicContact CG2-CZ 4.09Å; I324-F326 PolarHBondContact O-N 3.28Å; I324-F326 VanDerWaalsContact O-N 3.14Å
325	H	24.3	Very low	25.7	Very low	137 Å²	137	141.2 Å²	141.2	63%	0.634	69%	0.693	S	S	*	*			trans	-75.6	97	173.5	-76.5	-76.4	0	0	0	110.8	V323 K327	V323-H325 VanDerWaalsContact C-N 3.31Å; V323-H325 PolarHBondContact O-CD2 3.37Å; V323-H325 PolarHBondContact O-N 3.47Å; H325-K327 PolarHBondContact O-N 3.01Å
326	F	24.6	Very low	25.5	Very low	143 Å²	143	139.7 Å²	139.7	63%	0.627	69%	0.691	S	S	*	*			trans	-70.5	108.8	159.8	-69.3	-90.5	0	0	0	108.5	P280 I324	P280-F326 HydrophobicContact CG-CB 3.76Å; P280-F326 HydrophobicContact CG-CD2 4.27Å; P280-F326 HydrophobicContact CG-CG 4.4Å; I324-F326 HydrophobicContact CB-CE2 4.48Å; I324-F326 HydrophobicContact CG2-CD2 3.95Å; I324-F326 HydrophobicContact CG2-CE2 3.54Å; I324-F326 HydrophobicContact CG2-CZ 4.09Å; I324-F326 PolarHBondContact O-N 3.28Å; I324-F326 VanDerWaalsContact O-N 3.14Å
327	K	23.7	Very low	25.5	Very low	189 Å²	189	141.6 Å²	141.6	82%	0.822	69%	0.689	S	S	*	*			trans	-82.3	145	171.1	-106.7	-172.9	172.2	-170.7	0	110.4	H325 N329	H325-K327 PolarHBondContact O-N 3.01Å; K327-N329 PolarHBondContact O-N 3.02Å
328	E	26.1	Very low	25.6	Very low	132 Å²	132	142.6 Å²	142.6	62%	0.617	69%	0.694	S	S	*	*			trans	-45	128	170.8	-69.5	170.3	107.7	0	0	111.9
329	N	23.9	Very low	25.7	Very low	104 Å²	104	138.5 Å²	138.5	56%	0.556	68%	0.677	S	S	*	*				-116.9	119.9	128.6	-88.8	-19.2	0	0	0	105.7	K327 F331	K327-N329 PolarHBondContact O-N 3.02Å; N329-F331 VanDerWaalsContact O-CD2 3.26Å; N329-F331 WeakPolarHBondContact O-CD2 3.4Å; N329-F331 PolarHBondContact O-N 3.01Å
330	I	24.4	Very low	25.8	Very low	130 Å²	130	132.9 Å²	132.9	67%	0.667	65%	0.651	S	S	*	*			trans	-64.8	108	178.8	-65.9	170	0	0	0	106.8	R332	I330-R332 HydrophobicContact CG2-CG 4.29Å; I330-R332 PolarHBondContact O-N 2.78Å
331	F	25.1	Very low	26.2	Very low	174 Å²	174	130.9 Å²	130.9	76%	0.763	65%	0.651	S	S	*	*			trans	-70.6	58.3	-177.5	-79.2	-87.5	0	0	0	112.7	N329 N333	N329-F331 VanDerWaalsContact O-CD2 3.26Å; N329-F331 WeakPolarHBondContact O-CD2 3.4Å; N329-F331 PolarHBondContact O-N 3.01Å; F331-N333 PolarHBondContact O-N 3.42Å
332	R	23.3	Very low	26.5	Very low	221 Å²	221	124.6 Å²	124.6	83%	0.834	62%	0.623	S	S	*	*	S	Bend	trans	-77.8	108.2	153.9	-77.2	-175.8	174.2	-170.5	-0.5	106.7	I330	I330-R332 HydrophobicContact CG2-CG 4.29Å; I330-R332 PolarHBondContact O-N 2.78Å
333	N	25.6	Very low	26.9	Very low	153 Å²	153	122.9 Å²	122.9	82%	0.818	62%	0.616	S	S	*	*	S	Bend	trans	5	113.6	171.3	-60.3	-27	0	0	0	116.4	F331	F331-N333 PolarHBondContact O-N 3.42Å
334	Q	25.4	Very low	27.1	Very low	162 Å²	162	126.3 Å²	126.3	76%	0.757	62%	0.619	S	S	*	*	S	Bend	trans	110.3	145.1	172.8	-61	163.4	-5.4	0	0	114.5
335	D	26.9	Very low	27.6	Very low	142 Å²	142	124.6 Å²	124.6	76%	0.759	61%	0.611	S	S	*	*			trans	63.3	94.6	164.6	-53	-20.7	0	0	0	120.9
336	C	24.7	Very low	28	Very low	102 Å²	102	121.5 Å²	121.5	69%	0.689	60%	0.599	S	S	*	*			trans	-87.1	109	166.3	-64.5	0	0	0	0	111.6
337	T	25.9	Very low	28.3	Very low	114 Å²	114	117.3 Å²	117.3	70%	0.699	59%	0.587	S	S	*	*			trans	-116.2	135.6	164.5	49.8	0	0	0	0	111.3
338	L	26.7	Very low	28.7	Very low	124 Å²	124	113 Å²	113	65%	0.649	57%	0.573	S	S	*	*			trans	-77.2	132	-179.3	-78.7	162.6	0	0	0	110.9	F342 Q343	L338-F342 HydrophobicContact CD2-CD1 4.14Å; L338-F342 HydrophobicContact CD2-CE1 4.47Å; L338-Q343 PolarHBondContact O-NE2 3.13Å
339	S	31.5	Very low	28.9	Very low	55 Å²	55	111.7 Å²	111.7	39%	0.385	57%	0.57	S	S	.	*			trans	-63.4	144.5	-175	64	0	0	0	0	113.5	S341 F342 Q343	S339-S341 PolarHBondContact O-N 3.03Å; S339-S341 PolarHBondContact OG-OG 2.89Å; S339-F342 WeakPolarHBondContact O-CB 3.39Å; S339-F342 PolarHBondContact O-N 2.93Å; S339-Q343 PolarHBondContact O-N 2.79Å; S339-Q343 VanDerWaalsContact O-N 3.09Å
340	E	30.4	Very low	29	Very low	61 Å²	61	113.5 Å²	113.5	29%	0.285	57%	0.573	S	S	.	*	H	α-helix	trans	-61.6	-28	-177.4	-161.2	-173.4	169.3	0	0	112.8	Q343 R344 L454	E340-Q343 PolarHBondContact O-N 2.75Å; E340-R344 PolarHBondContact O-N 3.5Å; E340-L454 HydrophobicContact CG-CB 4.33Å; E340-L454 WeakPolarHBondContact OE1-CB 3.37Å
341	S	33.6	Very low	29.1	Very low	79 Å²	79	112.2 Å²	112.2	55%	0.552	57%	0.567	S	S	*	*	H	α-helix	trans	-65.9	-38.2	172.3	46	0	0	0	0	112.6	S339 R344 L345	S339-S341 PolarHBondContact O-N 3.03Å; S339-S341 PolarHBondContact OG-OG 2.89Å; S341-R344 PolarHBondContact O-N 3.3Å; S341-L345 PolarHBondContact O-N 2.83Å
342	F	33.6	Very low	29.2	Very low	85 Å²	85	110.8 Å²	110.8	37%	0.373	56%	0.562	S	S	.	*	H	α-helix	trans	-71.3	-36.3	173.8	-167.3	-105.2	0	0	0	111.6	L338 S339 L345 L346	L338-F342 HydrophobicContact CD2-CD1 4.14Å; L338-F342 HydrophobicContact CD2-CE1 4.47Å; S339-F342 WeakPolarHBondContact O-CB 3.39Å; S339-F342 PolarHBondContact O-N 2.93Å; F342-L345 HydrophobicContact CD2-CD2 4.46Å; F342-L345 PolarHBondContact O-N 3.18Å; F342-L346 HydrophobicContact CD1-CD1 3.78Å; F342-L346 HydrophobicContact CE1-CD1 3.6Å; F342-L346 HydrophobicContact CE1-CG 4.29Å; F342-L346 HydrophobicContact CZ-CD1 4.41Å; F342-L346 WeakPolarHBondContact O-CB 3.3Å; F342-L346 PolarHBondContact O-N 2.74Å
343	Q	32.8	Very low	29.3	Very low	91 Å²	91	101.6 Å²	101.6	43%	0.425	53%	0.532	S	S	.	.	H	α-helix	trans	-62.6	-40.1	171.4	-62	-176.6	14.5	0	0	112	L338 S339 E340 S347	L338-Q343 PolarHBondContact O-NE2 3.13Å; S339-Q343 PolarHBondContact O-N 2.79Å; S339-Q343 VanDerWaalsContact O-N 3.09Å; E340-Q343 PolarHBondContact O-N 2.75Å; Q343-S347 WeakPolarHBondContact O-CB 3.41Å; Q343-S347 PolarHBondContact O-N 3.1Å
344	R	32.3	Very low	29.2	Very low	152 Å²	152	102.8 Å²	102.8	57%	0.574	53%	0.525	S	S	*	.	H	α-helix	trans	-67.3	-38.9	173.3	-87.1	-174.9	174.2	167.3	4.1	113.2	E340 S341 S347 N348	E340-R344 PolarHBondContact O-N 3.5Å; S341-R344 PolarHBondContact O-N 3.3Å; R344-S347 WeakPolarHBondContact O-CB 3.33Å; R344-S347 PolarHBondContact O-N 2.83Å; R344-N348 WeakPolarHBondContact O-CB 3.42Å; R344-N348 PolarHBondContact O-N 3.23Å
345	L	34.6	Very low	29.2	Very low	66 Å²	66	102.8 Å²	102.8	35%	0.346	53%	0.53	S	S	.	.	H	α-helix	trans	-60.5	-49	174.4	-168.6	85	0	0	0	110.7	E322 S341 F342 S347 N348 L349	E322-L345 VanDerWaalsContact OE2-CD1 3.23Å; E322-L345 WeakPolarHBondContact OE2-CD1 3.17Å; S341-L345 PolarHBondContact O-N 2.83Å; F342-L345 HydrophobicContact CD2-CD2 4.46Å; F342-L345 PolarHBondContact O-N 3.18Å; L345-S347 PolarHBondContact O-N 2.66Å; L345-N348 PolarHBondContact O-N 3.45Å; L345-L349 HydrophobicContact CD2-CD1 4.43Å; L345-L349 HydrophobicContact CG-CD1 4.17Å; L345-L349 WeakPolarHBondContact O-CG 3.27Å; L345-L349 PolarHBondContact O-N 3.39Å
346	L	32.8	Very low	29.1	Very low	73 Å²	73	101.5 Å²	101.5	38%	0.382	52%	0.522	S	S	.	.	H	α-helix	trans	-57.6	-48.5	173.7	-82.9	164.3	0	0	0	111.5	F342 N348 L349 F350	F342-L346 HydrophobicContact CD1-CD1 3.78Å; F342-L346 HydrophobicContact CE1-CD1 3.6Å; F342-L346 HydrophobicContact CE1-CG 4.29Å; F342-L346 HydrophobicContact CZ-CD1 4.41Å; F342-L346 WeakPolarHBondContact O-CB 3.3Å; F342-L346 PolarHBondContact O-N 2.74Å; L346-N348 VanDerWaalsContact C-N 3.34Å; L346-N348 PolarHBondContact O-N 3.45Å; L346-L349 PolarHBondContact O-N 2.77Å; L346-F350 HydrophobicContact CD2-CE2 4.37Å; L346-F350 WeakPolarHBondContact O-CB 3.49Å; L346-F350 WeakPolarHBondContact O-CD2 3.28Å; L346-F350 PolarHBondContact O-N 3.39Å
347	S	31.6	Very low	29	Very low	55 Å²	55	103.5 Å²	103.5	39%	0.385	53%	0.526	S	S	.	.	H	α-helix	trans	-54.7	-47.1	176	176.2	0	0	0	0	112.2	Q343 R344 L345 F350 I351	Q343-S347 WeakPolarHBondContact O-CB 3.41Å; Q343-S347 PolarHBondContact O-N 3.1Å; R344-S347 WeakPolarHBondContact O-CB 3.33Å; R344-S347 PolarHBondContact O-N 2.83Å; L345-S347 PolarHBondContact O-N 2.66Å; S347-F350 PolarHBondContact O-N 2.9Å; S347-I351 WeakPolarHBondContact O-CD1 3.47Å; S347-I351 VanDerWaalsContact O-CG1 3.25Å; S347-I351 WeakPolarHBondContact O-CG1 3.25Å; S347-I351 PolarHBondContact O-N 2.86Å
348	N	31.7	Very low	28.9	Very low	98 Å²	98	103.6 Å²	103.6	52%	0.524	52%	0.517	S	S	.	.	H	α-helix	trans	-69	-38.8	-178.6	-73.5	-10.3	0	0	0	112.3	R344 L345 L346 I351 Q352	R344-N348 WeakPolarHBondContact O-CB 3.42Å; R344-N348 PolarHBondContact O-N 3.23Å; L345-N348 PolarHBondContact O-N 3.45Å; L346-N348 VanDerWaalsContact C-N 3.34Å; L346-N348 PolarHBondContact O-N 3.45Å; N348-I351 PolarHBondContact O-N 3.38Å; N348-Q352 PolarHBondContact O-N 2.81Å
349	L	30.1	Very low	28.8	Very low	104 Å²	104	106.9 Å²	106.9	55%	0.545	53%	0.526	S	S	.	.	H	α-helix	trans	-63.9	-39	172.5	-76.1	164.3	0	0	0	112.1	L345 L346 I351 S353	L345-L349 HydrophobicContact CD2-CD1 4.43Å; L345-L349 HydrophobicContact CG-CD1 4.17Å; L345-L349 WeakPolarHBondContact O-CG 3.27Å; L345-L349 PolarHBondContact O-N 3.39Å; L346-L349 PolarHBondContact O-N 2.77Å; L349-I351 VanDerWaalsContact C-N 3.34Å; L349-S353 WeakPolarHBondContact O-CB 3Å; L349-S353 PolarHBondContact O-N 3.22Å; L349-S353 PolarHBondContact O-OG 2.88Å
350	F	26.7	Very low	28.6	Very low	143 Å²	143	109 Å²	109	63%	0.627	54%	0.54	S	S	*	.	H	α-helix	trans	-69.5	-26.8	173.3	-90.6	-70.4	0	0	0	113.6	L346 S347 S353	L346-F350 HydrophobicContact CD2-CE2 4.37Å; L346-F350 WeakPolarHBondContact O-CB 3.49Å; L346-F350 WeakPolarHBondContact O-CD2 3.28Å; L346-F350 PolarHBondContact O-N 3.39Å; S347-F350 PolarHBondContact O-N 2.9Å; F350-S353 WeakPolarHBondContact CA-OG 2.81Å; F350-S353 PolarHBondContact O-OG 2.77Å
351	I	26.4	Very low	28.3	Very low	103 Å²	103	113.3 Å²	113.3	53%	0.528	56%	0.555	S	S	.	*	H	α-helix	trans	-79.7	-45.4	176	-70.3	163.9	0	0	0	111.1	S347 N348 L349 S353 R354	S347-I351 WeakPolarHBondContact O-CD1 3.47Å; S347-I351 VanDerWaalsContact O-CG1 3.25Å; S347-I351 WeakPolarHBondContact O-CG1 3.25Å; S347-I351 PolarHBondContact O-N 2.86Å; N348-I351 PolarHBondContact O-N 3.38Å; L349-I351 VanDerWaalsContact C-N 3.34Å; I351-S353 VanDerWaalsContact C-N 3.32Å; I351-S353 PolarHBondContact O-N 3.32Å; I351-R354 PolarHBondContact O-N 3.16Å
352	Q	26.3	Very low	27.9	Very low	143 Å²	143	117.7 Å²	117.7	67%	0.668	57%	0.567	S	S	*	*	H	α-helix	trans	-67.8	-30.3	179.9	-75	-171.7	-13.1	0	0	113.3	N348 R354	N348-Q352 PolarHBondContact O-N 2.81Å; Q352-R354 VanDerWaalsContact C-N 3.29Å; Q352-R354 PolarHBondContact O-N 2.67Å
353	S	25.6	Very low	27.5	Very low	29 Å²	29	124.3 Å²	124.3	20%	0.203	59%	0.591	C	S	.	*	G	3₁₀ helix	trans	-70.6	-18.3	178.3	48.9	0	0	0	0	114.3	L349 F350 I351 N355 I356 F358	L349-S353 WeakPolarHBondContact O-CB 3Å; L349-S353 PolarHBondContact O-N 3.22Å; L349-S353 PolarHBondContact O-OG 2.88Å; F350-S353 WeakPolarHBondContact CA-OG 2.81Å; F350-S353 PolarHBondContact O-OG 2.77Å; I351-S353 VanDerWaalsContact C-N 3.32Å; I351-S353 PolarHBondContact O-N 3.32Å; S353-N355 PolarHBondContact O-N 3.1Å; S353-N355 VanDerWaalsContact O-N 3.1Å; S353-I356 WeakPolarHBondContact O-CB 3.44Å; S353-I356 PolarHBondContact O-N 3.01Å; S353-F358 VanDerWaalsContact O-CE2 3.23Å; S353-F358 WeakPolarHBondContact O-CE2 3.43Å
354	R	23.6	Very low	27.1	Very low	177 Å²	177	122 Å²	122	67%	0.668	59%	0.588	S	S	*	*	G	3₁₀ helix	trans	-61.8	-18.7	-177.6	-81.4	-175.9	173.7	-171.7	-1.8	116	I351 Q352	I351-R354 PolarHBondContact O-N 3.16Å; Q352-R354 VanDerWaalsContact C-N 3.29Å; Q352-R354 PolarHBondContact O-N 2.67Å
355	N	25.6	Very low	26.7	Very low	162 Å²	162	122.4 Å²	122.4	87%	0.866	60%	0.596	S	S	*	*	G	3₁₀ helix	trans	-89.9	-1.8	174.8	-78.2	-10.2	0	0	0	113.7	S353	S353-N355 PolarHBondContact O-N 3.1Å; S353-N355 VanDerWaalsContact O-N 3.1Å
356	I	23.7	Very low	26.2	Very low	115 Å²	115	126.9 Å²	126.9	59%	0.59	62%	0.62	S	S	*	*	S	Bend	trans	-86.7	126	171.5	-56.6	179.4	0	0	0	107.7	S353 F358	S353-I356 WeakPolarHBondContact O-CB 3.44Å; S353-I356 PolarHBondContact O-N 3.01Å; I356-F358 VanDerWaalsContact C-N 3.34Å; I356-F358 WeakPolarHBondContact O-CD2 3.29Å; I356-F358 PolarHBondContact O-N 2.79Å
357	N	23.7	Very low	25.8	Very low	144 Å²	144	131.9 Å²	131.9	77%	0.77	64%	0.639	S	S	*	*			trans	-73.8	82.3	-168.9	-156.6	-15.4	0	0	0	111.2	K359	N357-K359 PolarHBondContact O-N 2.92Å
358	F	23.6	Very low	25.3	Very low	116 Å²	116	135.3 Å²	135.3	51%	0.509	65%	0.652	S	S	.	*			trans	-66.4	81.3	-175.2	-75.2	-76.4	0	0	0	113.2	S353 I356 Y361	S353-F358 VanDerWaalsContact O-CE2 3.23Å; S353-F358 WeakPolarHBondContact O-CE2 3.43Å; I356-F358 VanDerWaalsContact C-N 3.34Å; I356-F358 WeakPolarHBondContact O-CD2 3.29Å; I356-F358 PolarHBondContact O-N 2.79Å; F358-Y361 HydrophobicContact CD1-CD2 4.17Å; F358-Y361 HydrophobicContact CD1-CG 4.39Å; F358-Y361 HydrophobicContact CE1-CD2 4.37Å
359	K	25.7	Very low	24.8	Very low	194 Å²	194	139.6 Å²	139.6	84%	0.843	67%	0.669	S	S	*	*	S	Bend	trans	-102.2	-3.6	167	-83.7	-168.7	172.6	-175.2	0	115.1	N357	N357-K359 PolarHBondContact O-N 2.92Å
360	S	26.6	Very low	24.4	Very low	98 Å²	98	143.1 Å²	143.1	69%	0.685	68%	0.68	S	S	*	*	S	Bend	trans	-108.1	-2.4	-177.2	48.2	0	0	0	0	115.2
361	Y	23.9	Very low	24.2	Very low	152 Å²	152	141.3 Å²	141.3	60%	0.596	68%	0.683	S	S	*	*			trans	-110.6	12.2	-170.8	-95.2	-83	0	0	0	116.4	F358 Y363 A364	F358-Y361 HydrophobicContact CD1-CD2 4.17Å; F358-Y361 HydrophobicContact CD1-CG 4.39Å; F358-Y361 HydrophobicContact CE1-CD2 4.37Å; Y361-Y363 PolarHBondContact O-N 2.78Å; Y361-A364 HydrophobicContact CD1-CB 3.96Å; Y361-A364 PolarHBondContact O-N 2.87Å
362	Q	24.8	Very low	24	Very low	172 Å²	172	144.9 Å²	144.9	80%	0.804	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	13.9	174.6	-152.7	169.7	8.2	0	0	114.1
363	Y	24.7	Very low	23.9	Very low	223 Å²	223	145.5 Å²	145.5	88%	0.875	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.1	6.5	174	-80	-69.4	0	0	0	113.7	Y361	Y361-Y363 PolarHBondContact O-N 2.78Å
364	A	24.9	Very low	23.7	Very low	43 Å²	43	149.2 Å²	149.2	36%	0.355	73%	0.727	S	S	.	*	S	Bend	trans	-114.4	-9.5	-177.5	0	0	0	0	0	115.2	Y361 D366 F367	Y361-A364 HydrophobicContact CD1-CB 3.96Å; Y361-A364 PolarHBondContact O-N 2.87Å; A364-D366 VanDerWaalsContact C-N 3.28Å; A364-D366 PolarHBondContact O-N 2.83Å; A364-F367 PolarHBondContact O-N 3.42Å
365	E	23.2	Very low	23.7	Very low	161 Å²	161	145.9 Å²	145.9	75%	0.752	72%	0.722	S	S	*	*	G	3₁₀ helix	trans	-66.9	-26.7	-177.9	-69.8	-169.9	135.8	0	0	113.2	F367	E365-F367 PolarHBondContact O-N 3.32Å
366	D	25.4	Very low	23.7	Very low	159 Å²	159	144.3 Å²	144.3	85%	0.85	72%	0.718	S	S	*	*	G	3₁₀ helix	trans	-72.3	-7.9	178	-69.4	-26.9	0	0	0	114.4	A364	A364-D366 VanDerWaalsContact C-N 3.28Å; A364-D366 PolarHBondContact O-N 2.83Å
367	F	23.7	Very low	23.7	Very low	179 Å²	179	147.7 Å²	147.7	79%	0.785	73%	0.732	S	S	*	*	G	3₁₀ helix	trans	-103.1	1.6	-170.3	-96.8	-77.8	0	0	0	116.3	A364 E365	A364-F367 PolarHBondContact O-N 3.42Å; E365-F367 PolarHBondContact O-N 3.32Å
368	I	22.3	Very low	23.7	Very low	127 Å²	127	148.7 Å²	148.7	65%	0.651	73%	0.732	S	S	*	*			trans	-134.1	76.8	-179.8	-46.8	-178.4	0	0	0	112	F370	I368-F370 HydrophobicContact CG2-CD2 4Å; I368-F370 HydrophobicContact CG2-CE2 3.96Å
369	Q	20.4	Very low	23.7	Very low	187 Å²	187	150.1 Å²	150.1	87%	0.874	75%	0.745	S	S	*	*			trans	-126.1	117.8	150.8	-75.2	-169.4	-9.6	0	0	109.1	P371	Q369-P371 WeakPolarHBondContact O-CD 3.39Å
370	F	22.1	Very low	23.6	Very low	179 Å²	179	149.8 Å²	149.8	79%	0.785	75%	0.746	S	S	*	*			trans	-104.8	106.3	177.6	-77.2	-86.6	0	0	0	110.1	I368	I368-F370 HydrophobicContact CG2-CD2 4Å; I368-F370 HydrophobicContact CG2-CE2 3.96Å
371	P	21.7	Very low	23.5	Very low	104 Å²	104	153.1 Å²	153.1	68%	0.675	75%	0.75	S	S	*	*			trans	-93.8	111.6	163.6	11.8	7.5	0	0	0	109.3	Q369	Q369-P371 WeakPolarHBondContact O-CD 3.39Å
372	F	22.9	Very low	23.5	Very low	179 Å²	179	151.2 Å²	151.2	79%	0.785	76%	0.76	S	S	*	*			trans	-60.9	152.7	161.4	-80.2	-110.9	0	0	0	110.2
373	I	22.9	Very low	23.6	Very low	155 Å²	155	150 Å²	150	80%	0.795	75%	0.752	S	S	*	*			trans	-166.2	134.2	136	-95.4	144	0	0	0	108.5
374	S	22.9	Very low	23.8	Very low	108 Å²	108	146.4 Å²	146.4	76%	0.755	75%	0.748	S	S	*	*			trans	-86.4	143.2	177.6	43	0	0	0	0	111.5
375	N	23.2	Very low	23.9	Very low	106 Å²	106	151.6 Å²	151.6	57%	0.567	76%	0.763	S	S	*	*			trans	-123.3	95.2	169.4	-96.6	-20.1	0	0	0	109.4
376	V	25.2	Very low	24.1	Very low	129 Å²	129	147.6 Å²	147.6	78%	0.782	75%	0.749	S	S	*	*			trans	-136.5	92.2	159.4	-176.8	0	0	0	0	107.3
377	Q	23.3	Very low	24.4	Very low	186 Å²	186	148.4 Å²	148.4	87%	0.869	75%	0.745	S	S	*	*			trans	-86.9	115.5	162.8	-74.5	177.4	-56.9	0	0	107.9
378	E	23.7	Very low	25	Very low	165 Å²	165	146.7 Å²	146.7	77%	0.771	74%	0.744	S	S	*	*			trans	-155.7	110.5	147.9	-114.7	165.5	-139.7	0	0	109.7
379	N	24.7	Very low	25.3	Very low	146 Å²	146	147.7 Å²	147.7	78%	0.781	75%	0.751	S	S	*	*			trans	61.8	67.8	157.6	-54.6	-28.9	0	0	0	120.3
380	H	23.6	Very low	25.7	Very low	187 Å²	187	145.2 Å²	145.2	87%	0.866	74%	0.742	S	S	*	*			trans	-129.3	136.7	148.4	-77.2	-73.9	0	0	0	111.6	S382	H380-S382 PolarHBondContact O-N 2.6Å
381	Q	24.1	Very low	25.9	Very low	168 Å²	168	140.8 Å²	140.8	79%	0.785	73%	0.726	S	S	*	*			trans	-70.5	117.1	-179.3	-71.8	177.7	-21.6	0	0	110.7	F383	Q381-F383 HydrophobicContact CB-CD2 4.32Å; Q381-F383 HydrophobicContact CB-CE2 3.9Å; Q381-F383 PolarHBondContact O-N 2.77Å
382	S	24.8	Very low	26.4	Very low	113 Å²	113	140.3 Å²	140.3	79%	0.79	72%	0.717	S	S	*	*			trans	-75.2	108	177	45.1	0	0	0	0	111.6	H380	H380-S382 PolarHBondContact O-N 2.6Å
383	F	26.2	Very low	26.7	Very low	145 Å²	145	137.4 Å²	137.4	64%	0.636	71%	0.709	S	S	*	*			trans	-99.2	111.8	168.8	-76	-84.2	0	0	0	110.6	Q381 F385	Q381-F383 HydrophobicContact CB-CD2 4.32Å; Q381-F383 HydrophobicContact CB-CE2 3.9Å; Q381-F383 PolarHBondContact O-N 2.77Å; F383-F385 HydrophobicContact CB-CD2 3.97Å; F383-F385 HydrophobicContact CB-CE2 3.59Å; F383-F385 HydrophobicContact CB-CZ 4.45Å; F383-F385 HydrophobicContact CG-CE2 4.44Å; F383-F385 PolarHBondContact O-N 3.41Å
384	N	28.5	Very low	27.3	Very low	149 Å²	149	136.1 Å²	136.1	80%	0.797	70%	0.7	S	S	*	*			trans	-72.7	90.3	174.9	-78.9	-14.4	0	0	0	110.7	V386	N384-V386 PolarHBondContact O-N 3.03Å
385	F	28.2	Very low	28	Very low	152 Å²	152	136.2 Å²	136.2	67%	0.667	69%	0.692	S	S	*	*			trans	-81.1	12.9	168	-74.7	-78.1	0	0	0	113.5	F383 K387	F383-F385 HydrophobicContact CB-CD2 3.97Å; F383-F385 HydrophobicContact CB-CE2 3.59Å; F383-F385 HydrophobicContact CB-CZ 4.45Å; F383-F385 HydrophobicContact CG-CE2 4.44Å; F383-F385 PolarHBondContact O-N 3.41Å; F385-K387 PolarHBondContact O-N 2.8Å
386	V	27.1	Very low	28.4	Very low	77 Å²	77	133.5 Å²	133.5	47%	0.467	68%	0.677	S	S	.	*			trans	-91.1	100.2	173.9	-174.4	0	0	0	0	109.2	N384	N384-V386 PolarHBondContact O-N 3.03Å
387	K	30.5	Very low	28.8	Very low	175 Å²	175	130.8 Å²	130.8	76%	0.761	66%	0.657	S	S	*	*	B	Isolated β-bridge	trans	-105	125.2	157.1	-122.2	-178.5	179.6	-177.3	0	107.8	F385 N389	F385-K387 PolarHBondContact O-N 2.8Å; K387-N389 PolarHBondContact O-N 3.14Å; K387-N389 VanDerWaalsContact O-N 3.12Å
388	D	36.2	Very low	29.5	Very low	143 Å²	143	125.6 Å²	125.6	77%	0.765	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	51.7	36.3	176.1	-51.5	-33.7	0	0	0	115.2	I390	D388-I390 PolarHBondContact O-N 2.95Å; D388-I390 VanDerWaalsContact O-N 3.17Å
389	N	30	Very low	30.1	Very low	149 Å²	149	124.1 Å²	124.1	80%	0.797	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	61	19.1	170.9	-59	-20.6	0	0	0	116.5	K387	K387-N389 PolarHBondContact O-N 3.14Å; K387-N389 VanDerWaalsContact O-N 3.12Å
390	I	27.2	Very low	30.5	Very low	134 Å²	134	121.3 Å²	121.3	69%	0.687	61%	0.61	S	S	*	*	B	Isolated β-bridge	trans	-119.4	120.2	174.8	-59.5	174.4	0	0	0	108.9	D388	D388-I390 PolarHBondContact O-N 2.95Å; D388-I390 VanDerWaalsContact O-N 3.17Å
391	I	26.4	Very low	31.1	Very low	87 Å²	87	118.8 Å²	118.8	45%	0.446	60%	0.599	S	S	.	*			trans	-89.9	103.8	171.4	-60.5	175.6	0	0	0	107.2	L393 I396 T421	I391-L393 PolarHBondContact O-N 3.15Å; I391-I396 HydrophobicContact CG2-CD1 3.54Å; I391-I396 HydrophobicContact CG2-CG1 4.33Å; I391-T421 HydrophobicContact CD1-CG2 3.91Å
392	D	33.1	Very low	31.8	Very low	93 Å²	93	113.8 Å²	113.8	50%	0.497	58%	0.583	S	S	.	*			trans	-73.9	115.4	171.3	-162.5	-28	0	0	0	109.5	H394 D395	D392-H394 PolarHBondContact O-N 3.21Å; D392-H394 VanDerWaalsContact O-N 3.15Å; D392-H394 VanDerWaalsContact OD1-CB 3.31Å; D392-H394 WeakPolarHBondContact OD1-CB 3.33Å; D392-H394 PolarHBondContact OD1-N 2.67Å; D392-D395 PolarHBondContact O-N 2.92Å; D392-D395 VanDerWaalsContact O-N 3.09Å
393	L	29.3	Very low	32.2	Very low	118 Å²	118	110.3 Å²	110.3	62%	0.618	56%	0.558	S	S	*	*	H	α-helix	trans	-58.9	-23	175.9	-101.4	155.1	0	0	0	112.4	I391 D395 I396 I397	I391-L393 PolarHBondContact O-N 3.15Å; L393-D395 VanDerWaalsContact C-N 3.34Å; L393-I396 PolarHBondContact O-N 3.19Å; L393-I397 WeakPolarHBondContact O-CB 3.3Å; L393-I397 WeakPolarHBondContact O-CD1 3.27Å; L393-I397 VanDerWaalsContact O-CG1 3.25Å; L393-I397 WeakPolarHBondContact O-CG1 3.44Å; L393-I397 PolarHBondContact O-N 2.88Å
394	H	35.5	Very low	32.4	Very low	129 Å²	129	112.2 Å²	112.2	60%	0.597	57%	0.566	S	S	*	*	H	α-helix	trans	-67.4	-33.5	176.1	-137.2	45.9	0	0	0	112.5	D392 I397 T398	D392-H394 PolarHBondContact O-N 3.21Å; D392-H394 VanDerWaalsContact O-N 3.15Å; D392-H394 VanDerWaalsContact OD1-CB 3.31Å; D392-H394 WeakPolarHBondContact OD1-CB 3.33Å; D392-H394 PolarHBondContact OD1-N 2.67Å; H394-I397 PolarHBondContact O-N 3.46Å; H394-T398 VanDerWaalsContact O-CB 3.29Å; H394-T398 WeakPolarHBondContact O-CB 3.46Å; H394-T398 PolarHBondContact O-N 3.07Å; H394-T398 PolarHBondContact O-OG1 3.26Å
395	D	37.6	Very low	32.7	Very low	109 Å²	109	114.6 Å²	114.6	58%	0.583	57%	0.569	S	S	*	*	H	α-helix	trans	-70.4	-38.7	174.4	-75	-23.3	0	0	0	111.5	D392 L393 T398 W399	D392-D395 PolarHBondContact O-N 2.92Å; D392-D395 VanDerWaalsContact O-N 3.09Å; L393-D395 VanDerWaalsContact C-N 3.34Å; D395-T398 PolarHBondContact O-N 2.92Å; D395-W399 WeakPolarHBondContact O-CB 3.38Å; D395-W399 PolarHBondContact O-N 3.41Å
396	I	32.1	Very low	32.9	Very low	50 Å²	50	110.4 Å²	110.4	26%	0.256	56%	0.559	S	S	.	*	H	α-helix	trans	-63.2	-45.1	173.7	-63.4	177.6	0	0	0	110.7	I391 L393 W399 L400	I391-I396 HydrophobicContact CG2-CD1 3.54Å; I391-I396 HydrophobicContact CG2-CG1 4.33Å; L393-I396 PolarHBondContact O-N 3.19Å; I396-W399 PolarHBondContact O-N 3.03Å; I396-L400 HydrophobicContact CG2-CD1 4.03Å; I396-L400 WeakPolarHBondContact O-CB 3.13Å; I396-L400 WeakPolarHBondContact O-CG 3.49Å; I396-L400 PolarHBondContact O-N 3.01Å
397	I	33.6	Very low	32.9	Very low	72 Å²	72	116 Å²	116	37%	0.369	57%	0.573	S	S	.	*	H	α-helix	trans	-65.7	-41.6	178.5	-69	165.1	0	0	0	110.8	L393 H394 W399 L400 Q401	L393-I397 WeakPolarHBondContact O-CB 3.3Å; L393-I397 WeakPolarHBondContact O-CD1 3.27Å; L393-I397 VanDerWaalsContact O-CG1 3.25Å; L393-I397 WeakPolarHBondContact O-CG1 3.44Å; L393-I397 PolarHBondContact O-N 2.88Å; H394-I397 PolarHBondContact O-N 3.46Å; I397-W399 VanDerWaalsContact C-N 3.34Å; I397-L400 PolarHBondContact O-N 2.8Å; I397-Q401 WeakPolarHBondContact O-CB 3.43Å; I397-Q401 VanDerWaalsContact O-CG 3.29Å; I397-Q401 WeakPolarHBondContact O-CG 3.47Å; I397-Q401 PolarHBondContact O-N 3.01Å
398	T	36.5	Very low	32.8	Very low	76 Å²	76	115.9 Å²	115.9	47%	0.466	58%	0.58	S	S	.	*	H	α-helix	trans	-65.8	-39	177.1	-56.1	0	0	0	0	110.9	H394 D395 Q401 S402	H394-T398 VanDerWaalsContact O-CB 3.29Å; H394-T398 WeakPolarHBondContact O-CB 3.46Å; H394-T398 PolarHBondContact O-N 3.07Å; H394-T398 PolarHBondContact O-OG1 3.26Å; D395-T398 PolarHBondContact O-N 2.92Å; T398-Q401 PolarHBondContact O-N 3.27Å; T398-S402 WeakPolarHBondContact O-CB 3.48Å; T398-S402 PolarHBondContact O-N 2.89Å; T398-S402 PolarHBondContact O-OG 2.94Å
399	W	36.5	Very low	32.4	Very low	134 Å²	134	114.3 Å²	114.3	51%	0.508	57%	0.571	S	S	.	*	H	α-helix	trans	-62.9	-50.9	173.2	-177.2	77.7	0	0	0	112.1	D395 I396 I397 Q401 S402 S403	D395-W399 WeakPolarHBondContact O-CB 3.38Å; D395-W399 PolarHBondContact O-N 3.41Å; I396-W399 PolarHBondContact O-N 3.03Å; I397-W399 VanDerWaalsContact C-N 3.34Å; W399-Q401 PolarHBondContact O-N 3.38Å; W399-S402 WeakPolarHBondContact CA-OG 3.42Å; W399-S402 WeakPolarHBondContact O-CA 3.39Å; W399-S402 PolarHBondContact O-N 3.05Å; W399-S402 PolarHBondContact O-OG 2.92Å; W399-S403 PolarHBondContact O-N 2.88Å; W399-S403 PolarHBondContact O-OG 2.81Å
400	L	32.6	Very low	32.4	Very low	87 Å²	87	113.5 Å²	113.5	46%	0.455	57%	0.567	S	S	.	*	H	α-helix	trans	-60.5	-27.2	176.4	-74.6	170.9	0	0	0	113.8	I396 I397 S403	I396-L400 HydrophobicContact CG2-CD1 4.03Å; I396-L400 WeakPolarHBondContact O-CB 3.13Å; I396-L400 WeakPolarHBondContact O-CG 3.49Å; I396-L400 PolarHBondContact O-N 3.01Å; I397-L400 PolarHBondContact O-N 2.8Å; L400-S403 PolarHBondContact O-OG 3.15Å
401	Q	36.8	Very low	32.6	Very low	135 Å²	135	117.2 Å²	117.2	63%	0.631	58%	0.578	S	S	*	*	H	α-helix	trans	-82.3	-29.7	172.6	-71	-179.1	13.2	0	0	112.6	I397 T398 W399	I397-Q401 WeakPolarHBondContact O-CB 3.43Å; I397-Q401 VanDerWaalsContact O-CG 3.29Å; I397-Q401 WeakPolarHBondContact O-CG 3.47Å; I397-Q401 PolarHBondContact O-N 3.01Å; T398-Q401 PolarHBondContact O-N 3.27Å; W399-Q401 PolarHBondContact O-N 3.38Å
402	S	38.4	Very low	32.8	Very low	63 Å²	63	120.6 Å²	120.6	44%	0.441	60%	0.597	S	S	.	*	H	α-helix	trans	-76.9	-39.5	176.8	76.3	0	0	0	0	112.9	T398 W399 K404 K405	T398-S402 WeakPolarHBondContact O-CB 3.48Å; T398-S402 PolarHBondContact O-N 2.89Å; T398-S402 PolarHBondContact O-OG 2.94Å; W399-S402 WeakPolarHBondContact CA-OG 3.42Å; W399-S402 WeakPolarHBondContact O-CA 3.39Å; W399-S402 PolarHBondContact O-N 3.05Å; W399-S402 PolarHBondContact O-OG 2.92Å; S402-K404 PolarHBondContact O-N 3.43Å; S402-K405 PolarHBondContact O-N 3.09Å
403	S	33.3	Very low	32.5	Very low	39 Å²	39	119.1 Å²	119.1	27%	0.273	59%	0.594	S	S	.	*	H	α-helix	trans	-63.4	-29.5	-179.9	60.3	0	0	0	0	111.8	W399 L400 K405 S406	W399-S403 PolarHBondContact O-N 2.88Å; W399-S403 PolarHBondContact O-OG 2.81Å; L400-S403 PolarHBondContact O-OG 3.15Å; S403-K405 PolarHBondContact O-N 2.86Å; S403-K405 VanDerWaalsContact O-N 3.09Å; S403-S406 PolarHBondContact O-N 2.88Å; S403-S406 PolarHBondContact O-OG 3.05Å
404	K	32.1	Very low	32.3	Very low	185 Å²	185	122.1 Å²	122.1	80%	0.804	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	-9.9	171.1	-77.8	-173.3	175.6	-178.3	0	115.8	S402	S402-K404 PolarHBondContact O-N 3.43Å
405	K	33.7	Very low	31.8	Very low	200 Å²	200	123.4 Å²	123.4	87%	0.87	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.5	-18	175.7	-78.5	-172.8	175.2	178.7	0	114.3	S402 S403	S402-K405 PolarHBondContact O-N 3.09Å; S403-K405 PolarHBondContact O-N 2.86Å; S403-K405 VanDerWaalsContact O-N 3.09Å
406	S	31.4	Very low	31.2	Very low	63 Å²	63	125 Å²	125	44%	0.441	62%	0.619	S	S	.	*	S	Bend	trans	-106.9	129	175.8	52	0	0	0	0	109.3	S403	S403-S406 PolarHBondContact O-N 2.88Å; S403-S406 PolarHBondContact O-OG 3.05Å
407	Y	27.2	Very low	30.9	Very low	195 Å²	195	126.8 Å²	126.8	77%	0.765	63%	0.634	S	S	*	*			trans	76.8	108.1	-174.3	-53.4	-82.8	0	0	0	115.2	L409	Y407-L409 PolarHBondContact O-N 2.88Å
408	N	29.9	Very low	30.4	Very low	172 Å²	172	129.6 Å²	129.6	92%	0.92	66%	0.655	S	S	*	*			trans	-66.6	71.8	153.5	-72.4	-36.2	0	0	0	108.5	N410	N408-N410 PolarHBondContact O-N 3.09Å
409	L	28.2	Very low	29.8	Very low	110 Å²	110	132.9 Å²	132.9	58%	0.576	67%	0.669	S	S	*	*			trans	-64.6	123.3	174.3	-81.4	159.7	0	0	0	108.7	Y407	Y407-L409 PolarHBondContact O-N 2.88Å
410	N	30	Very low	29.2	Very low	133 Å²	133	131.4 Å²	131.4	71%	0.711	68%	0.679	S	S	*	*			trans	-55.9	147.3	171.7	-73.1	-36.7	0	0	0	109.2	N408 D412 S413	N408-N410 PolarHBondContact O-N 3.09Å; N410-D412 PolarHBondContact O-N 2.84Å; N410-S413 PolarHBondContact O-OG 2.94Å
411	K	30.7	Very low	28.9	Very low	212 Å²	212	130.8 Å²	130.8	92%	0.922	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.5	8.1	-168.2	-73.4	-176.4	171.5	-177.8	0	116.2
412	D	30.3	Very low	28.3	Very low	158 Å²	158	129.9 Å²	129.9	85%	0.845	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.4	26.8	-173.7	-48.9	-44.9	0	0	0	112.1	N410	N410-D412 PolarHBondContact O-N 2.84Å
413	S	26.1	Very low	27.7	Very low	61 Å²	61	133.8 Å²	133.8	43%	0.427	70%	0.699	S	S	.	*			trans	-125.8	97.3	175.6	44.8	0	0	0	0	111.7	N410	N410-S413 PolarHBondContact O-OG 2.94Å
414	E	25.6	Very low	27.3	Very low	181 Å²	181	140.4 Å²	140.4	85%	0.846	73%	0.726	S	S	*	*			trans	-84.2	101	164.3	-67.7	-174.7	136.5	0	0	109
415	E	25.1	Very low	26.8	Very low	157 Å²	157	137.7 Å²	137.7	73%	0.734	73%	0.728	S	S	*	*			trans	-85	118.6	168.7	-80.1	-168.3	143.9	0	0	110.8
416	I	25.5	Very low	26.3	Very low	143 Å²	143	136.3 Å²	136.3	73%	0.733	72%	0.723	S	S	*	*			trans	-97.2	107.2	174.3	-60.4	174	0	0	0	108.4	T418	I416-T418 PolarHBondContact O-N 2.79Å
417	C	24.7	Very low	25.7	Very low	86 Å²	86	142 Å²	142	58%	0.581	74%	0.74	S	S	*	*			trans	-90	98.5	176	-58.7	0	0	0	0	111.5	L419	C417-L419 PolarHBondContact O-N 3.22Å
418	T	24.7	Very low	25.5	Very low	132 Å²	132	138.6 Å²	138.6	81%	0.81	74%	0.743	S	S	*	*			trans	-84	106.3	175.5	23.5	0	0	0	0	112.1	I416	I416-T418 PolarHBondContact O-N 2.79Å
419	L	22.8	Very low	25.1	Very low	144 Å²	144	136.6 Å²	136.6	75%	0.754	73%	0.731	S	S	*	*			trans	-91.5	100.8	176.6	-72.7	164.2	0	0	0	111.1	C417	C417-L419 PolarHBondContact O-N 3.22Å
420	S	25.2	Very low	24.8	Very low	103 Å²	103	142.1 Å²	142.1	72%	0.72	75%	0.745	S	S	*	*			trans	-87.3	109.2	173.6	157.7	0	0	0	0	110.6
421	T	24.9	Very low	24.4	Very low	75 Å²	75	141.1 Å²	141.1	46%	0.46	74%	0.744	S	S	.	*			trans	-104.7	106.2	165.5	41.7	0	0	0	0	109.1	I391	I391-T421 HydrophobicContact CD1-CG2 3.91Å
422	T	24.9	Very low	24.2	Very low	116 Å²	116	135.7 Å²	135.7	71%	0.712	73%	0.733	S	S	*	*			trans	-76.2	122.7	172.8	48.2	0	0	0	0	109.4
423	D	25.6	Very low	23.9	Very low	145 Å²	145	136 Å²	136	78%	0.775	73%	0.729	S	S	*	*	S	Bend	trans	71.3	142.6	175.1	-55.2	-36.7	0	0	0	118.2
424	Q	24.8	Very low	23.8	Very low	178 Å²	178	143.9 Å²	143.9	83%	0.832	75%	0.751	S	S	*	*			trans	91.7	144.5	164.8	-47.6	-166.1	15.4	0	0	118.4	F426	Q424-F426 PolarHBondContact O-N 3.4Å
425	C	22.4	Very low	23.7	Very low	128 Å²	128	141.4 Å²	141.4	87%	0.865	75%	0.748	S	S	*	*			trans	-81.3	115.8	-155.4	-55.1	0	0	0	0	113.4	K427	C425-K427 PolarHBondContact O-N 3.48Å
426	F	22	Very low	23.6	Very low	170 Å²	170	142.6 Å²	142.6	75%	0.746	75%	0.754	S	S	*	*			trans	-67.9	96.1	168.1	-70.6	-83.8	0	0	0	111.6	Q424 C428	Q424-F426 PolarHBondContact O-N 3.4Å; F426-C428 PolarHBondContact O-N 3.12Å
427	K	20	Very low	23.4	Very low	184 Å²	184	144.7 Å²	144.7	80%	0.8	76%	0.758	S	S	*	*			trans	-95.1	66	172.7	-164.3	-178.7	-175	179.7	0	110.6	C425 I429	C425-K427 PolarHBondContact O-N 3.48Å; K427-I429 PolarHBondContact O-N 3.09Å
428	C	22.3	Very low	23.3	Very low	123 Å²	123	148.2 Å²	148.2	83%	0.831	77%	0.769	S	S	*	*			trans	-82	109.7	179.3	-156.2	0	0	0	0	110.9	F426	F426-C428 PolarHBondContact O-N 3.12Å
429	I	21.1	Very low	23.2	Very low	130 Å²	130	146.6 Å²	146.6	67%	0.667	76%	0.761	S	S	*	*			trans	-92	115.8	173.2	-61	167.2	0	0	0	107.3	K427	K427-I429 PolarHBondContact O-N 3.09Å
430	Y	22.1	Very low	23.2	Very low	225 Å²	225	145.3 Å²	145.3	88%	0.882	76%	0.764	S	S	*	*			trans	-148.7	120.4	151.1	-137.8	-96	0	0	0	111.6
431	T	22.3	Very low	23	Very low	113 Å²	113	150 Å²	150	69%	0.693	77%	0.771	S	S	*	*			trans	-102.9	132.4	179.2	50.6	0	0	0	0	110.2
432	S	25.9	Very low	23.1	Very low	97 Å²	97	151.6 Å²	151.6	68%	0.678	79%	0.786	S	S	*	*			trans	-125.6	118.5	149	53.5	0	0	0	0	109
433	H	25	Very low	23	Very low	164 Å²	164	151.4 Å²	151.4	76%	0.759	79%	0.789	S	S	*	*	S	Bend	trans	82.9	129.4	176.6	-43.1	-61.1	0	0	0	117.2
434	Y	23.6	Very low	22.9	Very low	228 Å²	228	149.7 Å²	149.7	89%	0.894	79%	0.789	S	S	*	*			trans	80.9	123.9	-178	-60.6	-75.1	0	0	0	118.3
435	T	23.3	Very low	23	Very low	128 Å²	128	146.1 Å²	146.1	79%	0.785	78%	0.783	S	S	*	*			trans	-107.6	162	-166.2	41.5	0	0	0	0	112.5
436	Q	22.9	Very low	23.2	Very low	182 Å²	182	148.8 Å²	148.8	85%	0.85	79%	0.788	S	S	*	*			trans	76.9	93.2	163.9	-72.8	176.8	-26.3	0	0	118.8
437	F	20.6	Very low	23.2	Very low	188 Å²	188	148 Å²	148	83%	0.825	79%	0.791	S	S	*	*			trans	-33.7	134.8	134.2	-105.1	-113.4	0	0	0	114.2	P439	F437-P439 HydrophobicContact CD1-CB 4.45Å; F437-P439 HydrophobicContact CD1-CG 4.01Å; F437-P439 HydrophobicContact CE1-CG 4.46Å
438	I	22.6	Very low	23.4	Very low	160 Å²	160	144.6 Å²	144.6	82%	0.821	79%	0.786	S	S	*	*			trans	-137.5	111.7	137.7	-58.9	-176.8	0	0	0	108.1
439	P	22.3	Very low	23.6	Very low	97 Å²	97	143.4 Å²	143.4	63%	0.63	77%	0.774	S	S	*	*			trans	-93	104	177.8	33.5	-27.3	0	0	0	110.4	F437 K441	F437-P439 HydrophobicContact CD1-CB 4.45Å; F437-P439 HydrophobicContact CD1-CG 4.01Å; F437-P439 HydrophobicContact CE1-CG 4.46Å; P439-K441 PolarHBondContact O-N 2.86Å
440	S	23.4	Very low	23.8	Very low	117 Å²	117	143.7 Å²	143.7	82%	0.818	78%	0.783	S	S	*	*			trans	-72.6	113	173.9	50.7	0	0	0	0	111.1
441	K	22	Very low	23.8	Very low	201 Å²	201	138.3 Å²	138.3	87%	0.874	77%	0.773	S	S	*	*			trans	-64.8	130.2	171.3	-65.2	171.5	175.6	175.7	0	111.1	P439	P439-K441 PolarHBondContact O-N 2.86Å
442	S	25.3	Very low	23.9	Very low	109 Å²	109	140.4 Å²	140.4	76%	0.762	78%	0.78	S	S	*	*				160.7	160.7	128.9	52.6	0	0	0	0	111.7
443	S	23.9	Very low	23.7	Very low	112 Å²	112	144.5 Å²	144.5	78%	0.783	78%	0.782	S	S	*	*			trans	58.6	99.5	-178.9	40	0	0	0	0	116.9
444	S	24.3	Very low	23.6	Very low	110 Å²	110	141.4 Å²	141.4	77%	0.769	77%	0.771	S	S	*	*			trans	-40	170.2	155.8	46.9	0	0	0	0	117.3
445	S	26.2	Very low	23.5	Very low	102 Å²	102	142.1 Å²	142.1	71%	0.713	77%	0.772	S	S	*	*	S	Bend	trans	70.7	71.8	169.8	62.9	0	0	0	0	117.7
446	L	25.3	Very low	23.3	Very low	185 Å²	185	142.9 Å²	142.9	97%	0.969	77%	0.766	S	S	*	*				46.2	80.5	121.3	-75.5	151.5	0	0	0	116.6
447	L	23.4	Very low	23.2	Very low	154 Å²	154	141 Å²	141	81%	0.806	77%	0.767	S	S	*	*			trans	-121.2	151.5	156.3	-96.4	166.7	0	0	0	110.5
448	T	23.7	Very low	23.2	Very low	112 Å²	112	138.8 Å²	138.8	69%	0.687	76%	0.759	S	S	*	*			trans	68.6	107	150.7	48.8	0	0	0	0	121.1
449	T	26.7	Very low	23.1	Very low	97 Å²	97	137.4 Å²	137.4	60%	0.595	76%	0.758	S	S	*	*				50.1	122.4	124.3	61.2	0	0	0	0	120.8
450	T	24.9	Very low	23.1	Very low	137 Å²	137	137.6 Å²	137.6	84%	0.84	76%	0.76	S	S	*	*			trans	-132.7	129.3	149.1	45.9	0	0	0	0	111.2
451	T	22.9	Very low	23.1	Very low	112 Å²	112	138.8 Å²	138.8	69%	0.687	75%	0.753	S	S	*	*			trans	-81.9	135	-179.9	44.4	0	0	0	0	112
452	N	23.7	Very low	23.1	Very low	157 Å²	157	135.3 Å²	135.3	84%	0.84	75%	0.749	S	S	*	*			trans	-91	140.2	174.3	-69.2	-18.7	0	0	0	111.4
453	Y	22.8	Very low	22.9	Very low	183 Å²	183	141 Å²	141	72%	0.718	75%	0.754	S	S	*	*			trans	-114.3	133.5	170.2	-71.2	-91.2	0	0	0	109
454	L	21.7	Very low	22.6	Very low	99 Å²	99	143.7 Å²	143.7	52%	0.518	76%	0.758	S	S	.	*			trans	-93.6	156.1	172.1	-120.8	88.8	0	0	0	110.7	E340	E340-L454 HydrophobicContact CG-CB 4.33Å; E340-L454 WeakPolarHBondContact OE1-CB 3.37Å
455	W	21	Very low	22.4	Very low	243 Å²	243	146.1 Å²	146.1	92%	0.92	76%	0.758	S	S	*	*			trans	-137.1	146.5	169.1	-78.7	85.6	0	0	0	110
456	H	20.3	Very low	22.1	Very low	143 Å²	143	148.7 Å²	148.7	66%	0.662	76%	0.762	S	S	*	*			trans	-120.4	140.1	-164.7	-164.7	-72.5	0	0	0	111.1
457	V	19.9	Very low	21.8	Very low	144 Å²	144	146.7 Å²	146.7	87%	0.873	75%	0.747	S	S	*	*			trans	-134.5	138.3	173.4	179.8	0	0	0	0	108.4
458	Q	20.6	Very low	21.6	Very low	141 Å²	141	147.5 Å²	147.5	66%	0.659	75%	0.751	S	S	*	*			trans	-144	142.4	-165.8	176.7	-171.9	-7.1	0	0	111.6
459	V	21	Very low	21.5	Very low	131 Å²	131	149.6 Å²	149.6	79%	0.794	75%	0.753	S	S	*	*			trans	-145.5	155.1	166.7	-174.6	0	0	0	0	109.8
460	C	21.1	Very low	21.2	Very low	100 Å²	100	153.2 Å²	153.2	68%	0.676	76%	0.763	S	S	*	*			trans	-140.5	176.4	-174.3	-46.6	0	0	0	0	110.6
461	E	24.4	Very low	21	Very low	142 Å²	142	154.9 Å²	154.9	66%	0.664	77%	0.767	S	S	*	*			cis	-156.6	168.6	7.4	-163.1	-145	123.7	0	0	108
462	T	22.6	Very low	20.9	Very low	129 Å²	129	158.4 Å²	158.4	79%	0.791	78%	0.775	S	S	*	*				168.4	172.4	101.3	40.4	0	0	0	0	115.4
463	R	19.9	Very low	20.7	Very low	228 Å²	228	161.1 Å²	161.1	86%	0.86	78%	0.78	S	S	*	*			trans	-76.1	166.5	-163.7	-61.4	167.7	167.5	176.1	-6.9	119.5
464	L	19.1	Very low	20.6	Very low	168 Å²	168	160.8 Å²	160.8	88%	0.88	79%	0.785	S	S	*	*			trans	-144.1	150.4	149.8	-147.7	141.1	0	0	0	111.8
465	Q	19.2	Very low	20.5	Very low	162 Å²	162	164.6 Å²	164.6	76%	0.757	80%	0.8	S	S	*	*			trans	-126.3	140.8	-167.5	174.5	-176.2	-5	0	0	111.4
466	I	18.9	Very low	20.5	Very low	156 Å²	156	162.9 Å²	162.9	80%	0.8	80%	0.795	S	S	*	*			trans	-134.3	141.2	173.6	-59	-179.9	0	0	0	109.6
467	Q	19	Very low	20.5	Very low	143 Å²	143	164.1 Å²	164.1	67%	0.668	80%	0.801	S	S	*	*			trans	-132.6	138.5	-171.4	-177.9	179.8	0.3	0	0	110
468	L	19.4	Very low	20.6	Very low	170 Å²	170	165.2 Å²	165.2	89%	0.89	80%	0.796	S	S	*	*			trans	-131.5	141.3	176.9	-83.3	164.6	0	0	0	111
469	H	21.4	Very low	20.6	Very low	157 Å²	157	165.8 Å²	165.8	73%	0.727	80%	0.803	S	S	*	*			trans	-99.5	162.9	-168.8	-97.4	-102.1	0	0	0	114.2
470	H	21.2	Very low	20.6	Very low	172 Å²	172	167.1 Å²	167.1	80%	0.796	81%	0.805	S	S	*	*			trans	-32.5	143.9	179.6	-64.7	-49.1	0	0	0	118.6
471	N	20.3	Very low	20.6	Very low	172 Å²	172	171.1 Å²	171.1	92%	0.92	81%	0.811	S	S	*	*			trans	-141.4	137.3	140.1	-100.3	-33.8	0	0	0	109.8
472	Q	21.5	Very low	20.6	Very low	186 Å²	186	175 Å²	175	87%	0.869	82%	0.819	S	S	*	*			trans	-90.8	154.9	-178.6	-77.1	-178.4	-36.2	0	0	112.3
473	F	19.7	Very low	20.5	Very low	214 Å²	214	174.3 Å²	174.3	94%	0.939	82%	0.819	S	S	*	*			trans	-63.6	131.9	-178.2	-70.6	-103.4	0	0	0	113
474	Q	19.7	Very low	20.6	Very low	176 Å²	176	168.6 Å²	168.6	82%	0.822	81%	0.81	S	S	*	*			trans	-111.7	137.1	157.4	-79.8	-173	-20.8	0	0	110	Y476	Q474-Y476 PolarHBondContact O-N 3.4Å
475	Q	20.5	Very low	20.8	Very low	179 Å²	179	164.9 Å²	164.9	84%	0.836	80%	0.796	S	S	*	*			trans	-73.9	120.6	-173.7	-67.4	160.5	-52.6	0	0	111.4	H477	Q475-H477 PolarHBondContact O-N 3.23Å
476	Y	19.8	Very low	21.1	Very low	207 Å²	207	164.5 Å²	164.5	81%	0.812	80%	0.798	S	S	*	*			trans	-90.5	98.7	171.3	-81.1	-91.6	0	0	0	110.8	Q474 H478	Q474-Y476 PolarHBondContact O-N 3.4Å; Y476-H478 PolarHBondContact O-N 3.07Å; Y476-H478 VanDerWaalsContact O-N 3.17Å
477	H	20.5	Very low	21.2	Very low	170 Å²	170	162 Å²	162	79%	0.787	79%	0.794	S	S	*	*			trans	-70.9	102.1	166.8	-82.8	-84.1	0	0	0	110.2	Q475 L479	Q475-H477 PolarHBondContact O-N 3.23Å; H477-L479 PolarHBondContact O-N 2.87Å
478	H	22	Very low	21.5	Very low	167 Å²	167	159.3 Å²	159.3	77%	0.773	79%	0.791	S	S	*	*			trans	-74	91.1	174.2	-95.5	-83.2	0	0	0	111.8	Y476 L480	Y476-H478 PolarHBondContact O-N 3.07Å; Y476-H478 VanDerWaalsContact O-N 3.17Å; H478-L480 PolarHBondContact O-N 3.29Å
479	L	20.9	Very low	21.7	Very low	152 Å²	152	160.6 Å²	160.6	80%	0.796	80%	0.795	S	S	*	*			trans	-79.3	92.6	173.5	-158.8	133.6	0	0	0	109.6	H477 K481	H477-L479 PolarHBondContact O-N 2.87Å; L479-K481 VanDerWaalsContact C-N 3.33Å; L479-K481 PolarHBondContact O-N 3.14Å
480	L	22.3	Very low	21.7	Very low	160 Å²	160	160.2 Å²	160.2	84%	0.838	80%	0.795	S	S	*	*			trans	-71.3	80	-175.9	-92.5	161.9	0	0	0	112.7	H478 R482	H478-L480 PolarHBondContact O-N 3.29Å; L480-R482 PolarHBondContact O-N 3.32Å
481	K	21	Very low	21.9	Very low	183 Å²	183	157.5 Å²	157.5	80%	0.796	79%	0.791	S	S	*	*			trans	-62.5	109.8	162.7	-108.3	-178.1	174.5	-179.4	0	109.5	L479	L479-K481 VanDerWaalsContact C-N 3.33Å; L479-K481 PolarHBondContact O-N 3.14Å
482	R	23.2	Very low	22.2	Very low	225 Å²	225	157.9 Å²	157.9	85%	0.849	79%	0.787	S	S	*	*			trans	-117.4	91.8	166.6	-154.2	176.6	-164.3	173.2	6.4	110	L480 T484	L480-R482 PolarHBondContact O-N 3.32Å; R482-T484 PolarHBondContact O-N 3.45Å
483	S	20.9	Very low	22.4	Very low	113 Å²	113	155.6 Å²	155.6	79%	0.79	79%	0.786	S	S	*	*			trans	-82	98.6	177.8	50.8	0	0	0	0	110.8
484	T	22.9	Very low	22.7	Very low	108 Å²	108	149.3 Å²	149.3	66%	0.663	77%	0.769	S	S	*	*			trans	-126.6	101.3	162.1	43.3	0	0	0	0	107.6	R482	R482-T484 PolarHBondContact O-N 3.45Å
485	P	22.6	Very low	22.9	Very low	91 Å²	91	147.9 Å²	147.9	59%	0.591	77%	0.766	S	S	*	*			trans	-65	135.8	178.2	27.2	-32.9	0	0	0	109.9	S487	P485-S487 PolarHBondContact O-N 2.72Å
486	I	25	Very low	23.2	Very low	154 Å²	154	148.1 Å²	148.1	79%	0.79	76%	0.764	S	S	*	*			trans	-87.6	84.9	179.6	-57.6	171.7	0	0	0	106.9	S488	I486-S488 VanDerWaalsContact C-N 3.31Å; I486-S488 PolarHBondContact O-N 2.86Å
487	S	22.3	Very low	23.5	Very low	103 Å²	103	145.6 Å²	145.6	72%	0.72	77%	0.765	S	S	*	*			trans	-73.9	84.6	174.8	62.6	0	0	0	0	110.1	P485 M489	P485-S487 PolarHBondContact O-N 2.72Å; S487-M489 PolarHBondContact O-N 2.92Å
488	S	25	Very low	23.6	Very low	87 Å²	87	146.6 Å²	146.6	61%	0.608	77%	0.769	S	S	*	*			trans	-67.8	125.5	165.7	55	0	0	0	0	109.1	I486 M490	I486-S488 VanDerWaalsContact C-N 3.31Å; I486-S488 PolarHBondContact O-N 2.86Å; S488-M490 PolarHBondContact O-N 2.79Å
489	M	22.3	Very low	23.8	Very low	196 Å²	196	144 Å²	144	97%	0.966	77%	0.77	S	S	*	*			trans	-69.9	82.1	165.5	-79.3	-173.6	71.6	0	0	109	S487	S487-M489 PolarHBondContact O-N 2.92Å
490	M	22.4	Very low	23.9	Very low	150 Å²	150	143.8 Å²	143.8	74%	0.739	77%	0.765	S	S	*	*			trans	-82.4	132.9	159	-76.5	-153.5	166.2	0	0	109.4	S488	S488-M490 PolarHBondContact O-N 2.79Å
491	T	25.2	Very low	24	Very low	115 Å²	115	141.5 Å²	141.5	71%	0.706	76%	0.763	S	S	*	*			trans	-54.5	139.7	-174.6	44.7	0	0	0	0	112.8	T493	T491-T493 PolarHBondContact O-N 2.82Å
492	E	26.4	Very low	24.1	Very low	179 Å²	179	137 Å²	137	84%	0.836	75%	0.754	S	S	*	*	G	3₁₀ helix	trans	-58.7	2.6	-160.4	-109.1	179.7	156.7	0	0	118.8
493	T	26.9	Very low	24.1	Very low	138 Å²	138	132.4 Å²	132.4	85%	0.847	75%	0.746	S	S	*	*	G	3₁₀ helix	trans	-93.7	-4	-172.6	49.1	0	0	0	0	115.5	T491	T491-T493 PolarHBondContact O-N 2.82Å
494	S	25	Very low	24.3	Very low	83 Å²	83	135.4 Å²	135.4	58%	0.58	74%	0.741	S	S	*	*	G	3₁₀ helix	trans	-116.6	19.5	177.8	58.2	0	0	0	0	114.6	K496	S494-K496 PolarHBondContact O-N 2.83Å
495	L	23.3	Very low	24.5	Very low	145 Å²	145	135 Å²	135	76%	0.759	74%	0.738	S	S	*	*			trans	-85.1	76.3	-175.9	-140.9	139.3	0	0	0	112.6
496	K	26.6	Very low	24.7	Very low	184 Å²	184	137.6 Å²	137.6	80%	0.8	75%	0.745	S	S	*	*	S	Bend	trans	-158.1	110.7	161.1	-104.8	152.2	-168.9	174.1	0	111.2	S494	S494-K496 PolarHBondContact O-N 2.83Å
497	N	26.7	Very low	24.9	Very low	155 Å²	155	131.9 Å²	131.9	83%	0.829	73%	0.725	S	S	*	*	S	Bend	trans	93.4	19.7	164	-51.2	-12.1	0	0	0	120.2
498	H	23.6	Very low	25.4	Very low	190 Å²	190	134.4 Å²	134.4	88%	0.88	72%	0.723	S	S	*	*			trans	-112.2	101.9	167.4	-69.3	-58	0	0	0	112.1
499	S	24.9	Very low	26	Very low	113 Å²	113	133.1 Å²	133.1	79%	0.79	71%	0.709	S	S	*	*			trans	-82.2	135.6	170.8	52.6	0	0	0	0	111.2	S501	S499-S501 PolarHBondContact O-N 2.77Å; S499-S501 VanDerWaalsContact O-N 3.12Å
500	E	23.6	Very low	26.5	Very low	148 Å²	148	127.4 Å²	127.4	69%	0.692	68%	0.682	S	S	*	*			trans	-51.2	106.7	-176.1	-57.3	173.7	153.3	0	0	113.8
501	S	23.7	Very low	27.2	Very low	112 Å²	112	126.2 Å²	126.2	78%	0.783	67%	0.669	S	S	*	*			trans	-87	110.7	172.1	57.2	0	0	0	0	110.8	S499 L503	S499-S501 PolarHBondContact O-N 2.77Å; S499-S501 VanDerWaalsContact O-N 3.12Å; S501-L503 PolarHBondContact O-N 2.9Å
502	S	24.6	Very low	27.7	Very low	87 Å²	87	123.3 Å²	123.3	61%	0.608	65%	0.649	S	S	*	*			trans	-72.5	122	177	37.5	0	0	0	0	111.8	Y504	S502-Y504 WeakPolarHBondContact O-CD2 3.48Å; S502-Y504 WeakPolarHBondContact OG-CE2 3.24Å
503	L	22.8	Very low	28	Very low	130 Å²	130	121.5 Å²	121.5	68%	0.681	65%	0.645	S	S	*	*			trans	-81.3	123.2	178	-109.5	148.9	0	0	0	111	S501	S501-L503 PolarHBondContact O-N 2.9Å
504	Y	25.3	Very low	28.4	Very low	175 Å²	175	120 Å²	120	69%	0.686	64%	0.636	S	S	*	*			trans	-114.7	122.4	173	-62	-91.5	0	0	0	109.4	S502	S502-Y504 WeakPolarHBondContact O-CD2 3.48Å; S502-Y504 WeakPolarHBondContact OG-CE2 3.24Å
505	V	26.2	Very low	29.1	Very low	101 Å²	101	121.8 Å²	121.8	61%	0.612	64%	0.635	S	S	*	*			trans	-96.3	103.2	179.5	-173.9	0	0	0	0	109.7	L520 T522	V505-L520 HydrophobicContact CG1-CD2 4.38Å; V505-T522 HydrophobicContact CG1-CG2 3.56Å
506	I	26.7	Very low	29.4	Very low	144 Å²	144	116.9 Å²	116.9	74%	0.738	62%	0.619	S	S	*	*			trans	-120.8	129.4	170.4	-57.2	175.6	0	0	0	107
507	G	30.1	Very low	29.8	Very low	35 Å²	35	109.5 Å²	109.5	36%	0.361	59%	0.59	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-155.1	163.7	-174.5	0	0	0	0	0	113.9	Q521	G507-Q521 CarbonylContact C-O 3.41Å; G507-Q521 WeakPolarHBondContact CA-O 3.37Å
508	K	32.5	Very low	30.3	Very low	155 Å²	155	104 Å²	104	67%	0.674	56%	0.559	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-98.8	139.7	173.9	-68.9	-179.1	178.1	179.3	0	109.5	Q521	K508-Q521 PolarHBondContact N-O 2.86Å; K508-Q521 PolarHBondContact O-N 2.82Å
509	I	36.6	Very low	30.9	Very low	61 Å²	61	97.2 Å²	97.2	31%	0.313	53%	0.526	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	127.9	172.3	-60.9	164.3	0	0	0	108.1	F518 Y519 L520 I615	I509-F518 HydrophobicContact CG2-CB 4.19Å; I509-F518 HydrophobicContact CG2-CD1 4Å; I509-Y519 CarbonylContact C-O 3.6Å; I509-Y519 WeakPolarHBondContact CA-O 3.31Å; I509-L520 HydrophobicContact CG1-CD1 3.68Å; I509-I615 HydrophobicContact CD1-CB 4.47Å; I509-I615 HydrophobicContact CD1-CD1 3.76Å; I509-I615 HydrophobicContact CD1-CG1 3.92Å
510	L	33.8	Very low	31.5	Very low	76 Å²	76	93.7 Å²	93.7	40%	0.398	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	128.6	178.4	-64.9	175.8	0	0	0	109.5	F518 Y519 Q521 F547	L510-F518 CarbonylContact O-C 3.47Å; L510-F518 WeakPolarHBondContact O-CA 3.49Å; L510-Y519 PolarHBondContact N-O 2.79Å; L510-Y519 PolarHBondContact O-N 2.88Å; L510-Q521 HydrophobicContact CD1-CB 4.21Å; L510-F547 HydrophobicContact CD1-CE1 4.37Å
511	W	36.5	Very low	32	Very low	125 Å²	125	89.3 Å²	89.3	47%	0.473	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	131.5	169.5	172.8	-105.7	0	0	0	109.9	N513 G516 F518	W511-N513 PolarHBondContact NE1-OD1 2.76Å; W511-G516 VanDerWaalsContact CH2-CA 3.44Å; W511-G516 WeakPolarHBondContact CH2-O 3.37Å; W511-G516 WeakPolarHBondContact CZ3-O 3.41Å; W511-F518 HydrophobicContact CB-CD1 3.98Å; W511-F518 HydrophobicContact CB-CE1 3.83Å; W511-F518 HydrophobicContact CD2-CD1 4.46Å; W511-F518 HydrophobicContact CD2-CE1 4.07Å; W511-F518 HydrophobicContact CD2-CE2 4.48Å; W511-F518 HydrophobicContact CD2-CZ 4.06Å; W511-F518 AromaticContact CE3-CD1 3.73Å; W511-F518 HydrophobicContact CE3-CD1 3.73Å; W511-F518 AromaticContact CE3-CD2 3.56Å; W511-F518 HydrophobicContact CE3-CD2 3.56Å; W511-F518 AromaticContact CE3-CE1 3.53Å; W511-F518 HydrophobicContact CE3-CE1 3.53Å; W511-F518 AromaticContact CE3-CE2 3.38Å; W511-F518 HydrophobicContact CE3-CE2 3.38Å; W511-F518 AromaticContact CE3-CG 3.73Å; W511-F518 HydrophobicContact CE3-CG 3.73Å; W511-F518 AromaticContact CE3-CZ 3.33Å; W511-F518 HydrophobicContact CE3-CZ 3.33Å; W511-F518 HydrophobicContact CG-CE1 4.23Å; W511-F518 HydrophobicContact CH2-CE2 4.43Å; W511-F518 AromaticContact CZ3-CD2 3.64Å; W511-F518 HydrophobicContact CZ3-CD2 3.64Å; W511-F518 HydrophobicContact CZ3-CE1 4.35Å; W511-F518 AromaticContact CZ3-CE2 3.34Å; W511-F518 HydrophobicContact CZ3-CE2 3.34Å; W511-F518 HydrophobicContact CZ3-CG 4.27Å; W511-F518 AromaticContact CZ3-CZ 3.71Å; W511-F518 HydrophobicContact CZ3-CZ 3.71Å
512	N	36.5	Very low	32.6	Very low	54 Å²	54	84.6 Å²	84.6	29%	0.289	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	109	174.6	-172	-1.5	0	0	0	111.7	T514 H515 G516 C517 Y519	N512-T514 PolarHBondContact ND2-OG1 3.22Å; N512-T514 PolarHBondContact O-N 2.75Å; N512-T514 VanDerWaalsContact O-N 3.16Å; N512-T514 PolarHBondContact OD1-N 3.09Å; N512-T514 VanDerWaalsContact OD1-N 3.09Å; N512-T514 PolarHBondContact OD1-OG1 3.12Å; N512-H515 PolarHBondContact ND2-CD2 2.76Å; N512-H515 VanDerWaalsContact ND2-CD2 3.32Å; N512-H515 PolarHBondContact O-N 2.73Å; N512-G516 PolarHBondContact O-N 3.47Å; N512-C517 PolarHBondContact N-O 3.38Å; N512-Y519 HydrophobicContact CB-CD2 4.06Å; N512-Y519 HydrophobicContact CB-CE2 3.75Å
513	N	32.7	Very low	32.9	Very low	140 Å²	140	84.2 Å²	84.2	75%	0.749	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-27.5	177.9	-74.1	-13.9	0	0	0	114.2	W511 H515	W511-N513 PolarHBondContact NE1-OD1 2.76Å; N513-H515 VanDerWaalsContact C-N 3.34Å
514	T	35.4	Very low	33.3	Very low	106 Å²	106	81.8 Å²	81.8	65%	0.65	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-19.6	-177.9	58.4	0	0	0	0	114.1	N512	N512-T514 PolarHBondContact ND2-OG1 3.22Å; N512-T514 PolarHBondContact O-N 2.75Å; N512-T514 VanDerWaalsContact O-N 3.16Å; N512-T514 PolarHBondContact OD1-N 3.09Å; N512-T514 VanDerWaalsContact OD1-N 3.09Å; N512-T514 PolarHBondContact OD1-OG1 3.12Å
515	H	39.8	Very low	33.5	Very low	122 Å²	122	78.8 Å²	78.8	57%	0.565	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.2	-9.8	-176.6	-54.2	-43.3	0	0	0	113.2	N512 N513 C517	N512-H515 PolarHBondContact ND2-CD2 2.76Å; N512-H515 VanDerWaalsContact ND2-CD2 3.32Å; N512-H515 PolarHBondContact O-N 2.73Å; N513-H515 VanDerWaalsContact C-N 3.34Å; H515-C517 VanDerWaalsContact C-N 3.28Å; H515-C517 PolarHBondContact O-N 3.38Å
516	G	29	Very low	33.7	Very low	41 Å²	41	79.5 Å²	79.5	42%	0.423	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.4	30.6	-177.8	0	0	0	0	0	113.1	W511 N512	W511-G516 VanDerWaalsContact CH2-CA 3.44Å; W511-G516 WeakPolarHBondContact CH2-O 3.37Å; W511-G516 WeakPolarHBondContact CZ3-O 3.41Å; N512-G516 PolarHBondContact O-N 3.47Å
517	C	35.4	Very low	33.8	Very low	30 Å²	30	78.6 Å²	78.6	20%	0.203	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	143.6	-174.9	-71.7	0	0	0	0	111.9	N512 H515 Y519	N512-C517 PolarHBondContact N-O 3.38Å; H515-C517 VanDerWaalsContact C-N 3.28Å; H515-C517 PolarHBondContact O-N 3.38Å; C517-Y519 HydrophobicContact CB-CD2 4.42Å; C517-Y519 HydrophobicContact CB-CE2 3.73Å
518	F	35.6	Very low	33.7	Very low	38 Å²	38	82.2 Å²	82.2	17%	0.167	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	138.1	165.6	-65.2	-82	0	0	0	109.7	I509 L510 W511 P549 L550 F552 M613	I509-F518 HydrophobicContact CG2-CB 4.19Å; I509-F518 HydrophobicContact CG2-CD1 4Å; L510-F518 CarbonylContact O-C 3.47Å; L510-F518 WeakPolarHBondContact O-CA 3.49Å; W511-F518 HydrophobicContact CB-CD1 3.98Å; W511-F518 HydrophobicContact CB-CE1 3.83Å; W511-F518 HydrophobicContact CD2-CD1 4.46Å; W511-F518 HydrophobicContact CD2-CE1 4.07Å; W511-F518 HydrophobicContact CD2-CE2 4.48Å; W511-F518 HydrophobicContact CD2-CZ 4.06Å; W511-F518 AromaticContact CE3-CD1 3.73Å; W511-F518 HydrophobicContact CE3-CD1 3.73Å; W511-F518 AromaticContact CE3-CD2 3.56Å; W511-F518 HydrophobicContact CE3-CD2 3.56Å; W511-F518 AromaticContact CE3-CE1 3.53Å; W511-F518 HydrophobicContact CE3-CE1 3.53Å; W511-F518 AromaticContact CE3-CE2 3.38Å; W511-F518 HydrophobicContact CE3-CE2 3.38Å; W511-F518 AromaticContact CE3-CG 3.73Å; W511-F518 HydrophobicContact CE3-CG 3.73Å; W511-F518 AromaticContact CE3-CZ 3.33Å; W511-F518 HydrophobicContact CE3-CZ 3.33Å; W511-F518 HydrophobicContact CG-CE1 4.23Å; W511-F518 HydrophobicContact CH2-CE2 4.43Å; W511-F518 AromaticContact CZ3-CD2 3.64Å; W511-F518 HydrophobicContact CZ3-CD2 3.64Å; W511-F518 HydrophobicContact CZ3-CE1 4.35Å; W511-F518 AromaticContact CZ3-CE2 3.34Å; W511-F518 HydrophobicContact CZ3-CE2 3.34Å; W511-F518 HydrophobicContact CZ3-CG 4.27Å; W511-F518 AromaticContact CZ3-CZ 3.71Å; W511-F518 HydrophobicContact CZ3-CZ 3.71Å; F518-P549 CarbonylContact O-C 3.59Å; F518-P549 WeakPolarHBondContact O-CA 3.33Å; F518-L550 HydrophobicContact CB-CB 4.24Å; F518-L550 PolarHBondContact O-N 3.06Å; F518-F552 HydrophobicContact CB-CE2 4.42Å; F518-F552 HydrophobicContact CD2-CD2 4.36Å; F518-F552 AromaticContact CD2-CE2 3.77Å; F518-F552 HydrophobicContact CD2-CE2 3.77Å; F518-F552 HydrophobicContact CE2-CE2 4.45Å; F518-F552 HydrophobicContact CG-CE2 4.29Å; F518-M613 HydrophobicContact CD1-SD 4.3Å; F518-M613 HydrophobicContact CE1-CE 3.69Å; F518-M613 HydrophobicContact CE1-SD 3.47Å; F518-M613 WeakPolarHBondContact CE1-SD 3.49Å; F518-M613 HydrophobicContact CE2-CE 4.35Å; F518-M613 HydrophobicContact CZ-CE 3.52Å; F518-M613 HydrophobicContact CZ-SD 3.96Å
519	Y	38.2	Very low	33.4	Very low	49 Å²	49	81.2 Å²	81.2	19%	0.192	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	131.4	175.5	-65.9	-92.8	0	0	0	110.2	I509 L510 N512 C517 F547 I548 P549	I509-Y519 CarbonylContact C-O 3.6Å; I509-Y519 WeakPolarHBondContact CA-O 3.31Å; L510-Y519 PolarHBondContact N-O 2.79Å; L510-Y519 PolarHBondContact O-N 2.88Å; N512-Y519 HydrophobicContact CB-CD2 4.06Å; N512-Y519 HydrophobicContact CB-CE2 3.75Å; C517-Y519 HydrophobicContact CB-CD2 4.42Å; C517-Y519 HydrophobicContact CB-CE2 3.73Å; Y519-F547 HydrophobicContact CD1-CB 3.96Å; Y519-I548 CarbonylContact C-O 3.44Å; Y519-I548 WeakPolarHBondContact CA-O 3.44Å; Y519-P549 HydrophobicContact CD1-CB 4.15Å; Y519-P549 HydrophobicContact CE1-CB 3.96Å
520	L	37.1	Very low	33	Very low	39 Å²	39	84.3 Å²	84.3	20%	0.204	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	111.3	164.3	-170.1	75.1	0	0	0	108.6	V505 I509 T522 I548 L550	V505-L520 HydrophobicContact CG1-CD2 4.38Å; I509-L520 HydrophobicContact CG1-CD1 3.68Å; L520-T522 HydrophobicContact CD2-CG2 3.75Å; L520-T522 HydrophobicContact CG-CG2 3.82Å; L520-I548 HydrophobicContact CB-CB 4.36Å; L520-I548 PolarHBondContact N-O 2.81Å; L520-I548 PolarHBondContact O-N 3.45Å; L520-L550 HydrophobicContact CB-CD1 4.35Å
521	Q	34	Very low	32.6	Very low	55 Å²	55	86.9 Å²	86.9	26%	0.257	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	114.5	173.5	-173.5	-173.3	30.4	0	0	109.6	G507 K508 L510 T545 I546 F547	G507-Q521 CarbonylContact C-O 3.41Å; G507-Q521 WeakPolarHBondContact CA-O 3.37Å; K508-Q521 PolarHBondContact N-O 2.86Å; K508-Q521 PolarHBondContact O-N 2.82Å; L510-Q521 HydrophobicContact CD1-CB 4.21Å; Q521-T545 HydrophobicContact CG-CG2 3.97Å; Q521-I546 WeakPolarHBondContact CA-O 3.43Å; Q521-F547 HydrophobicContact CB-CD1 4.04Å; Q521-F547 HydrophobicContact CB-CE1 3.91Å; Q521-F547 HydrophobicContact CG-CD1 4.13Å; Q521-F547 HydrophobicContact CG-CE1 3.66Å; Q521-F547 HydrophobicContact CG-CZ 3.96Å
522	T	35.4	Very low	32.1	Very low	13 Å²	13	86.9 Å²	86.9	8%	0.08	49%	0.493	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	147.1	-177.8	63	0	0	0	0	111	V505 L520 T545 I546	V505-T522 HydrophobicContact CG1-CG2 3.56Å; L520-T522 HydrophobicContact CD2-CG2 3.75Å; L520-T522 HydrophobicContact CG-CG2 3.82Å; T522-T545 WeakPolarHBondContact O-CA 3.31Å; T522-I546 PolarHBondContact N-O 2.74Å; T522-I546 VanDerWaalsContact N-O 3.07Å; T522-I546 PolarHBondContact O-N 2.96Å
523	V	31.4	Very low	31.6	Very low	79 Å²	79	90.4 Å²	90.4	48%	0.479	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	119.5	179	-178.6	0	0	0	0	109.5	N525 T545	V523-N525 PolarHBondContact O-N 3.14Å; V523-N525 VanDerWaalsContact O-N 3.15Å; V523-T545 HydrophobicContact CG2-CG2 4.15Å
524	H	31.3	Very low	31.3	Very low	80 Å²	80	90.3 Å²	90.3	37%	0.37	52%	0.521	S	S	.	.			trans	-82.3	87.9	179.9	-161.4	-51.1	0	0	0	111.6	N526	H524-N526 PolarHBondContact CE1-OD1 2.88Å; H524-N526 PolarHBondContact ND1-OD1 2.82Å; H524-N526 PolarHBondContact O-N 2.66Å
525	N	30	Very low	30.9	Very low	111 Å²	111	92.9 Å²	92.9	59%	0.594	53%	0.531	S	S	*	.			trans	-71.5	95.9	175.1	-91.7	23.8	0	0	0	111.9	V523 D527	V523-N525 PolarHBondContact O-N 3.14Å; V523-N525 VanDerWaalsContact O-N 3.15Å; N525-D527 VanDerWaalsContact C-N 3.26Å; N525-D527 PolarHBondContact ND2-OD2 2.81Å; N525-D527 PolarHBondContact O-N 3.31Å
526	N	30	Very low	30.4	Very low	116 Å²	116	94.4 Å²	94.4	62%	0.62	54%	0.543	S	S	*	.			trans	-77.4	75.6	164.5	-77.8	-5.6	0	0	0	110.4	H524 T528	H524-N526 PolarHBondContact CE1-OD1 2.88Å; H524-N526 PolarHBondContact ND1-OD1 2.82Å; H524-N526 PolarHBondContact O-N 2.66Å; N526-T528 PolarHBondContact O-N 2.88Å
527	D	27.7	Very low	30.4	Very low	126 Å²	126	99.6 Å²	99.6	67%	0.674	56%	0.562	S	S	*	*			trans	-77.5	60.2	174.9	-74.7	-36.3	0	0	0	111.8	N525 T529	N525-D527 VanDerWaalsContact C-N 3.26Å; N525-D527 PolarHBondContact ND2-OD2 2.81Å; N525-D527 PolarHBondContact O-N 3.31Å; D527-T529 PolarHBondContact O-N 2.9Å
528	T	29.2	Very low	30.1	Very low	110 Å²	110	105.6 Å²	105.6	68%	0.675	59%	0.591	S	S	*	*			trans	-77.2	95.7	164.4	52.5	0	0	0	0	109	N526 T530	N526-T528 PolarHBondContact O-N 2.88Å; T528-T530 PolarHBondContact O-N 3.46Å
529	T	26.2	Very low	29.8	Very low	135 Å²	135	111.1 Å²	111.1	83%	0.828	62%	0.623	S	S	*	*			trans	-71.2	73.6	176.1	53	0	0	0	0	111.9	D527 T531	D527-T529 PolarHBondContact O-N 2.9Å; T529-T531 PolarHBondContact O-N 2.84Å
530	T	27	Very low	29.4	Very low	126 Å²	126	116.4 Å²	116.4	77%	0.773	65%	0.654	S	S	*	*			trans	-75.9	103.1	167.5	49.5	0	0	0	0	109.6	T528 T532	T528-T530 PolarHBondContact O-N 3.46Å; T530-T532 PolarHBondContact O-N 3.18Å; T530-T532 VanDerWaalsContact O-N 3.13Å
531	T	25.8	Very low	28.9	Very low	129 Å²	129	123.4 Å²	123.4	79%	0.791	68%	0.683	S	S	*	*			trans	-61.1	108.6	167.5	47.7	0	0	0	0	110.5	T529	T529-T531 PolarHBondContact O-N 2.84Å
532	T	25.4	Very low	28.6	Very low	125 Å²	125	129.6 Å²	129.6	77%	0.767	71%	0.709	S	S	*	*				179.9	138.6	127.1	31.5	0	0	0	0	112.1	T530	T530-T532 PolarHBondContact O-N 3.18Å; T530-T532 VanDerWaalsContact O-N 3.13Å
533	T	25.9	Very low	28.4	Very low	128 Å²	128	134.1 Å²	134.1	79%	0.785	73%	0.733	S	S	*	*			trans	53.9	112.4	155.1	49	0	0	0	0	119.4	N535	T533-N535 PolarHBondContact O-N 2.98Å
534	T	27.6	Very low	28.3	Very low	138 Å²	138	135.7 Å²	135.7	85%	0.847	74%	0.739	S	S	*	*			trans	-41	123	154.9	47.5	0	0	0	0	113
535	N	27	Very low	28.3	Very low	161 Å²	161	134.4 Å²	134.4	86%	0.861	74%	0.736	S	S	*	*			trans	-148.1	121.4	148.3	-110.8	-22.5	0	0	0	109.7	T533 N537	T533-N535 PolarHBondContact O-N 2.98Å; N535-N537 PolarHBondContact O-N 2.92Å
536	N	28.6	Very low	28.4	Very low	154 Å²	154	132.3 Å²	132.3	82%	0.824	73%	0.725	S	S	*	*			trans	-64.3	125.4	171.5	-73.2	-27.1	0	0	0	108.9
537	N	28.6	Very low	28.4	Very low	150 Å²	150	131.9 Å²	131.9	80%	0.802	72%	0.717	S	S	*	*				-169.7	142.6	129.9	-95.8	-27	0	0	0	111.8	N535 N539	N535-N537 PolarHBondContact O-N 2.92Å; N537-N539 PolarHBondContact O-N 3.43Å
538	N	30.2	Very low	28.8	Very low	155 Å²	155	128.9 Å²	128.9	83%	0.829	70%	0.701	S	S	*	*			trans	-44	104.9	-178.3	-60.6	-24.7	0	0	0	113.6
539	N	29.3	Very low	28.8	Very low	154 Å²	154	126.3 Å²	126.3	82%	0.824	69%	0.686	S	S	*	*			trans	-114.3	119.5	153.3	-88.9	-30.2	0	0	0	107.7	N537 K541	N537-N539 PolarHBondContact O-N 3.43Å; N539-K541 PolarHBondContact O-N 3.29Å
540	N	30	Very low	29.1	Very low	160 Å²	160	121.6 Å²	121.6	86%	0.856	66%	0.655	S	S	*	*			trans	-60	97	175	-68.6	-30.6	0	0	0	108.9	K542	N540-K542 VanDerWaalsContact C-N 3.32Å; N540-K542 PolarHBondContact O-N 2.87Å
541	K	27.1	Very low	29.1	Very low	187 Å²	187	121.8 Å²	121.8	81%	0.813	65%	0.65	S	S	*	*			trans	-60.1	102.8	159.9	-83.6	-171.9	171.4	-172.3	0	106.3	N539 D543	N539-K541 PolarHBondContact O-N 3.29Å; K541-D543 PolarHBondContact O-N 2.84Å
542	K	27.7	Very low	29.4	Very low	185 Å²	185	118 Å²	118	80%	0.804	62%	0.623	S	S	*	*			trans	-64.4	98.4	155.1	-78.8	-175.6	172.4	-175.5	0	104.9	N540 N544	N540-K542 VanDerWaalsContact C-N 3.32Å; N540-K542 PolarHBondContact O-N 2.87Å; K542-N544 PolarHBondContact O-N 3.27Å
543	D	31	Very low	29.5	Very low	107 Å²	107	118.2 Å²	118.2	57%	0.572	62%	0.619	S	S	*	*			trans	-62.8	105.2	171.7	-70	-29.7	0	0	0	106.8	K541 T545	K541-D543 PolarHBondContact O-N 2.84Å; D543-T545 PolarHBondContact O-N 2.98Å; D543-T545 PolarHBondContact O-OG1 2.96Å
544	N	29.2	Very low	29.5	Very low	113 Å²	113	117.8 Å²	117.8	60%	0.604	61%	0.61	S	S	*	*			trans	-63.1	87.6	178.5	-77.8	-6.7	0	0	0	108.2	K542	K542-N544 PolarHBondContact O-N 3.27Å
545	T	31.8	Very low	29.6	Very low	52 Å²	52	117.6 Å²	117.6	32%	0.319	60%	0.604	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-94.8	108.9	179.8	18.5	0	0	0	0	107.5	Q521 T522 V523 D543 F547	Q521-T545 HydrophobicContact CG-CG2 3.97Å; T522-T545 WeakPolarHBondContact O-CA 3.31Å; V523-T545 HydrophobicContact CG2-CG2 4.15Å; D543-T545 PolarHBondContact O-N 2.98Å; D543-T545 PolarHBondContact O-OG1 2.96Å; T545-F547 WeakPolarHBondContact O-CD2 3.37Å
546	I	31.4	Very low	29.7	Very low	68 Å²	68	116.1 Å²	116.1	35%	0.349	60%	0.601	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-89	132.3	-179.1	-56.3	174.4	0	0	0	107.3	Q521 T522 I548	Q521-I546 WeakPolarHBondContact CA-O 3.43Å; T522-I546 PolarHBondContact N-O 2.74Å; T522-I546 VanDerWaalsContact N-O 3.07Å; T522-I546 PolarHBondContact O-N 2.96Å; I546-I548 HydrophobicContact CG2-CG1 4.07Å
547	F	30.2	Very low	29.7	Very low	107 Å²	107	113.6 Å²	113.6	47%	0.469	60%	0.595	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-110.7	106.4	178.4	-68.2	-89.6	0	0	0	109.4	L510 Y519 Q521 T545	L510-F547 HydrophobicContact CD1-CE1 4.37Å; Y519-F547 HydrophobicContact CD1-CB 3.96Å; Q521-F547 HydrophobicContact CB-CD1 4.04Å; Q521-F547 HydrophobicContact CB-CE1 3.91Å; Q521-F547 HydrophobicContact CG-CD1 4.13Å; Q521-F547 HydrophobicContact CG-CE1 3.66Å; Q521-F547 HydrophobicContact CG-CZ 3.96Å; T545-F547 WeakPolarHBondContact O-CD2 3.37Å
548	I	35.3	Very low	29.5	Very low	63 Å²	63	114.2 Å²	114.2	32%	0.323	60%	0.598	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-99.1	114.3	-178.7	-55.6	170.4	0	0	0	108.9	Y519 L520 I546	Y519-I548 CarbonylContact C-O 3.44Å; Y519-I548 WeakPolarHBondContact CA-O 3.44Å; L520-I548 HydrophobicContact CB-CB 4.36Å; L520-I548 PolarHBondContact N-O 2.81Å; L520-I548 PolarHBondContact O-N 3.45Å; I546-I548 HydrophobicContact CG2-CG1 4.07Å
549	P	28.7	Very low	29.2	Very low	55 Å²	55	116 Å²	116	36%	0.357	60%	0.602	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-68.7	140.3	177.6	28	-33.7	0	0	0	111.7	F518 Y519 P566	F518-P549 CarbonylContact O-C 3.59Å; F518-P549 WeakPolarHBondContact O-CA 3.33Å; Y519-P549 HydrophobicContact CD1-CB 4.15Å; Y519-P549 HydrophobicContact CE1-CB 3.96Å; P549-P566 HydrophobicContact CG-CG 4.22Å
550	L	32.7	Very low	29	Very low	37 Å²	37	115.1 Å²	115.1	19%	0.194	60%	0.596	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-120.4	121.4	-179.8	-58.3	174.5	0	0	0	109.9	F518 L520 F552	F518-L550 HydrophobicContact CB-CB 4.24Å; F518-L550 PolarHBondContact O-N 3.06Å; L520-L550 HydrophobicContact CB-CD1 4.35Å; L550-F552 HydrophobicContact CB-CE1 4.46Å; L550-F552 HydrophobicContact CB-CE2 4.02Å; L550-F552 HydrophobicContact CB-CZ 3.64Å; L550-F552 HydrophobicContact CD1-CZ 4.26Å
551	I	27.5	Very low	28.6	Very low	129 Å²	129	113.9 Å²	113.9	66%	0.662	59%	0.589	S	S	*	*			trans	-121.6	132.7	176.6	-58.6	177.5	0	0	0	108.7
552	F	32.2	Very low	28.5	Very low	49 Å²	49	108.8 Å²	108.8	22%	0.215	57%	0.57	C	S	.	*			trans	-109.1	128.4	-170.5	-56.9	-76.5	0	0	0	111.6	F518 L550 M554 V577 I615	F518-F552 HydrophobicContact CB-CE2 4.42Å; F518-F552 HydrophobicContact CD2-CD2 4.36Å; F518-F552 AromaticContact CD2-CE2 3.77Å; F518-F552 HydrophobicContact CD2-CE2 3.77Å; F518-F552 HydrophobicContact CE2-CE2 4.45Å; F518-F552 HydrophobicContact CG-CE2 4.29Å; L550-F552 HydrophobicContact CB-CE1 4.46Å; L550-F552 HydrophobicContact CB-CE2 4.02Å; L550-F552 HydrophobicContact CB-CZ 3.64Å; L550-F552 HydrophobicContact CD1-CZ 4.26Å; F552-M554 HydrophobicContact CB-CG 4.26Å; F552-M554 PolarHBondContact O-N 3.47Å; F552-V577 HydrophobicContact CD1-CB 4.44Å; F552-V577 HydrophobicContact CD1-CG1 3.88Å; F552-V577 HydrophobicContact CE1-CG1 4.07Å; F552-I615 HydrophobicContact CE1-CD1 3.97Å; F552-I615 HydrophobicContact CE1-CG2 3.97Å; F552-I615 HydrophobicContact CE2-CD1 4.21Å; F552-I615 HydrophobicContact CZ-CD1 3.42Å; F552-I615 VanDerWaalsContact CZ-CD1 3.42Å; F552-I615 HydrophobicContact CZ-CG2 4.46Å
553	N	28	Very low	28.3	Very low	130 Å²	130	105 Å²	105	70%	0.695	56%	0.558	S	S	*	*			trans	-77	104	172.6	-176.1	-2.2	0	0	0	109.8	N555	N553-N555 PolarHBondContact OD1-N 3.48Å
554	M	26	Very low	28	Very low	119 Å²	119	104.4 Å²	104.4	59%	0.586	55%	0.548	S	S	*	.			trans	-116.3	53.9	-178.9	-67.4	-82.2	-103.6	0	0	110.8	F552	F552-M554 HydrophobicContact CB-CG 4.26Å; F552-M554 PolarHBondContact O-N 3.47Å
555	N	29	Very low	27.9	Very low	134 Å²	134	103.5 Å²	103.5	72%	0.717	54%	0.543	S	S	*	.			trans	-150.1	140.2	160.5	-118.4	-20.8	0	0	0	114.5	N553	N553-N555 PolarHBondContact OD1-N 3.48Å
556	T	29.6	Very low	27.7	Very low	131 Å²	131	104 Å²	104	80%	0.804	55%	0.547	S	S	*	.			trans	-121.9	81	-171.6	50.7	0	0	0	0	111
557	S	27.3	Very low	27.8	Very low	101 Å²	101	104.1 Å²	104.1	71%	0.706	55%	0.554	S	S	*	*	S	Bend	trans	-177.2	112	153.2	33.5	0	0	0	0	108.5	E559	S557-E559 PolarHBondContact O-N 3.1Å; S557-E559 VanDerWaalsContact O-N 3.14Å
558	D	25.6	Very low	27.7	Very low	162 Å²	162	104.3 Å²	104.3	87%	0.866	56%	0.56	S	S	*	*	S	Bend	trans	37.2	61.4	151.2	-52.8	-23.8	0	0	0	118.6
559	E	23.9	Very low	27.4	Very low	192 Å²	192	109.7 Å²	109.7	90%	0.897	58%	0.578	S	S	*	*			trans	-167.7	158.2	140.8	-108	161.6	-151.2	0	0	112.3	S557	S557-E559 PolarHBondContact O-N 3.1Å; S557-E559 VanDerWaalsContact O-N 3.14Å
560	I	23.7	Very low	27.3	Very low	136 Å²	136	111.4 Å²	111.4	70%	0.697	59%	0.591	S	S	*	*			trans	-84	133.4	-167.8	-62.4	169.5	0	0	0	111	I562	I560-I562 HydrophobicContact CG2-CG1 4.03Å
561	N	22.5	Very low	27.2	Very low	135 Å²	135	112 Å²	112	72%	0.722	59%	0.594	S	S	*	*			trans	-126.8	139.4	159.4	-87.1	-54.8	0	0	0	111
562	I	24.1	Very low	27.4	Very low	79 Å²	79	110.7 Å²	110.7	41%	0.405	59%	0.587	S	S	.	*	P	Polyproline II helix	trans	-98.8	144.7	-160.5	-66.4	173.3	0	0	0	111.6	I560 L760	I560-I562 HydrophobicContact CG2-CG1 4.03Å; I562-L760 HydrophobicContact CD1-CB 3.73Å; I562-L760 HydrophobicContact CD1-CD2 3.89Å; I562-L760 HydrophobicContact CD1-CG 4.16Å
563	L	23.9	Very low	27.2	Very low	107 Å²	107	111.4 Å²	111.4	56%	0.56	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-88.4	145.1	-172.9	-150.3	98.5	0	0	0	112.2	L571 L573	L563-L571 HydrophobicContact CD2-CD2 4.38Å; L563-L573 HydrophobicContact CD1-CD1 4.2Å; L563-L573 HydrophobicContact CD2-CD1 4.02Å
564	Y	26.2	Very low	27.4	Very low	93 Å²	93	108.3 Å²	108.3	37%	0.365	58%	0.576	S	S	.	*	P	Polyproline II helix	trans	-103	159.9	-173.4	-81.8	-115.6	0	0	0	113.9	I744 Q759	Y564-I744 HydrophobicContact CD1-CD1 4.41Å; Y564-I744 HydrophobicContact CE1-CB 4.33Å; Y564-I744 HydrophobicContact CE1-CD1 3.5Å; Y564-I744 VanDerWaalsContact CE1-CD1 3.5Å; Y564-I744 HydrophobicContact CE1-CG1 3.72Å; Y564-I744 HydrophobicContact CE1-CG2 4.24Å; Y564-Q759 PolarHBondContact OH-OE1 3.39Å; Y564-Q759 VanDerWaalsContact OH-OE1 3.11Å
565	L	26.1	Very low	27.7	Very low	94 Å²	94	108.5 Å²	108.5	49%	0.492	57%	0.574	S	S	.	*			trans	-111.3	150	-174.6	-91.4	152.7	0	0	0	112.3	L571 L757	L565-L571 HydrophobicContact CD2-CD1 3.77Å; L565-L571 HydrophobicContact CD2-CD2 4.08Å; L565-L571 HydrophobicContact CD2-CG 3.83Å; L565-L571 HydrophobicContact CG-CD1 4.17Å; L565-L571 HydrophobicContact CG-CD2 4.28Å; L565-L571 HydrophobicContact CG-CG 4.45Å; L565-L757 HydrophobicContact CB-CD2 4.23Å
566	P	28.4	Very low	27.8	Very low	64 Å²	64	104 Å²	104	42%	0.416	56%	0.559	S	S	.	*			trans	-130.1	119.4	143.8	17.9	2.9	0	0	0	113.6	P549 D568	P549-P566 HydrophobicContact CG-CG 4.22Å; P566-D568 VanDerWaalsContact C-N 3.35Å; P566-D568 PolarHBondContact O-N 2.82Å
567	S	32.9	Very low	27.9	Very low	70 Å²	70	99.7 Å²	99.7	49%	0.49	53%	0.532	S	S	.	.	S	Bend	trans	36.2	-26	155.8	57.2	0	0	0	0	125.2
568	D	27.4	Very low	28.2	Very low	111 Å²	111	99.4 Å²	99.4	59%	0.594	52%	0.519	S	S	*	.	S	Bend	trans	-112.8	55.5	-174.5	-74.9	-36.2	0	0	0	113.6	P566 S570	P566-D568 VanDerWaalsContact C-N 3.35Å; P566-D568 PolarHBondContact O-N 2.82Å; D568-S570 PolarHBondContact O-N 3.43Å; D568-S570 PolarHBondContact O-OG 2.92Å
569	Y	28.8	Very low	28.6	Very low	176 Å²	176	93 Å²	93	69%	0.69	49%	0.486	S	S	*	.	S	Bend	trans	39.1	19.3	161.2	-62.9	-72.2	0	0	0	120.4
570	S	28.6	Very low	29	Very low	91 Å²	91	86.3 Å²	86.3	64%	0.636	46%	0.456	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.5	98.9	-176.1	51.3	0	0	0	0	110.3	D568	D568-S570 PolarHBondContact O-N 3.43Å; D568-S570 PolarHBondContact O-OG 2.92Å
571	L	29.9	Very low	29.4	Very low	49 Å²	49	83.9 Å²	83.9	26%	0.257	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	130.2	179	-87.4	160.3	0	0	0	109.8	L563 L565 P622 F623	L563-L571 HydrophobicContact CD2-CD2 4.38Å; L565-L571 HydrophobicContact CD2-CD1 3.77Å; L565-L571 HydrophobicContact CD2-CD2 4.08Å; L565-L571 HydrophobicContact CD2-CG 3.83Å; L565-L571 HydrophobicContact CG-CD1 4.17Å; L565-L571 HydrophobicContact CG-CD2 4.28Å; L565-L571 HydrophobicContact CG-CG 4.45Å; L571-P622 CarbonylContact O-C 3.52Å; L571-P622 WeakPolarHBondContact O-CA 3.47Å; L571-F623 HydrophobicContact CB-CB 4.43Å; L571-F623 PolarHBondContact N-O 3.37Å; L571-F623 PolarHBondContact O-N 3.29Å
572	I	30.5	Very low	29.9	Very low	102 Å²	102	81.4 Å²	81.4	52%	0.523	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	105.5	173.9	-60.3	179.6	0	0	0	108.7	L574 I620	I572-L574 HydrophobicContact CG2-CD2 3.89Å; I572-L574 HydrophobicContact CG2-CG 4.45Å; I572-L574 PolarHBondContact O-N 3.21Å; I572-I620 HydrophobicContact CG2-CG2 3.42Å; I572-I620 VanDerWaalsContact CG2-CG2 3.42Å
573	L	29.9	Very low	30.4	Very low	64 Å²	64	81.9 Å²	81.9	34%	0.335	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	119.3	174.7	-170.4	79.9	0	0	0	109.8	L563 I620 I621 F623	L563-L573 HydrophobicContact CD1-CD1 4.2Å; L563-L573 HydrophobicContact CD2-CD1 4.02Å; L573-I620 WeakPolarHBondContact O-CA 3.31Å; L573-I621 HydrophobicContact CB-CB 4.36Å; L573-I621 HydrophobicContact CD2-CD1 4.41Å; L573-I621 PolarHBondContact N-O 3.23Å; L573-I621 PolarHBondContact O-N 3.18Å; L573-F623 HydrophobicContact CB-CE2 4.25Å
574	L	31.2	Very low	31.1	Very low	64 Å²	64	84.1 Å²	84.1	34%	0.335	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	113.4	173.9	-58	179.8	0	0	0	109.6	I572 V577 A617 I620	I572-L574 HydrophobicContact CG2-CD2 3.89Å; I572-L574 HydrophobicContact CG2-CG 4.45Å; I572-L574 PolarHBondContact O-N 3.21Å; L574-V577 HydrophobicContact CB-CG2 3.75Å; L574-A617 HydrophobicContact CB-CB 3.98Å; L574-A617 HydrophobicContact CD2-CB 4.03Å; L574-A617 HydrophobicContact CG-CB 4.48Å; L574-I620 HydrophobicContact CD2-CB 4.2Å; L574-I620 HydrophobicContact CD2-CD1 4.16Å; L574-I620 HydrophobicContact CD2-CG1 3.72Å; L574-I620 HydrophobicContact CD2-CG2 3.95Å
575	K	31.4	Very low	31.7	Very low	124 Å²	124	88.5 Å²	88.5	54%	0.539	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	137.2	-179.5	-172	-174.6	178.3	-170.3	0	111.1	K618 Q619	K575-K618 PolarHBondContact O-N 3.18Å; K575-Q619 HydrophobicContact CB-CB 4.24Å; K575-Q619 PolarHBondContact N-O 2.88Å; K575-Q619 PolarHBondContact O-N 3.4Å; K575-Q619 VanDerWaalsContact O-N 3.1Å
576	G	31.1	Very low	31.9	Very low	39 Å²	39	89.9 Å²	89.9	40%	0.402	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	65.2	60.2	177	0	0	0	0	0	110.7	K618	G576-K618 PolarHBondContact O-N 3.39Å
577	V	32.5	Very low	32.2	Very low	41 Å²	41	92.2 Å²	92.2	25%	0.248	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	126.2	-175.6	-174.6	0	0	0	0	109.8	F552 L574 I615 Y616 A617	F552-V577 HydrophobicContact CD1-CB 4.44Å; F552-V577 HydrophobicContact CD1-CG1 3.88Å; F552-V577 HydrophobicContact CE1-CG1 4.07Å; L574-V577 HydrophobicContact CB-CG2 3.75Å; V577-I615 HydrophobicContact CG1-CG2 3.39Å; V577-Y616 CarbonylContact C-O 3.56Å; V577-Y616 VanDerWaalsContact CA-O 3.25Å; V577-Y616 WeakPolarHBondContact CA-O 3.44Å; V577-A617 HydrophobicContact CG2-CB 4.11Å
578	Q	33.8	Very low	32	Very low	94 Å²	94	93 Å²	93	44%	0.439	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	137.8	168.5	-73.3	179.8	-34.4	0	0	108.9	Y616	Q578-Y616 PolarHBondContact N-O 3.43Å; Q578-Y616 PolarHBondContact O-N 3.23Å
579	V	33.4	Very low	32.1	Very low	28 Å²	28	94.6 Å²	94.6	17%	0.17	48%	0.483	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	124.3	174.4	173.3	0	0	0	0	107.3	M613 Y614	V579-M613 HydrophobicContact CG1-CE 3.28Å; V579-M613 HydrophobicContact CG1-CG 3.95Å; V579-M613 HydrophobicContact CG1-SD 4.47Å; V579-Y614 WeakPolarHBondContact CA-O 3.44Å
580	I	33.9	Very low	32.2	Very low	52 Å²	52	90.4 Å²	90.4	27%	0.267	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	124.6	-178.8	-54.1	177.3	0	0	0	107.4	V588 M613 Y614	I580-V588 HydrophobicContact CG2-CG1 3.62Å; I580-M613 WeakPolarHBondContact O-CA 3.4Å; I580-Y614 PolarHBondContact N-O 3.43Å; I580-Y614 PolarHBondContact O-N 3.19Å
581	Y	31.4	Very low	32.2	Very low	84 Å²	84	89.1 Å²	89.1	33%	0.329	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	128	178.3	-157.8	-108.9	0	0	0	109.1	E583 S611 M613	Y581-E583 HydrophobicContact CD1-CG 3.85Å; Y581-E583 HydrophobicContact CE1-CG 3.54Å; Y581-S611 VanDerWaalsContact CZ-CB 3.47Å; Y581-S611 VanDerWaalsContact OH-CB 3.3Å; Y581-S611 WeakPolarHBondContact OH-CB 3.37Å; Y581-S611 PolarHBondContact OH-OG 3.32Å; Y581-M613 HydrophobicContact CD2-CB 4.25Å; Y581-M613 HydrophobicContact CD2-CG 4.33Å
582	E	33.1	Very low	32.3	Very low	83 Å²	83	90.5 Å²	90.5	39%	0.388	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	107.8	179	-169.3	174.7	-139	0	0	108.7	S611 R612 Y614	E582-S611 WeakPolarHBondContact O-CA 3.45Å; E582-R612 PolarHBondContact N-O 3.11Å; E582-R612 PolarHBondContact O-N 3.42Å; E582-Y614 HydrophobicContact CB-CE2 4.36Å; E582-Y614 WeakPolarHBondContact OE2-CE2 3.41Å
583	E	33.5	Very low	32.5	Very low	90 Å²	90	89.6 Å²	89.6	42%	0.421	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	134.7	164.7	-64.5	-165.4	144.8	0	0	108.6	Y581 E585 N586	Y581-E583 HydrophobicContact CD1-CG 3.85Å; Y581-E583 HydrophobicContact CE1-CG 3.54Å; E583-E585 PolarHBondContact O-N 3.34Å; E583-N586 PolarHBondContact O-N 3.14Å
584	E	39.9	Very low	32.6	Very low	153 Å²	153	93 Å²	93	72%	0.715	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-11.4	-166.4	-66.8	-173.7	148.6	0	0	115.2	R612	E584-R612 IonicContact OE1-NH2 3.65Å
585	E	37.3	Very low	32.6	Very low	186 Å²	186	94.9 Å²	94.9	87%	0.869	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.6	0.9	-178.9	-63.5	-162.7	152.5	0	0	116	E583	E583-E585 PolarHBondContact O-N 3.34Å
586	N	31.8	Very low	32.4	Very low	123 Å²	123	92.2 Å²	92.2	66%	0.658	50%	0.496	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.3	143.9	174.4	-85.4	-48.7	0	0	0	113.3	E583 V588	E583-N586 PolarHBondContact O-N 3.14Å; N586-V588 PolarHBondContact O-N 3.02Å
587	P	33.6	Very low	32.4	Very low	112 Å²	112	96.3 Å²	96.3	73%	0.727	51%	0.512	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.4	127.3	-172.3	30.2	-34.7	0	0	0	112.9	E589	P587-E589 PolarHBondContact O-N 3.07Å
588	V	29.4	Very low	32.1	Very low	86 Å²	86	101.3 Å²	101.3	52%	0.521	54%	0.538	S	S	.	.	E	Extended strand (participates in β ladder)	trans	0.8	93.5	164.4	-169.5	0	0	0	0	115.8	I580 N586	I580-V588 HydrophobicContact CG2-CG1 3.62Å; N586-V588 PolarHBondContact O-N 3.02Å
589	E	28.9	Very low	31.7	Very low	146 Å²	146	103.4 Å²	103.4	68%	0.682	55%	0.549	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90	134	166	-74.2	-158.6	147.8	0	0	111.5	P587	P587-E589 PolarHBondContact O-N 3.07Å
590	V	31.8	Very low	31.4	Very low	88 Å²	88	106.5 Å²	106.5	53%	0.533	57%	0.57	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-91.6	107.6	174.6	179.1	0	0	0	0	108.4	T592	V590-T592 HydrophobicContact CG1-CG2 4.37Å; V590-T592 PolarHBondContact O-N 2.92Å; V590-T592 VanDerWaalsContact O-N 3.1Å
591	I	27.6	Very low	30.9	Very low	64 Å²	64	113.9 Å²	113.9	33%	0.328	60%	0.6	S	S	.	*			trans	-71.7	106.9	179.5	-54.8	174.8	0	0	0	109
592	T	32.8	Very low	30.7	Very low	77 Å²	77	117.5 Å²	117.5	47%	0.472	62%	0.62	S	S	.	*			trans	-100.6	158.3	169.6	57.4	0	0	0	0	110.2	V590 E594 N595	V590-T592 HydrophobicContact CG1-CG2 4.37Å; V590-T592 PolarHBondContact O-N 2.92Å; V590-T592 VanDerWaalsContact O-N 3.1Å; T592-E594 PolarHBondContact O-N 2.9Å; T592-N595 PolarHBondContact O-N 2.82Å
593	S	34.8	Very low	30.5	Very low	84 Å²	84	117.7 Å²	117.7	59%	0.587	63%	0.63	S	S	*	*	G	3₁₀ helix	trans	-57.1	-24.3	-167.4	51.3	0	0	0	0	115.7	N595 C596	S593-N595 VanDerWaalsContact C-N 3.31Å; S593-N595 PolarHBondContact O-N 2.85Å; S593-C596 PolarHBondContact O-N 3.3Å
594	E	31.3	Very low	30.5	Very low	135 Å²	135	120.4 Å²	120.4	63%	0.631	65%	0.653	S	S	*	*	G	3₁₀ helix	trans	-70.6	-23.7	177.7	-75	165.2	176.8	0	0	112.9	K266 T592	K266-E594 IonicContact NZ-OE1 2.67Å; K266-E594 PolarHBondContact NZ-OE1 3.44Å; K266-E594 IonicContact NZ-OE2 3.43Å; K266-E594 PolarHBondContact NZ-OE2 2.75Å; T592-E594 PolarHBondContact O-N 2.9Å
595	N	30.5	Very low	29.9	Very low	103 Å²	103	119.4 Å²	119.4	55%	0.551	65%	0.653	S	S	*	*	G	3₁₀ helix	trans	-90.7	-3.4	176.5	-73.1	10.5	0	0	0	113.5	T592 S593 V597	T592-N595 PolarHBondContact O-N 2.82Å; S593-N595 VanDerWaalsContact C-N 3.31Å; S593-N595 PolarHBondContact O-N 2.85Å; N595-V597 PolarHBondContact O-N 3.22Å
596	C	28	Very low	29.6	Very low	69 Å²	69	116.4 Å²	116.4	47%	0.466	65%	0.653	S	S	.	*	S	Bend	trans	-73.5	-7.2	-176.3	-71.6	0	0	0	0	115	S593	S593-C596 PolarHBondContact O-N 3.3Å
597	V	30.3	Very low	29.4	Very low	124 Å²	124	116.8 Å²	116.8	75%	0.752	66%	0.659	S	S	*	*	S	Bend	trans	-81.1	-37.1	-178.2	-175.4	0	0	0	0	112	N595	N595-V597 PolarHBondContact O-N 3.22Å
598	D	26.5	Very low	29.2	Very low	146 Å²	146	117 Å²	117	78%	0.781	66%	0.663	S	S	*	*			trans	-105.7	42.6	-175.2	-68.3	-32.7	0	0	0	112.3	P600	D598-P600 VanDerWaalsContact O-CD 3.25Å; D598-P600 WeakPolarHBondContact O-CD 3.31Å
599	M	25.9	Very low	29.2	Very low	138 Å²	138	116.8 Å²	116.8	68%	0.68	67%	0.666	S	S	*	*			trans	-66	114.1	166.4	-139.1	-175.6	-171.2	0	0	107.8	F601	M599-F601 PolarHBondContact O-N 2.85Å; M599-F601 VanDerWaalsContact O-N 3.1Å
600	P	26	Very low	29.3	Very low	93 Å²	93	115.6 Å²	115.6	60%	0.604	66%	0.663	S	S	*	*			trans	-72.5	115	-165.2	25.9	-31.7	0	0	0	110.7	D598 H602	D598-P600 VanDerWaalsContact O-CD 3.25Å; D598-P600 WeakPolarHBondContact O-CD 3.31Å; P600-H602 PolarHBondContact O-N 2.78Å
601	F	24.5	Very low	29.1	Very low	208 Å²	208	113.3 Å²	113.3	91%	0.912	65%	0.651	S	S	*	*			trans	-68.7	59.9	170.8	-78.1	-92.9	0	0	0	111.4	M599 S603	M599-F601 PolarHBondContact O-N 2.85Å; M599-F601 VanDerWaalsContact O-N 3.1Å; F601-S603 PolarHBondContact O-N 3.2Å; F601-S603 VanDerWaalsContact O-N 3.15Å
602	H	26.8	Very low	29.3	Very low	159 Å²	159	115.9 Å²	115.9	74%	0.736	66%	0.656	S	S	*	*			trans	-83.5	94.7	175.3	-77.5	-40.7	0	0	0	111	P600	P600-H602 PolarHBondContact O-N 2.78Å
603	S	28.4	Very low	29.3	Very low	87 Å²	87	115.2 Å²	115.2	61%	0.608	65%	0.649	S	S	*	*			trans	41.1	126.4	140.2	53.1	0	0	0	0	118.5	F601 D605	F601-S603 PolarHBondContact O-N 3.2Å; F601-S603 VanDerWaalsContact O-N 3.15Å; S603-D605 PolarHBondContact O-N 3.11Å
604	T	33.4	Very low	29.3	Very low	147 Å²	147	116.6 Å²	116.6	90%	0.902	64%	0.642	S	S	*	*	S	Bend	trans	-59.2	13.7	-176	46.8	0	0	0	0	118.2
605	D	28.2	Very low	29.3	Very low	132 Å²	132	112.3 Å²	112.3	71%	0.706	62%	0.622	S	S	*	*			trans	-94.4	116.9	-173.6	-69.3	-15.3	0	0	0	111.3	S603 V607	S603-D605 PolarHBondContact O-N 3.11Å; D605-V607 PolarHBondContact O-N 3.35Å; D605-V607 VanDerWaalsContact O-N 3.12Å
606	S	31	Very low	29.5	Very low	124 Å²	124	111.9 Å²	111.9	87%	0.867	61%	0.614	S	S	*	*			trans	-60.3	107.9	-173	55.2	0	0	0	0	113.3
607	V	27	Very low	29.7	Very low	130 Å²	130	109.5 Å²	109.5	79%	0.788	60%	0.599	S	S	*	*			trans	-125.5	122	160.6	-176.1	0	0	0	0	108.5	D605 S609	D605-V607 PolarHBondContact O-N 3.35Å; D605-V607 VanDerWaalsContact O-N 3.12Å; V607-S609 PolarHBondContact O-N 3.33Å; V607-S609 VanDerWaalsContact O-N 3.07Å
608	S	30	Very low	29.8	Very low	117 Å²	117	109.2 Å²	109.2	82%	0.818	59%	0.588	S	S	*	*			trans	-82.2	79.5	-172.9	56.7	0	0	0	0	112.3
609	S	29.5	Very low	30	Very low	82 Å²	82	105.6 Å²	105.6	57%	0.573	57%	0.566	S	S	*	*			trans	-88.9	123	156.4	42.5	0	0	0	0	108.7	V607 S611	V607-S609 PolarHBondContact O-N 3.33Å; V607-S609 VanDerWaalsContact O-N 3.07Å; S609-S611 PolarHBondContact O-N 2.86Å
610	I	30.6	Very low	30.2	Very low	121 Å²	121	104.3 Å²	104.3	62%	0.621	56%	0.561	S	S	*	*			trans	-86.1	69.2	177.9	-52.8	176.9	0	0	0	108.2	R612	I610-R612 PolarHBondContact O-N 3.46Å
611	S	28.1	Very low	30.4	Very low	40 Å²	40	102.2 Å²	102.2	28%	0.28	54%	0.544	S	S	.	.			trans	-65.3	131.8	172.5	42	0	0	0	0	110.3	Y581 E582 S609	Y581-S611 VanDerWaalsContact CZ-CB 3.47Å; Y581-S611 VanDerWaalsContact OH-CB 3.3Å; Y581-S611 WeakPolarHBondContact OH-CB 3.37Å; Y581-S611 PolarHBondContact OH-OG 3.32Å; E582-S611 WeakPolarHBondContact O-CA 3.45Å; S609-S611 PolarHBondContact O-N 2.86Å
612	R	32.2	Very low	30.5	Very low	117 Å²	117	97.1 Å²	97.1	44%	0.442	53%	0.532	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	126.1	-176.1	-63.7	-175	-170.2	160.4	10.7	110	E582 E584 I610 Y614	E582-R612 PolarHBondContact N-O 3.11Å; E582-R612 PolarHBondContact O-N 3.42Å; E584-R612 IonicContact OE1-NH2 3.65Å; I610-R612 PolarHBondContact O-N 3.46Å; R612-Y614 HydrophobicContact CB-CD2 4.35Å; R612-Y614 HydrophobicContact CB-CE2 3.59Å; R612-Y614 WeakPolarHBondContact CD-OH 3.35Å
613	M	31.2	Very low	30.6	Very low	64 Å²	64	94.9 Å²	94.9	32%	0.315	52%	0.52	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	114.9	-178.9	-169.8	-178.9	-167	0	0	109.1	F518 V579 I580 Y581	F518-M613 HydrophobicContact CD1-SD 4.3Å; F518-M613 HydrophobicContact CE1-CE 3.69Å; F518-M613 HydrophobicContact CE1-SD 3.47Å; F518-M613 WeakPolarHBondContact CE1-SD 3.49Å; F518-M613 HydrophobicContact CE2-CE 4.35Å; F518-M613 HydrophobicContact CZ-CE 3.52Å; F518-M613 HydrophobicContact CZ-SD 3.96Å; V579-M613 HydrophobicContact CG1-CE 3.28Å; V579-M613 HydrophobicContact CG1-CG 3.95Å; V579-M613 HydrophobicContact CG1-SD 4.47Å; I580-M613 WeakPolarHBondContact O-CA 3.4Å; Y581-M613 HydrophobicContact CD2-CB 4.25Å; Y581-M613 HydrophobicContact CD2-CG 4.33Å
614	Y	35.2	Very low	30.5	Very low	113 Å²	113	97.8 Å²	97.8	44%	0.443	52%	0.524	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	137	179.8	-64.1	-85.9	0	0	0	110.3	V579 I580 E582 R612	V579-Y614 WeakPolarHBondContact CA-O 3.44Å; I580-Y614 PolarHBondContact N-O 3.43Å; I580-Y614 PolarHBondContact O-N 3.19Å; E582-Y614 HydrophobicContact CB-CE2 4.36Å; E582-Y614 WeakPolarHBondContact OE2-CE2 3.41Å; R612-Y614 HydrophobicContact CB-CD2 4.35Å; R612-Y614 HydrophobicContact CB-CE2 3.59Å; R612-Y614 WeakPolarHBondContact CD-OH 3.35Å
615	I	32.4	Very low	30.2	Very low	44 Å²	44	95.2 Å²	95.2	23%	0.226	51%	0.508	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	111.1	179.6	-54.9	-167.3	0	0	0	108.5	I509 F552 V577	I509-I615 HydrophobicContact CD1-CB 4.47Å; I509-I615 HydrophobicContact CD1-CD1 3.76Å; I509-I615 HydrophobicContact CD1-CG1 3.92Å; F552-I615 HydrophobicContact CE1-CD1 3.97Å; F552-I615 HydrophobicContact CE1-CG2 3.97Å; F552-I615 HydrophobicContact CE2-CD1 4.21Å; F552-I615 HydrophobicContact CZ-CD1 3.42Å; F552-I615 VanDerWaalsContact CZ-CD1 3.42Å; F552-I615 HydrophobicContact CZ-CG2 4.46Å; V577-I615 HydrophobicContact CG1-CG2 3.39Å
616	Y	34.2	Very low	30	Very low	95 Å²	95	94.2 Å²	94.2	37%	0.373	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	123.7	-179.5	176	-94	0	0	0	110	L212 V577 Q578 K618	L212-Y616 WeakPolarHBondContact CD1-OH 3.46Å; V577-Y616 CarbonylContact C-O 3.56Å; V577-Y616 VanDerWaalsContact CA-O 3.25Å; V577-Y616 WeakPolarHBondContact CA-O 3.44Å; Q578-Y616 PolarHBondContact N-O 3.43Å; Q578-Y616 PolarHBondContact O-N 3.23Å; Y616-K618 HydrophobicContact CE1-CG 4.01Å
617	A	32.1	Very low	29.7	Very low	19 Å²	19	98.1 Å²	98.1	16%	0.157	50%	0.5	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	124	176.8	0	0	0	0	0	111.1	L574 V577 Q619 I620	L574-A617 HydrophobicContact CB-CB 3.98Å; L574-A617 HydrophobicContact CD2-CB 4.03Å; L574-A617 HydrophobicContact CG-CB 4.48Å; V577-A617 HydrophobicContact CG2-CB 4.11Å; A617-Q619 PolarHBondContact O-N 3.1Å; A617-I620 HydrophobicContact CB-CG1 4.39Å
618	K	32.6	Very low	29.6	Very low	117 Å²	117	98.4 Å²	98.4	51%	0.509	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	-26	177.2	-78.2	-178.9	175.1	172.8	0	113.8	K575 G576 Y616	K575-K618 PolarHBondContact O-N 3.18Å; G576-K618 PolarHBondContact O-N 3.39Å; Y616-K618 HydrophobicContact CE1-CG 4.01Å
619	Q	31.2	Very low	29.5	Very low	71 Å²	71	95.3 Å²	95.3	33%	0.332	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	136.3	173.5	-163.6	176.4	-7.8	0	0	111.5	K575 A617 I621	K575-Q619 HydrophobicContact CB-CB 4.24Å; K575-Q619 PolarHBondContact N-O 2.88Å; K575-Q619 PolarHBondContact O-N 3.4Å; K575-Q619 VanDerWaalsContact O-N 3.1Å; A617-Q619 PolarHBondContact O-N 3.1Å; Q619-I621 HydrophobicContact CG-CD1 4.37Å; Q619-I621 HydrophobicContact CG-CG1 3.96Å
620	I	29.4	Very low	29.3	Very low	111 Å²	111	98.2 Å²	98.2	57%	0.569	48%	0.479	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.2	120.8	175.6	-53.2	-172.5	0	0	0	107.1	I572 L573 L574 A617	I572-I620 HydrophobicContact CG2-CG2 3.42Å; I572-I620 VanDerWaalsContact CG2-CG2 3.42Å; L573-I620 WeakPolarHBondContact O-CA 3.31Å; L574-I620 HydrophobicContact CD2-CB 4.2Å; L574-I620 HydrophobicContact CD2-CD1 4.16Å; L574-I620 HydrophobicContact CD2-CG1 3.72Å; L574-I620 HydrophobicContact CD2-CG2 3.95Å; A617-I620 HydrophobicContact CB-CG1 4.39Å
621	I	30.6	Very low	29.3	Very low	48 Å²	48	97.4 Å²	97.4	25%	0.246	48%	0.484	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	108.1	-179.7	-45.9	-179.8	0	0	0	109.5	L573 Q619 F623	L573-I621 HydrophobicContact CB-CB 4.36Å; L573-I621 HydrophobicContact CD2-CD1 4.41Å; L573-I621 PolarHBondContact N-O 3.23Å; L573-I621 PolarHBondContact O-N 3.18Å; Q619-I621 HydrophobicContact CG-CD1 4.37Å; Q619-I621 HydrophobicContact CG-CG1 3.96Å; I621-F623 HydrophobicContact CB-CD2 4.48Å; I621-F623 HydrophobicContact CB-CE2 3.83Å; I621-F623 HydrophobicContact CB-CZ 4.39Å; I621-F623 HydrophobicContact CG2-CD2 4.06Å; I621-F623 HydrophobicContact CG2-CE1 4.32Å; I621-F623 HydrophobicContact CG2-CE2 3.39Å; I621-F623 HydrophobicContact CG2-CZ 3.55Å
622	P	26	Very low	29.5	Very low	102 Å²	102	99 Å²	99	66%	0.662	49%	0.489	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.3	137.2	172.8	32	-32.5	0	0	0	110.8	L571	L571-P622 CarbonylContact O-C 3.52Å; L571-P622 WeakPolarHBondContact O-CA 3.47Å
623	F	29.7	Very low	29.3	Very low	112 Å²	112	98.5 Å²	98.5	49%	0.491	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	141.6	175	-69.7	-84.5	0	0	0	111.2	L571 L573 I621	L571-F623 HydrophobicContact CB-CB 4.43Å; L571-F623 PolarHBondContact N-O 3.37Å; L571-F623 PolarHBondContact O-N 3.29Å; L573-F623 HydrophobicContact CB-CE2 4.25Å; I621-F623 HydrophobicContact CB-CD2 4.48Å; I621-F623 HydrophobicContact CB-CE2 3.83Å; I621-F623 HydrophobicContact CB-CZ 4.39Å; I621-F623 HydrophobicContact CG2-CD2 4.06Å; I621-F623 HydrophobicContact CG2-CE1 4.32Å; I621-F623 HydrophobicContact CG2-CE2 3.39Å; I621-F623 HydrophobicContact CG2-CZ 3.55Å
624	Q	26.4	Very low	29.2	Very low	148 Å²	148	101.8 Å²	101.8	69%	0.692	51%	0.512	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.3	119.1	170	-174.4	179.2	-0.8	0	0	107.6	N626	Q624-N626 PolarHBondContact NE2-OD1 3.47Å; Q624-N626 PolarHBondContact O-N 3.01Å
625	V	26.2	Very low	29.1	Very low	93 Å²	93	99.6 Å²	99.6	56%	0.564	52%	0.524	S	S	*	.			trans	-88.2	95.3	179.4	-178.6	0	0	0	0	108.4	Y627	V625-Y627 PolarHBondContact O-N 3.43Å
626	N	23.9	Very low	29.1	Very low	111 Å²	111	102.9 Å²	102.9	59%	0.594	53%	0.534	S	S	*	.			trans	-78.3	117	176.7	-74.1	-15.8	0	0	0	110.5	Q624	Q624-N626 PolarHBondContact NE2-OD1 3.47Å; Q624-N626 PolarHBondContact O-N 3.01Å
627	Y	24.3	Very low	28.9	Very low	206 Å²	206	101.9 Å²	101.9	81%	0.808	55%	0.552	S	S	*	*			trans	52.6	84.7	163.3	-65.1	-82.4	0	0	0	117.7	V625	V625-Y627 PolarHBondContact O-N 3.43Å
628	L	25.7	Very low	28.9	Very low	136 Å²	136	110.5 Å²	110.5	71%	0.712	59%	0.586	S	S	*	*			trans	-80.4	122.9	131.2	-96.2	154.5	0	0	0	106.4	E630	L628-E630 PolarHBondContact O-N 2.91Å
629	S	27.5	Very low	28.8	Very low	52 Å²	52	110.1 Å²	110.1	36%	0.364	59%	0.594	S	S	.	*			trans	-66.3	119.5	-172.6	53	0	0	0	0	112.3	S631 I632	S629-S631 PolarHBondContact O-N 3.47Å; S629-I632 PolarHBondContact O-N 3.28Å; S629-I632 VanDerWaalsContact O-N 3.12Å; S629-I632 WeakPolarHBondContact OG-CD1 3.49Å
630	E	26.5	Very low	28.9	Very low	142 Å²	142	115.2 Å²	115.2	66%	0.664	62%	0.618	S	S	*	*	G	3₁₀ helix	trans	-49.3	-34.4	177.9	-67.7	168.3	139.1	0	0	112.7	L628 I632 M633 D634	L628-E630 PolarHBondContact O-N 2.91Å; E630-I632 PolarHBondContact O-N 3.08Å; E630-M633 PolarHBondContact O-N 2.66Å; E630-D634 PolarHBondContact O-N 3.2Å
631	S	29.6	Very low	29.1	Very low	104 Å²	104	118.8 Å²	118.8	73%	0.727	63%	0.632	S	S	*	*	G	3₁₀ helix	trans	-56.5	-19.9	179.6	58.7	0	0	0	0	115.9	S629	S629-S631 PolarHBondContact O-N 3.47Å
632	I	32.5	Very low	29.3	Very low	75 Å²	75	124.4 Å²	124.4	39%	0.385	66%	0.657	S	S	.	*	G	3₁₀ helix	trans	-89.3	-25.3	178.2	-61.3	178	0	0	0	111.7	S629 E630 M715	S629-I632 PolarHBondContact O-N 3.28Å; S629-I632 VanDerWaalsContact O-N 3.12Å; S629-I632 WeakPolarHBondContact OG-CD1 3.49Å; E630-I632 PolarHBondContact O-N 3.08Å; I632-M715 HydrophobicContact CG2-CE 4.38Å
633	M	28.2	Very low	29.7	Very low	106 Å²	106	127 Å²	127	52%	0.522	66%	0.661	S	S	.	*	T	Hydrogen-bonded Turn	trans	-99.5	-34.1	-171.7	-67.4	-64.7	-178.5	0	0	113.6	E630 G635 Y636 M715	E630-M633 PolarHBondContact O-N 2.66Å; M633-G635 PolarHBondContact O-N 2.77Å; M633-G635 VanDerWaalsContact O-N 3.16Å; M633-Y636 PolarHBondContact O-N 3.47Å; M633-Y636 VanDerWaalsContact O-N 3.14Å; M633-M715 HydrophobicContact CE-CE 4.25Å
634	D	29.3	Very low	30.4	Very low	133 Å²	133	124.6 Å²	124.6	71%	0.711	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.2	-28.2	-179.6	-80.4	-4	0	0	0	113.6	E630 Y636	E630-D634 PolarHBondContact O-N 3.2Å; D634-Y636 PolarHBondContact O-N 3.36Å
635	G	33.2	Very low	31.1	Very low	67 Å²	67	119.5 Å²	119.5	69%	0.691	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.9	-25.5	178.6	0	0	0	0	0	114.3	M633	M633-G635 PolarHBondContact O-N 2.77Å; M633-G635 VanDerWaalsContact O-N 3.16Å
636	Y	31.9	Very low	31.9	Very low	113 Å²	113	115.4 Å²	115.4	44%	0.443	61%	0.607	S	S	.	*	T	Hydrogen-bonded Turn	trans	-103.3	-13.2	-171.4	-77.8	-89.2	0	0	0	114.5	M633 D634 K638 I710	M633-Y636 PolarHBondContact O-N 3.47Å; M633-Y636 VanDerWaalsContact O-N 3.14Å; D634-Y636 PolarHBondContact O-N 3.36Å; Y636-K638 PolarHBondContact O-N 3.13Å; Y636-I710 WeakPolarHBondContact OH-CG2 3.38Å
637	G	29.4	Very low	32.7	Very low	73 Å²	73	110.1 Å²	110.1	75%	0.753	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.5	1.5	-174.5	0	0	0	0	0	116.6
638	K	32.2	Very low	33.7	Very low	200 Å²	200	101.7 Å²	101.7	87%	0.87	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.6	-2.2	-172.2	-77.5	-175.6	177.3	171.8	0	116.4	Y636	Y636-K638 PolarHBondContact O-N 3.13Å
639	T	31.8	Very low	34.3	Very low	110 Å²	110	96.3 Å²	96.3	68%	0.675	52%	0.52	S	S	*	.	S	Bend	trans	-130.4	111.7	-176.7	41.2	0	0	0	0	113.6
640	Q	32.6	Very low	35	Very low	178 Å²	178	94.2 Å²	94.2	83%	0.832	51%	0.505	S	S	*	.			trans	75.7	88.3	159.7	-59.6	-174.4	-8.6	0	0	117.8	Q642	Q640-Q642 VanDerWaalsContact C-N 3.3Å; Q640-Q642 PolarHBondContact O-N 3.48Å
641	E	33.4	Very low	35.5	Very low	186 Å²	186	89.1 Å²	89.1	87%	0.869	48%	0.483	S	S	*	.			trans	-62.8	83	154.5	-63	177.7	136.7	0	0	111.3
642	Q	34.9	Very low	36.1	Very low	166 Å²	166	84.2 Å²	84.2	78%	0.776	45%	0.449	S	S	*	.	S	Bend	trans	-160.9	113.5	162.6	-116.3	150	78.8	0	0	112.3	Q640 Q644	Q640-Q642 VanDerWaalsContact C-N 3.3Å; Q640-Q642 PolarHBondContact O-N 3.48Å; Q642-Q644 PolarHBondContact O-N 3.44Å; Q642-Q644 VanDerWaalsContact O-N 3.07Å
643	Q	35.1	Very low	36.2	Very low	157 Å²	157	85 Å²	85	73%	0.734	45%	0.453	S	S	*	.			trans	13	77.8	163.1	-65.6	-176.5	-29.1	0	0	117.4
644	Q	44.4	Very low	36.6	Very low	61 Å²	61	80.3 Å²	80.3	29%	0.285	43%	0.431	S	S	.	.			trans	-121.3	117.4	168.2	-73.4	-166	-0.8	0	0	112	Q642 C646 N691	Q642-Q644 PolarHBondContact O-N 3.44Å; Q642-Q644 VanDerWaalsContact O-N 3.07Å; Q644-C646 PolarHBondContact O-N 3.24Å; Q644-N691 PolarHBondContact NE2-OD1 3.38Å
645	S	40.3	Very low	36.9	Very low	40 Å²	40	77 Å²	77	28%	0.28	42%	0.418	S	S	.	.			trans	-67.5	124	165.1	58.2	0	0	0	0	109.5	W741	S645-W741 CarbonylContact C-O 3.59Å; S645-W741 WeakPolarHBondContact CA-O 3.3Å
646	C	43.2	Very low	37.2	Very low	7 Å²	7	77 Å²	77	5%	0.047	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	135.9	177.5	155.4	0	0	0	0	110.3	Q644 F687 V740 W741	Q644-C646 PolarHBondContact O-N 3.24Å; C646-F687 HydrophobicContact CB-CE2 4.2Å; C646-F687 HydrophobicContact CB-CZ 3.77Å; C646-F687 WeakPolarHBondContact SG-CE2 3.48Å; C646-F687 WeakPolarHBondContact SG-CZ 3.32Å; C646-V740 CarbonylContact O-C 3.58Å; C646-V740 WeakPolarHBondContact O-CA 3.25Å; C646-W741 HydrophobicContact CB-CB 4.27Å; C646-W741 PolarHBondContact N-O 3.01Å; C646-W741 PolarHBondContact O-N 2.74Å
647	T	40.8	Very low	37.4	Very low	1 Å²	1	74 Å²	74	1%	0.006	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	129.4	169.9	-63.2	0	0	0	0	110.2	V649 I688 N690 Q738 L739	T647-V649 HydrophobicContact CG2-CG2 4.46Å; T647-I688 HydrophobicContact CG2-CB 4.47Å; T647-I688 PolarHBondContact N-O 2.92Å; T647-I688 PolarHBondContact O-N 2.93Å; T647-N690 PolarHBondContact OG1-ND2 2.85Å; T647-Q738 HydrophobicContact CG2-CG 3.45Å; T647-Q738 VanDerWaalsContact CG2-CG 3.45Å; T647-L739 WeakPolarHBondContact CA-O 3.43Å
648	I	44.5	Very low	37.4	Very low	28 Å²	28	75.7 Å²	75.7	14%	0.144	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	126.3	172.2	-52	178.8	0	0	0	108.1	L650 F687 L739	I648-L650 HydrophobicContact CG2-CD2 3.7Å; I648-L650 HydrophobicContact CG2-CG 3.97Å; I648-F687 HydrophobicContact CG1-CD2 4.2Å; I648-L739 PolarHBondContact N-O 3.48Å; I648-L739 PolarHBondContact O-N 3.37Å
649	V	38.9	Very low	37.1	Very low	23 Å²	23	71.2 Å²	71.2	14%	0.139	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	116.2	172.3	-180	0	0	0	0	108.8	T647 G685 K686 I688 Y737 Q738 L766	T647-V649 HydrophobicContact CG2-CG2 4.46Å; V649-G685 CarbonylContact O-C 3.48Å; V649-G685 WeakPolarHBondContact O-CA 3.25Å; V649-K686 PolarHBondContact N-O 2.98Å; V649-K686 PolarHBondContact O-N 3.42Å; V649-I688 HydrophobicContact CG2-CD1 3.65Å; V649-I688 HydrophobicContact CG2-CG1 4.48Å; V649-Y737 CarbonylContact C-O 3.52Å; V649-Y737 WeakPolarHBondContact CA-O 3.47Å; V649-Q738 HydrophobicContact CG2-CG 4.45Å; V649-L766 HydrophobicContact CG1-CD1 3.97Å; V649-L766 HydrophobicContact CG2-CD1 4.33Å
650	L	42.1	Very low	36.9	Very low	9 Å²	9	70.5 Å²	70.5	5%	0.047	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	139.2	-179.3	-64.5	-175.7	0	0	0	111.5	I648 F683 L717 Y737 L739	I648-L650 HydrophobicContact CG2-CD2 3.7Å; I648-L650 HydrophobicContact CG2-CG 3.97Å; L650-F683 HydrophobicContact CB-CB 4.24Å; L650-F683 HydrophobicContact CB-CD1 4.23Å; L650-F683 HydrophobicContact CD1-CB 4.13Å; L650-F683 HydrophobicContact CD1-CD1 4.42Å; L650-F683 HydrophobicContact CD1-CG 4.37Å; L650-F683 HydrophobicContact CD2-CB 4.32Å; L650-F683 HydrophobicContact CG-CB 4.47Å; L650-L717 HydrophobicContact CD1-CD2 3.97Å; L650-Y737 PolarHBondContact N-O 3.28Å; L650-Y737 PolarHBondContact O-N 3.39Å; L650-L739 HydrophobicContact CB-CD1 4.23Å; L650-L739 HydrophobicContact CD1-CD1 3.65Å; L650-L739 HydrophobicContact CG-CD1 3.83Å
651	V	36.7	Very low	36.6	Very low	34 Å²	34	67.4 Å²	67.4	21%	0.206	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	127.8	167.9	-176.7	0	0	0	0	108.6	L653 F683 A684 H736	V651-L653 HydrophobicContact CG1-CD2 4.39Å; V651-L653 PolarHBondContact O-N 2.82Å; V651-F683 VanDerWaalsContact O-CA 3.3Å; V651-F683 WeakPolarHBondContact O-CA 3.48Å; V651-A684 PolarHBondContact N-O 2.83Å; V651-A684 PolarHBondContact O-N 3.23Å; V651-H736 VanDerWaalsContact CG2-CD2 3.5Å; V651-H736 WeakPolarHBondContact CG2-CD2 3.24Å; V651-H736 WeakPolarHBondContact CG2-NE2 3.38Å
652	N	42.2	Very low	36.3	Very low	2 Å²	2	67.3 Å²	67.3	1%	0.011	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	117.5	177.3	-173.3	1	0	0	0	110.9	G654 Y681 F683 F731 G734	N652-G654 PolarHBondContact OD1-N 2.97Å; N652-Y681 VanDerWaalsContact OD1-CD1 3.28Å; N652-Y681 WeakPolarHBondContact OD1-CD1 3.49Å; N652-Y681 WeakPolarHBondContact OD1-CE1 3.34Å; N652-F683 HydrophobicContact CB-CD1 3.83Å; N652-F683 HydrophobicContact CB-CE1 3.53Å; N652-F683 HydrophobicContact CB-CZ 4.3Å; N652-F731 PolarHBondContact ND2-O 2.96Å; N652-G734 PolarHBondContact O-N 3.29Å
653	L	34.4	Very low	36	Very low	92 Å²	92	63.4 Å²	63.4	48%	0.482	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	-15.3	-175.8	-58.9	-176.1	0	0	0	114.4	V651 V682 A684	V651-L653 HydrophobicContact CG1-CD2 4.39Å; V651-L653 PolarHBondContact O-N 2.82Å; L653-V682 WeakPolarHBondContact CB-O 3.47Å; L653-V682 HydrophobicContact CD1-CG1 4.13Å; L653-V682 PolarHBondContact N-O 3.49Å; L653-A684 HydrophobicContact CD1-CB 3.8Å; L653-A684 HydrophobicContact CG-CB 4.28Å
654	G	37.9	Very low	35.5	Very low	6 Å²	6	62 Å²	62	6%	0.062	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	107.1	-174.6	-179.3	0	0	0	0	0	115.4	N652 Y681 V682	N652-G654 PolarHBondContact OD1-N 2.97Å; G654-Y681 VanDerWaalsContact O-CD1 3.29Å; G654-Y681 WeakPolarHBondContact O-CD1 3.03Å; G654-V682 PolarHBondContact O-N 2.97Å
655	P	36.1	Very low	34.6	Very low	65 Å²	65	64.4 Å²	64.4	42%	0.422	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	137.2	-177.5	30.3	-30.5	0	0	0	111.7	S680 Y681	P655-S680 WeakPolarHBondContact CA-O 3.35Å; P655-Y681 HydrophobicContact CB-CD2 4.01Å; P655-Y681 HydrophobicContact CB-CE2 3.61Å; P655-Y681 WeakPolarHBondContact CD-OH 3.15Å; P655-Y681 HydrophobicContact CG-CE2 4.23Å
656	L	38.5	Very low	33.9	Very low	66 Å²	66	68.6 Å²	68.6	35%	0.346	43%	0.425	S	S	.	.	S	Bend	trans	-73.3	-41	-180	-98.1	168.8	0	0	0	113.1	S680 V682 C799	L656-S680 WeakPolarHBondContact CB-OG 3.07Å; L656-S680 PolarHBondContact N-O 2.88Å; L656-V682 HydrophobicContact CD1-CG2 3.39Å; L656-V682 HydrophobicContact CD2-CG2 4.23Å; L656-V682 HydrophobicContact CG-CG2 3.65Å; L656-C799 HydrophobicContact CD2-CB 4.13Å
657	S	36.1	Very low	33.2	Very low	51 Å²	51	74.3 Å²	74.3	36%	0.357	46%	0.461	S	S	.	.			trans	-163	146.9	173.4	62.1	0	0	0	0	113.4	C659	S657-C659 PolarHBondContact OG-SG 2.87Å
658	C	28.5	Very low	32.7	Very low	108 Å²	108	80 Å²	80	73%	0.73	50%	0.497	S	S	*	.			trans	-104.8	86.7	151	-65.8	0	0	0	0	106.6	S660	C658-S660 PolarHBondContact O-N 3.05Å
659	C	27.6	Very low	31.8	Very low	106 Å²	106	86.2 Å²	86.2	72%	0.716	53%	0.525	S	S	*	.			trans	-61.8	102.7	-176.1	-69.3	0	0	0	0	112	S657	S657-C659 PolarHBondContact OG-SG 2.87Å
660	S	26.8	Very low	31.3	Very low	95 Å²	95	97.5 Å²	97.5	66%	0.664	57%	0.565	S	S	*	*			trans	-66.5	130.4	152.2	49.6	0	0	0	0	108.4	C658 E662	C658-S660 PolarHBondContact O-N 3.05Å; S660-E662 VanDerWaalsContact C-N 3.31Å; S660-E662 PolarHBondContact O-N 3.41Å
661	P	27.2	Very low	30.5	Very low	112 Å²	112	101.2 Å²	101.2	73%	0.727	59%	0.591	S	S	*	*	S	Bend	trans	-79	77.6	-173.3	32.4	-36	0	0	0	111.5
662	E	26.6	Very low	30	Very low	185 Å²	185	105.6 Å²	105.6	86%	0.864	62%	0.624	S	S	*	*			trans	-125.8	81.9	168.6	-73.1	-167.3	164.2	0	0	110.6	S660	S660-E662 VanDerWaalsContact C-N 3.31Å; S660-E662 PolarHBondContact O-N 3.41Å
663	A	27.4	Very low	29.3	Very low	84 Å²	84	109.8 Å²	109.8	69%	0.694	65%	0.653	S	S	*	*			trans	-141.1	102.4	154.1	0	0	0	0	0	106.9	V665	A663-V665 VanDerWaalsContact C-N 3.28Å; A663-V665 PolarHBondContact O-N 3.06Å
664	S	25	Very low	29	Very low	128 Å²	128	110.2 Å²	110.2	90%	0.895	66%	0.664	S	S	*	*			trans	-71.2	85.1	174.7	53.8	0	0	0	0	109.5
665	V	25.2	Very low	28.4	Very low	110 Å²	110	117.1 Å²	117.1	67%	0.667	70%	0.699	S	S	*	*			trans	-79.7	127.3	167.9	-177.4	0	0	0	0	107.9	A663	A663-V665 VanDerWaalsContact C-N 3.28Å; A663-V665 PolarHBondContact O-N 3.06Å
666	D	25.9	Very low	28.2	Very low	129 Å²	129	122 Å²	122	69%	0.69	71%	0.714	S	S	*	*			trans	-56.6	131.1	-178	-121.5	-32.5	0	0	0	110.5	T668	D666-T668 PolarHBondContact O-N 2.98Å
667	P	29.8	Very low	27.8	Very low	126 Å²	126	126.9 Å²	126.9	82%	0.818	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	16.7	-164.7	30.7	-36.5	0	0	0	115.1
668	T	28.8	Very low	27.6	Very low	122 Å²	122	129.8 Å²	129.8	75%	0.748	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.5	-16.7	179.3	45.3	0	0	0	0	114.5	D666	D666-T668 PolarHBondContact O-N 2.98Å
669	E	26.5	Very low	27.8	Very low	157 Å²	157	130 Å²	130	73%	0.734	74%	0.736	S	S	*	*	S	Bend	trans	-97.1	109.6	175.8	-68.6	-161.9	157.3	0	0	112.1	S671	E669-S671 VanDerWaalsContact C-N 3.31Å; E669-S671 PolarHBondContact O-N 2.83Å
670	R	27.3	Very low	28.2	Very low	261 Å²	261	125.7 Å²	125.7	99%	0.985	71%	0.707	S	S	*	*			trans	-68.2	81.2	178.1	-68.4	177.9	174.2	174.8	-2.4	111.5
671	S	26.1	Very low	29	Very low	86 Å²	86	121.4 Å²	121.4	60%	0.601	68%	0.676	S	S	*	*			trans	-117	123.9	168	61.7	0	0	0	0	110.9	E669 S673	E669-S671 VanDerWaalsContact C-N 3.31Å; E669-S671 PolarHBondContact O-N 2.83Å; S671-S673 VanDerWaalsContact C-N 3.34Å; S671-S673 PolarHBondContact O-N 2.85Å
672	S	26	Very low	29.6	Very low	126 Å²	126	117.2 Å²	117.2	88%	0.881	65%	0.649	S	S	*	*			trans	-80.5	73	-173.6	43.5	0	0	0	0	112.2	S674	S672-S674 PolarHBondContact O-N 3.47Å
673	S	28.2	Very low	30.3	Very low	90 Å²	90	108.5 Å²	108.5	63%	0.629	61%	0.608	S	S	*	*			trans	-73.6	83.8	176	47.2	0	0	0	0	112.1	S671 N675	S671-S673 VanDerWaalsContact C-N 3.34Å; S671-S673 PolarHBondContact O-N 2.85Å; S673-N675 PolarHBondContact O-N 2.9Å
674	S	27.2	Very low	30.8	Very low	101 Å²	101	105.2 Å²	105.2	71%	0.706	58%	0.581	S	S	*	*			trans	-69.5	97.4	169.6	66.5	0	0	0	0	110.4	S672 K676	S672-S674 PolarHBondContact O-N 3.47Å; S674-K676 VanDerWaalsContact C-N 3.31Å; S674-K676 PolarHBondContact O-N 3.32Å
675	N	26.6	Very low	31.7	Very low	151 Å²	151	99.6 Å²	99.6	81%	0.807	54%	0.543	S	S	*	.			trans	-68.3	79.2	-178.7	-77.6	-31.6	0	0	0	112.3	S673	S673-N675 PolarHBondContact O-N 2.9Å
676	K	30.2	Very low	32.6	Very low	168 Å²	168	98.8 Å²	98.8	73%	0.73	53%	0.531	S	S	*	.			trans	-88	134.9	164	-76.3	-179.1	177.4	173.3	0	110	S674 L678	S674-K676 VanDerWaalsContact C-N 3.31Å; S674-K676 PolarHBondContact O-N 3.32Å; K676-L678 PolarHBondContact O-N 3.02Å
677	L	30.3	Very low	33.3	Very low	168 Å²	168	95.8 Å²	95.8	88%	0.88	51%	0.512	S	S	*	.			trans	-59.8	92.3	174.9	-76.1	156.3	0	0	0	111.1	W679	L677-W679 PolarHBondContact O-N 2.92Å
678	L	32.9	Very low	34	Very low	113 Å²	113	93.1 Å²	93.1	59%	0.592	49%	0.49	S	S	*	.			trans	-91.3	92.2	177.5	-82.5	157.8	0	0	0	110.3	K676 S680	K676-L678 PolarHBondContact O-N 3.02Å; L678-S680 PolarHBondContact O-N 3.3Å
679	W	32.9	Very low	34.7	Very low	112 Å²	112	92.1 Å²	92.1	42%	0.424	48%	0.477	S	S	.	.			trans	-59.3	128	161.5	-68.6	82.2	0	0	0	108.6	L677 T720 G721 A724	L677-W679 PolarHBondContact O-N 2.92Å; W679-T720 CarbonylContact O-C 3.47Å; W679-T720 VanDerWaalsContact O-CA 3.23Å; W679-T720 WeakPolarHBondContact O-CA 3.5Å; W679-G721 PolarHBondContact O-N 3.49Å; W679-A724 HydrophobicContact CB-CB 4.37Å
680	S	35	Very low	35.4	Very low	16 Å²	16	87.5 Å²	87.5	11%	0.112	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	138.8	-178.9	49.4	0	0	0	0	110.7	P655 L656 L678 L719	P655-S680 WeakPolarHBondContact CA-O 3.35Å; L656-S680 WeakPolarHBondContact CB-OG 3.07Å; L656-S680 PolarHBondContact N-O 2.88Å; L678-S680 PolarHBondContact O-N 3.3Å; S680-L719 CarbonylContact C-O 3.58Å; S680-L719 VanDerWaalsContact CA-O 3.31Å; S680-L719 WeakPolarHBondContact CA-O 3.37Å
681	Y	43.3	Very low	35.6	Very low	5 Å²	5	80.2 Å²	80.2	2%	0.02	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	146.1	-173	-119.3	-95.9	0	0	0	110.3	N652 G654 P655 S718 L719 Y728 I733	N652-Y681 VanDerWaalsContact OD1-CD1 3.28Å; N652-Y681 WeakPolarHBondContact OD1-CD1 3.49Å; N652-Y681 WeakPolarHBondContact OD1-CE1 3.34Å; G654-Y681 VanDerWaalsContact O-CD1 3.29Å; G654-Y681 WeakPolarHBondContact O-CD1 3.03Å; P655-Y681 HydrophobicContact CB-CD2 4.01Å; P655-Y681 HydrophobicContact CB-CE2 3.61Å; P655-Y681 WeakPolarHBondContact CD-OH 3.15Å; P655-Y681 HydrophobicContact CG-CE2 4.23Å; Y681-S718 CarbonylContact O-C 3.54Å; Y681-S718 WeakPolarHBondContact O-CA 3.46Å; Y681-L719 PolarHBondContact N-O 2.73Å; Y681-L719 PolarHBondContact O-N 2.92Å; Y681-Y728 AromaticContact CE2-CD2 3.95Å; Y681-Y728 HydrophobicContact CE2-CD2 3.95Å; Y681-Y728 HydrophobicContact CE2-CG 4.46Å; Y681-Y728 AromaticContact CZ-CD2 3.81Å; Y681-Y728 VanDerWaalsContact OH-CD2 3.28Å; Y681-Y728 WeakPolarHBondContact OH-CD2 3.41Å; Y681-I733 WeakPolarHBondContact OH-CD1 3.35Å
682	V	40.6	Very low	35.8	Very low	24 Å²	24	81.4 Å²	81.4	15%	0.145	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	136.6	179.4	-180	0	0	0	0	111.7	L653 G654 L656 L717	L653-V682 WeakPolarHBondContact CB-O 3.47Å; L653-V682 HydrophobicContact CD1-CG1 4.13Å; L653-V682 PolarHBondContact N-O 3.49Å; G654-V682 PolarHBondContact O-N 2.97Å; L656-V682 HydrophobicContact CD1-CG2 3.39Å; L656-V682 HydrophobicContact CD2-CG2 4.23Å; L656-V682 HydrophobicContact CG-CG2 3.65Å; V682-L717 WeakPolarHBondContact CA-O 3.42Å
683	F	41.9	Very low	35.8	Very low	1 Å²	1	80.9 Å²	80.9	0%	0.004	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	141	164.9	-60.6	-103.9	0	0	0	108.7	L650 V651 N652 H716 L717 L719 W727 F731	L650-F683 HydrophobicContact CB-CB 4.24Å; L650-F683 HydrophobicContact CB-CD1 4.23Å; L650-F683 HydrophobicContact CD1-CB 4.13Å; L650-F683 HydrophobicContact CD1-CD1 4.42Å; L650-F683 HydrophobicContact CD1-CG 4.37Å; L650-F683 HydrophobicContact CD2-CB 4.32Å; L650-F683 HydrophobicContact CG-CB 4.47Å; V651-F683 VanDerWaalsContact O-CA 3.3Å; V651-F683 WeakPolarHBondContact O-CA 3.48Å; N652-F683 HydrophobicContact CB-CD1 3.83Å; N652-F683 HydrophobicContact CB-CE1 3.53Å; N652-F683 HydrophobicContact CB-CZ 4.3Å; F683-H716 WeakPolarHBondContact O-CA 3.33Å; F683-L717 HydrophobicContact CB-CB 4.32Å; F683-L717 PolarHBondContact N-O 3.48Å; F683-L717 PolarHBondContact O-N 3.12Å; F683-L719 HydrophobicContact CD2-CD1 4.44Å; F683-L719 HydrophobicContact CE2-CD1 3.91Å; F683-L719 HydrophobicContact CE2-CG 4.45Å; F683-W727 HydrophobicContact CE1-CE3 4.35Å; F683-W727 AromaticContact CE2-CE3 3.95Å; F683-W727 HydrophobicContact CE2-CE3 3.95Å; F683-W727 AromaticContact CZ-CE3 3.71Å; F683-W727 HydrophobicContact CZ-CE3 3.71Å; F683-W727 HydrophobicContact CZ-CZ3 4.34Å; F683-F731 HydrophobicContact CE1-CB 4.15Å; F683-F731 HydrophobicContact CE1-CD1 4.37Å; F683-F731 HydrophobicContact CE1-CG 4.35Å; F683-F731 HydrophobicContact CZ-CB 4.19Å; F683-F731 HydrophobicContact CZ-CG 4.43Å
684	A	38.2	Very low	35.7	Very low	15 Å²	15	81.2 Å²	81.2	12%	0.124	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	142.6	170.1	0	0	0	0	0	109.4	V651 L653 L714 M715	V651-A684 PolarHBondContact N-O 2.83Å; V651-A684 PolarHBondContact O-N 3.23Å; L653-A684 HydrophobicContact CD1-CB 3.8Å; L653-A684 HydrophobicContact CG-CB 4.28Å; A684-L714 HydrophobicContact CB-CD2 4.21Å; A684-M715 CarbonylContact C-O 3.59Å; A684-M715 WeakPolarHBondContact CA-O 3.2Å
685	G	42.5	Very low	35.7	Very low	11 Å²	11	84.2 Å²	84.2	11%	0.113	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.2	-177.5	-173.1	0	0	0	0	0	116.3	V649 L714 M715	V649-G685 CarbonylContact O-C 3.48Å; V649-G685 WeakPolarHBondContact O-CA 3.25Å; G685-L714 CarbonylContact O-C 3.49Å; G685-L714 WeakPolarHBondContact O-CA 3.36Å; G685-M715 PolarHBondContact N-O 3.48Å; G685-M715 PolarHBondContact O-N 2.76Å
686	K	43.8	Very low	35.6	Very low	92 Å²	92	79.8 Å²	79.8	40%	0.4	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	137.7	-177	171.1	166.1	171.1	149.9	0	110.5	V649 S712	V649-K686 PolarHBondContact N-O 2.98Å; V649-K686 PolarHBondContact O-N 3.42Å; K686-S712 VanDerWaalsContact CD-OG 3.22Å; K686-S712 WeakPolarHBondContact CD-OG 3.41Å; K686-S712 VanDerWaalsContact CE-CB 3.49Å; K686-S712 WeakPolarHBondContact CE-OG 3.31Å; K686-S712 PolarHBondContact NZ-OG 2.82Å
687	F	41.9	Very low	35.4	Very low	67 Å²	67	79.7 Å²	79.7	29%	0.294	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	135.6	168.6	-160.7	-81.3	0	0	0	109.7	C646 I648 E689	C646-F687 HydrophobicContact CB-CE2 4.2Å; C646-F687 HydrophobicContact CB-CZ 3.77Å; C646-F687 WeakPolarHBondContact SG-CE2 3.48Å; C646-F687 WeakPolarHBondContact SG-CZ 3.32Å; I648-F687 HydrophobicContact CG1-CD2 4.2Å; F687-E689 HydrophobicContact CD1-CG 4.11Å; F687-E689 HydrophobicContact CE1-CG 3.72Å
688	I	44.5	Very low	35.3	Very low	70 Å²	70	76 Å²	76	36%	0.359	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	111	174.7	-55.2	-179.4	0	0	0	107.5	T647 V649 N690	T647-I688 HydrophobicContact CG2-CB 4.47Å; T647-I688 PolarHBondContact N-O 2.92Å; T647-I688 PolarHBondContact O-N 2.93Å; V649-I688 HydrophobicContact CG2-CD1 3.65Å; V649-I688 HydrophobicContact CG2-CG1 4.48Å; I688-N690 PolarHBondContact O-N 3.42Å
689	E	43.9	Very low	35.2	Very low	100 Å²	100	77.7 Å²	77.7	47%	0.467	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	115.6	166.5	-76.9	-176.4	163.4	0	0	109.4	F687 N691	F687-E689 HydrophobicContact CD1-CG 4.11Å; F687-E689 HydrophobicContact CE1-CG 3.72Å; E689-N691 PolarHBondContact O-N 3.41Å
690	N	39.8	Very low	35	Very low	61 Å²	61	78.5 Å²	78.5	33%	0.326	47%	0.466	S	S	.	.			trans	-76.6	82.1	165.9	-76.1	-16.2	0	0	0	108.4	T647 I688 T692	T647-N690 PolarHBondContact OG1-ND2 2.85Å; I688-N690 PolarHBondContact O-N 3.42Å; N690-T692 PolarHBondContact O-N 2.94Å
691	N	32.9	Very low	34.6	Very low	108 Å²	108	84.8 Å²	84.8	58%	0.578	50%	0.504	S	S	*	.			trans	-67.2	79.7	165.9	-85.2	-36.7	0	0	0	109.3	Q644 E689 V693	Q644-N691 PolarHBondContact NE2-OD1 3.38Å; E689-N691 PolarHBondContact O-N 3.41Å; N691-V693 PolarHBondContact O-N 3.25Å
692	T	29.2	Very low	33.8	Very low	110 Å²	110	90.2 Å²	90.2	68%	0.675	54%	0.537	S	S	*	.			trans	-66	98.2	172.2	44.5	0	0	0	0	108.9	N690 A694	N690-T692 PolarHBondContact O-N 2.94Å; T692-A694 PolarHBondContact O-N 2.95Å; T692-A694 VanDerWaalsContact O-N 3.12Å
693	V	25.9	Very low	33.1	Very low	116 Å²	116	93.5 Å²	93.5	70%	0.703	57%	0.567	S	S	*	*			trans	-28.1	109.2	174.7	-174.8	0	0	0	0	112.1	N691 I695	N691-V693 PolarHBondContact O-N 3.25Å; V693-I695 VanDerWaalsContact C-N 3.3Å; V693-I695 HydrophobicContact CB-CG1 4.36Å; V693-I695 HydrophobicContact CG1-CG1 3.75Å; V693-I695 PolarHBondContact O-N 2.92Å
694	A	26.7	Very low	32.1	Very low	97 Å²	97	103.9 Å²	103.9	80%	0.802	61%	0.612	S	S	*	*			trans	-66.2	95.4	159.9	0	0	0	0	0	107.5	T692 G696	T692-A694 PolarHBondContact O-N 2.95Å; T692-A694 VanDerWaalsContact O-N 3.12Å; A694-G696 PolarHBondContact O-N 3.04Å
695	I	26.3	Very low	31.5	Very low	164 Å²	164	110.6 Å²	110.6	84%	0.841	65%	0.646	S	S	*	*			trans	-71.6	79.4	172.4	-57.3	177	0	0	0	107	V693	V693-I695 VanDerWaalsContact C-N 3.3Å; V693-I695 HydrophobicContact CB-CG1 4.36Å; V693-I695 HydrophobicContact CG1-CG1 3.75Å; V693-I695 PolarHBondContact O-N 2.92Å
696	G	24.8	Very low	30.7	Very low	58 Å²	58	117.5 Å²	117.5	60%	0.598	68%	0.68	S	S	*	*			trans	-128.6	69.9	-169	0	0	0	0	0	112	A694	A694-G696 PolarHBondContact O-N 3.04Å
697	N	26.8	Very low	29.8	Very low	166 Å²	166	116.9 Å²	116.9	89%	0.888	70%	0.7	S	S	*	*			trans	67.1	140.9	171.4	-60.8	-23.1	0	0	0	117.8
698	A	27.4	Very low	29	Very low	89 Å²	89	118 Å²	118	74%	0.736	72%	0.716	S	S	*	*	S	Bend	trans	-72.1	175.7	175.7	0	0	0	0	0	112.1
699	D	30.6	Very low	28.1	Very low	150 Å²	150	119.6 Å²	119.6	80%	0.802	73%	0.734	S	S	*	*			trans	76.3	65	173	-53	-21.3	0	0	0	116.8
700	T	28.4	Very low	27.4	Very low	129 Å²	129	120.2 Å²	120.2	79%	0.791	74%	0.739	S	S	*	*			trans	-159.1	72.5	142	7.8	0	0	0	0	111.8	T702	T700-T702 PolarHBondContact O-N 3.46Å
701	T	27.9	Very low	26.9	Very low	148 Å²	148	122.5 Å²	122.5	91%	0.908	75%	0.751	S	S	*	*			trans	-75.6	67.9	173.2	49.7	0	0	0	0	112.5
702	T	26	Very low	27	Very low	119 Å²	119	119.4 Å²	119.4	73%	0.73	74%	0.738	S	S	*	*			trans	-154.9	135.8	166.1	41.4	0	0	0	0	111.4	T700	T700-T702 PolarHBondContact O-N 3.46Å
703	A	25.2	Very low	27.4	Very low	92 Å²	92	119.1 Å²	119.1	76%	0.76	73%	0.733	S	S	*	*			trans	77	58.2	166.4	0	0	0	0	0	119.3
704	F	22.3	Very low	27.8	Very low	219 Å²	219	118.7 Å²	118.7	96%	0.961	73%	0.726	S	S	*	*			trans	-111	35.1	149.5	-98	-75.8	0	0	0	112.2
705	N	24.7	Very low	28.3	Very low	156 Å²	156	116.4 Å²	116.4	83%	0.834	70%	0.699	S	S	*	*			trans	-105.2	19.9	-177	-111.8	17.9	0	0	0	114.3
706	N	25.3	Very low	28.9	Very low	156 Å²	156	114.8 Å²	114.8	83%	0.834	69%	0.687	S	S	*	*			trans	-102.2	71.6	172.9	-83.7	2.6	0	0	0	111.5	S708	N706-S708 PolarHBondContact O-N 2.96Å
707	G	25.7	Very low	29.7	Very low	79 Å²	79	114.8 Å²	114.8	81%	0.814	67%	0.673	S	S	*	*				58.5	-6.2	113.4	0	0	0	0	0	121.8	S709	G707-S709 VanDerWaalsContact C-N 3.3Å; G707-S709 PolarHBondContact O-N 3.11Å
708	S	23.6	Very low	30.3	Very low	91 Å²	91	110.9 Å²	110.9	64%	0.636	66%	0.659	S	S	*	*			trans	-87.4	73.5	169	64.3	0	0	0	0	109.5	N706 I710	N706-S708 PolarHBondContact O-N 2.96Å; S708-I710 PolarHBondContact O-N 2.96Å
709	S	25.9	Very low	30.9	Very low	103 Å²	103	107.5 Å²	107.5	72%	0.72	63%	0.629	S	S	*	*			trans	-65.8	85.1	155.1	53.9	0	0	0	0	106.8	G707 D711	G707-S709 VanDerWaalsContact C-N 3.3Å; G707-S709 PolarHBondContact O-N 3.11Å; S709-D711 PolarHBondContact O-N 2.83Å
710	I	28.9	Very low	31.2	Very low	114 Å²	114	104.4 Å²	104.4	59%	0.585	62%	0.615	S	S	*	*			trans	-62.7	105.8	177.2	-65	170.6	0	0	0	105.7	Y636 S708 S712	Y636-I710 WeakPolarHBondContact OH-CG2 3.38Å; S708-I710 PolarHBondContact O-N 2.96Å; I710-S712 PolarHBondContact O-N 3.21Å
711	D	30.3	Very low	31.7	Very low	108 Å²	108	99.2 Å²	99.2	58%	0.578	59%	0.587	S	S	*	*			trans	-54.7	113.9	177.4	-85.8	-52.8	0	0	0	107.6	S709 N713	S709-D711 PolarHBondContact O-N 2.83Å; D711-N713 VanDerWaalsContact C-N 3.28Å; D711-N713 PolarHBondContact O-N 2.89Å; D711-N713 PolarHBondContact O-OD1 2.87Å
712	S	34.9	Very low	32.2	Very low	43 Å²	43	98.5 Å²	98.5	30%	0.301	58%	0.578	S	S	.	*			trans	-71.5	89.2	-174.2	56.8	0	0	0	0	108.2	K686 I710 L714	K686-S712 VanDerWaalsContact CD-OG 3.22Å; K686-S712 WeakPolarHBondContact CD-OG 3.41Å; K686-S712 VanDerWaalsContact CE-CB 3.49Å; K686-S712 WeakPolarHBondContact CE-OG 3.31Å; K686-S712 PolarHBondContact NZ-OG 2.82Å; I710-S712 PolarHBondContact O-N 3.21Å; S712-L714 PolarHBondContact O-N 2.84Å
713	N	38.5	Very low	32.7	Very low	105 Å²	105	97.3 Å²	97.3	56%	0.561	57%	0.567	S	S	*	*			trans	-44.8	125.5	-172.8	-73.9	-25	0	0	0	111.3	D711 M715	D711-N713 VanDerWaalsContact C-N 3.28Å; D711-N713 PolarHBondContact O-N 2.89Å; D711-N713 PolarHBondContact O-OD1 2.87Å; N713-M715 PolarHBondContact O-N 2.86Å
714	L	32.4	Very low	33.4	Very low	107 Å²	107	93 Å²	93	56%	0.56	53%	0.531	S	S	*	.			trans	-68.5	106.3	-178.5	-165.5	142.7	0	0	0	108.1	A684 G685 S712 H716	A684-L714 HydrophobicContact CB-CD2 4.21Å; G685-L714 CarbonylContact O-C 3.49Å; G685-L714 WeakPolarHBondContact O-CA 3.36Å; S712-L714 PolarHBondContact O-N 2.84Å; L714-H716 VanDerWaalsContact CD2-NE2 3.26Å; L714-H716 WeakPolarHBondContact CD2-NE2 3.49Å
715	M	38.4	Very low	34.2	Very low	48 Å²	48	88.3 Å²	88.3	24%	0.236	51%	0.508	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	124.7	-177.9	-97.3	-169.2	164	0	0	110	I632 M633 A684 G685 N713	I632-M715 HydrophobicContact CG2-CE 4.38Å; M633-M715 HydrophobicContact CE-CE 4.25Å; A684-M715 CarbonylContact C-O 3.59Å; A684-M715 WeakPolarHBondContact CA-O 3.2Å; G685-M715 PolarHBondContact N-O 3.48Å; G685-M715 PolarHBondContact O-N 2.76Å; N713-M715 PolarHBondContact O-N 2.86Å
716	H	38.8	Very low	34.8	Very low	130 Å²	130	88.8 Å²	88.8	60%	0.602	50%	0.498	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.6	121.6	166.4	-74.1	-69	0	0	0	110.1	F683 L714	F683-H716 WeakPolarHBondContact O-CA 3.33Å; L714-H716 VanDerWaalsContact CD2-NE2 3.26Å; L714-H716 WeakPolarHBondContact CD2-NE2 3.49Å
717	L	41.7	Very low	35.6	Very low	58 Å²	58	84.2 Å²	84.2	30%	0.304	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	110.3	174.6	175.5	70.2	0	0	0	108.9	L650 V682 F683 L719	L650-L717 HydrophobicContact CD1-CD2 3.97Å; V682-L717 WeakPolarHBondContact CA-O 3.42Å; F683-L717 HydrophobicContact CB-CB 4.32Å; F683-L717 PolarHBondContact N-O 3.48Å; F683-L717 PolarHBondContact O-N 3.12Å; L717-L719 HydrophobicContact CD1-CD2 3.99Å; L717-L719 HydrophobicContact CD2-CD2 4.17Å; L717-L719 HydrophobicContact CG-CD2 3.93Å; L717-L719 HydrophobicContact CG-CG 4.34Å
718	S	39.7	Very low	36.5	Very low	84 Å²	84	86.2 Å²	86.2	59%	0.587	45%	0.453	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.3	120.3	173.6	52.3	0	0	0	0	110.8	Y681	Y681-S718 CarbonylContact O-C 3.54Å; Y681-S718 WeakPolarHBondContact O-CA 3.46Å
719	L	38.9	Very low	37.4	Very low	18 Å²	18	90.9 Å²	90.9	9%	0.094	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	140.9	175.7	-57.6	-175.1	0	0	0	109.7	S680 Y681 F683 L717 L723 A724 W727	S680-L719 CarbonylContact C-O 3.58Å; S680-L719 VanDerWaalsContact CA-O 3.31Å; S680-L719 WeakPolarHBondContact CA-O 3.37Å; Y681-L719 PolarHBondContact N-O 2.73Å; Y681-L719 PolarHBondContact O-N 2.92Å; F683-L719 HydrophobicContact CD2-CD1 4.44Å; F683-L719 HydrophobicContact CE2-CD1 3.91Å; F683-L719 HydrophobicContact CE2-CG 4.45Å; L717-L719 HydrophobicContact CD1-CD2 3.99Å; L717-L719 HydrophobicContact CD2-CD2 4.17Å; L717-L719 HydrophobicContact CG-CD2 3.93Å; L717-L719 HydrophobicContact CG-CG 4.34Å; L719-L723 HydrophobicContact CD1-CD2 4.33Å; L719-L723 HydrophobicContact CD2-CD2 4.06Å; L719-A724 HydrophobicContact CB-CB 4.27Å; L719-W727 HydrophobicContact CD1-CB 4.21Å; L719-W727 HydrophobicContact CD1-CD2 3.55Å; L719-W727 HydrophobicContact CD1-CE3 3.61Å; L719-W727 HydrophobicContact CD1-CG 3.82Å; L719-W727 HydrophobicContact CD1-CZ3 4.19Å
720	T	37.8	Very low	38.1	Very low	85 Å²	85	91 Å²	91	52%	0.521	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	157.6	177.5	62.8	0	0	0	0	113.2	W679	W679-T720 CarbonylContact O-C 3.47Å; W679-T720 VanDerWaalsContact O-CA 3.23Å; W679-T720 WeakPolarHBondContact O-CA 3.5Å
721	G	38.2	Very low	38.6	Very low	20 Å²	20	86.7 Å²	86.7	21%	0.206	43%	0.428	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.9	-151.1	176.6	0	0	0	0	0	114.4	W679 L723 A724 Y725	W679-G721 PolarHBondContact O-N 3.49Å; G721-L723 PolarHBondContact O-N 3.11Å; G721-L723 VanDerWaalsContact O-N 3.08Å; G721-A724 WeakPolarHBondContact O-CB 3.28Å; G721-A724 PolarHBondContact O-N 3.26Å; G721-Y725 PolarHBondContact O-N 2.95Å
722	D	39.2	Very low	39.2	Very low	133 Å²	133	87.1 Å²	87.1	71%	0.711	43%	0.426	S	S	*	.	H	α-helix	trans	-56.2	-27.4	-177.2	-70.9	4.6	0	0	0	113.5	Y725 R726	D722-Y725 PolarHBondContact O-N 3.4Å; D722-R726 WeakPolarHBondContact O-CG 3.26Å; D722-R726 PolarHBondContact O-N 3.15Å
723	L	35.4	Very low	39.4	Very low	95 Å²	95	89.6 Å²	89.6	50%	0.497	44%	0.435	S	S	.	.	H	α-helix	trans	-67	-43	176.5	-151.2	89.2	0	0	0	111	L719 G721 Y725 R726 W727	L719-L723 HydrophobicContact CD1-CD2 4.33Å; L719-L723 HydrophobicContact CD2-CD2 4.06Å; G721-L723 PolarHBondContact O-N 3.11Å; G721-L723 VanDerWaalsContact O-N 3.08Å; L723-Y725 VanDerWaalsContact C-N 3.34Å; L723-Y725 PolarHBondContact O-N 3.36Å; L723-R726 PolarHBondContact O-N 3.45Å; L723-W727 WeakPolarHBondContact O-CB 3.09Å; L723-W727 VanDerWaalsContact O-CD1 3.22Å; L723-W727 PolarHBondContact O-N 2.63Å
724	A	41.3	Very low	39.3	Very low	1 Å²	1	86.9 Å²	86.9	1%	0.008	43%	0.432	C	S	.	.	H	α-helix	trans	-62.6	-40.4	174.2	0	0	0	0	0	111.6	W679 L719 G721 W727 Y728	W679-A724 HydrophobicContact CB-CB 4.37Å; L719-A724 HydrophobicContact CB-CB 4.27Å; G721-A724 WeakPolarHBondContact O-CB 3.28Å; G721-A724 PolarHBondContact O-N 3.26Å; A724-W727 PolarHBondContact O-N 3.33Å; A724-Y728 VanDerWaalsContact O-CB 3.3Å; A724-Y728 WeakPolarHBondContact O-CB 3.32Å; A724-Y728 PolarHBondContact O-N 3.43Å
725	Y	39.2	Very low	39.6	Very low	121 Å²	121	86.8 Å²	86.8	48%	0.475	43%	0.425	S	S	.	.	H	α-helix	trans	-64.6	-39.9	176	-177.3	-96.4	0	0	0	112.9	G721 D722 L723 Y729	G721-Y725 PolarHBondContact O-N 2.95Å; D722-Y725 PolarHBondContact O-N 3.4Å; L723-Y725 VanDerWaalsContact C-N 3.34Å; L723-Y725 PolarHBondContact O-N 3.36Å; Y725-Y729 PolarHBondContact O-N 3.1Å
726	R	36	Very low	39.8	Very low	165 Å²	165	88.8 Å²	88.8	62%	0.623	43%	0.433	S	S	*	.	H	α-helix	trans	-70.9	-39.1	175.7	-71.9	-176.5	-175.4	-168.6	5.1	112.7	D722 L723 Y729 N730	D722-R726 WeakPolarHBondContact O-CG 3.26Å; D722-R726 PolarHBondContact O-N 3.15Å; L723-R726 PolarHBondContact O-N 3.45Å; R726-Y729 PolarHBondContact O-N 3.11Å; R726-N730 PolarHBondContact O-N 3.02Å
727	W	43.5	Very low	40.2	Very low	61 Å²	61	82.9 Å²	82.9	23%	0.231	41%	0.406	C	S	.	.	H	α-helix	trans	-69.9	-34.2	176.7	-79.6	52	0	0	0	111.7	F683 L719 L723 A724 Y729 N730 F731 L739	F683-W727 HydrophobicContact CE1-CE3 4.35Å; F683-W727 AromaticContact CE2-CE3 3.95Å; F683-W727 HydrophobicContact CE2-CE3 3.95Å; F683-W727 AromaticContact CZ-CE3 3.71Å; F683-W727 HydrophobicContact CZ-CE3 3.71Å; F683-W727 HydrophobicContact CZ-CZ3 4.34Å; L719-W727 HydrophobicContact CD1-CB 4.21Å; L719-W727 HydrophobicContact CD1-CD2 3.55Å; L719-W727 HydrophobicContact CD1-CE3 3.61Å; L719-W727 HydrophobicContact CD1-CG 3.82Å; L719-W727 HydrophobicContact CD1-CZ3 4.19Å; L723-W727 WeakPolarHBondContact O-CB 3.09Å; L723-W727 VanDerWaalsContact O-CD1 3.22Å; L723-W727 PolarHBondContact O-N 2.63Å; A724-W727 PolarHBondContact O-N 3.33Å; W727-Y729 PolarHBondContact O-N 3.17Å; W727-N730 PolarHBondContact O-N 3.2Å; W727-N730 VanDerWaalsContact O-N 3.08Å; W727-F731 HydrophobicContact CB-CD2 4.04Å; W727-F731 AromaticContact CD2-CD2 3.85Å; W727-F731 HydrophobicContact CD2-CD2 3.85Å; W727-F731 AromaticContact CD2-CE2 3.59Å; W727-F731 HydrophobicContact CD2-CE2 3.59Å; W727-F731 HydrophobicContact CD2-CZ 4.35Å; W727-F731 AromaticContact CE3-CD2 3.65Å; W727-F731 HydrophobicContact CE3-CD2 3.65Å; W727-F731 HydrophobicContact CE3-CE1 4.43Å; W727-F731 AromaticContact CE3-CE2 3.49Å; W727-F731 HydrophobicContact CE3-CE2 3.49Å; W727-F731 VanDerWaalsContact CE3-CE2 3.49Å; W727-F731 HydrophobicContact CE3-CG 4.2Å; W727-F731 AromaticContact CE3-CZ 3.93Å; W727-F731 HydrophobicContact CE3-CZ 3.93Å; W727-F731 HydrophobicContact CG-CD2 4.05Å; W727-F731 HydrophobicContact CG-CE2 4.08Å; W727-F731 HydrophobicContact CH2-CE2 4.39Å; W727-F731 HydrophobicContact CH2-CZ 4.24Å; W727-F731 HydrophobicContact CZ2-CE2 4.46Å; W727-F731 HydrophobicContact CZ3-CD2 4.4Å; W727-F731 HydrophobicContact CZ3-CE1 4.29Å; W727-F731 AromaticContact CZ3-CE2 3.92Å; W727-F731 HydrophobicContact CZ3-CE2 3.92Å; W727-F731 AromaticContact CZ3-CZ 3.87Å; W727-F731 HydrophobicContact CZ3-CZ 3.87Å; W727-F731 WeakPolarHBondContact O-CB 3.39Å; W727-F731 PolarHBondContact O-N 3.13Å; W727-L739 HydrophobicContact CH2-CD2 4.43Å
728	Y	44	Very low	40.6	Very low	120 Å²	120	82.7 Å²	82.7	47%	0.471	40%	0.403	S	S	.	.	H	α-helix	trans	-54.4	-38.1	170.3	168.3	-108.1	0	0	0	113.1	Y681 A724 N730	Y681-Y728 AromaticContact CE2-CD2 3.95Å; Y681-Y728 HydrophobicContact CE2-CD2 3.95Å; Y681-Y728 HydrophobicContact CE2-CG 4.46Å; Y681-Y728 AromaticContact CZ-CD2 3.81Å; Y681-Y728 VanDerWaalsContact OH-CD2 3.28Å; Y681-Y728 WeakPolarHBondContact OH-CD2 3.41Å; A724-Y728 VanDerWaalsContact O-CB 3.3Å; A724-Y728 WeakPolarHBondContact O-CB 3.32Å; A724-Y728 PolarHBondContact O-N 3.43Å; Y728-N730 VanDerWaalsContact C-N 3.34Å
729	Y	42.2	Very low	41	Very low	190 Å²	190	78.9 Å²	78.9	75%	0.745	38%	0.376	S	S	*	.	H	α-helix	trans	-73.5	-25.9	179.2	-152.4	-88.3	0	0	0	113.3	Y725 R726 W727	Y725-Y729 PolarHBondContact O-N 3.1Å; R726-Y729 PolarHBondContact O-N 3.11Å; W727-Y729 PolarHBondContact O-N 3.17Å
730	N	39.8	Very low	41.3	Very low	105 Å²	105	78.9 Å²	78.9	56%	0.561	38%	0.377	S	S	*	.	H	α-helix	trans	-106.5	-26.8	-171.1	-66.9	-6.6	0	0	0	114.2	R726 W727 Y728	R726-N730 PolarHBondContact O-N 3.02Å; W727-N730 PolarHBondContact O-N 3.2Å; W727-N730 VanDerWaalsContact O-N 3.08Å; Y728-N730 VanDerWaalsContact C-N 3.34Å
731	F	40.5	Very low	41.7	Very low	24 Å²	24	78.4 Å²	78.4	11%	0.105	37%	0.366	C	S	.	.	S	Bend	trans	-114.8	109.9	-175.3	-67.6	-95.9	0	0	0	110.4	N652 F683 W727 Y737 V763	N652-F731 PolarHBondContact ND2-O 2.96Å; F683-F731 HydrophobicContact CE1-CB 4.15Å; F683-F731 HydrophobicContact CE1-CD1 4.37Å; F683-F731 HydrophobicContact CE1-CG 4.35Å; F683-F731 HydrophobicContact CZ-CB 4.19Å; F683-F731 HydrophobicContact CZ-CG 4.43Å; W727-F731 HydrophobicContact CB-CD2 4.04Å; W727-F731 AromaticContact CD2-CD2 3.85Å; W727-F731 HydrophobicContact CD2-CD2 3.85Å; W727-F731 AromaticContact CD2-CE2 3.59Å; W727-F731 HydrophobicContact CD2-CE2 3.59Å; W727-F731 HydrophobicContact CD2-CZ 4.35Å; W727-F731 AromaticContact CE3-CD2 3.65Å; W727-F731 HydrophobicContact CE3-CD2 3.65Å; W727-F731 HydrophobicContact CE3-CE1 4.43Å; W727-F731 AromaticContact CE3-CE2 3.49Å; W727-F731 HydrophobicContact CE3-CE2 3.49Å; W727-F731 VanDerWaalsContact CE3-CE2 3.49Å; W727-F731 HydrophobicContact CE3-CG 4.2Å; W727-F731 AromaticContact CE3-CZ 3.93Å; W727-F731 HydrophobicContact CE3-CZ 3.93Å; W727-F731 HydrophobicContact CG-CD2 4.05Å; W727-F731 HydrophobicContact CG-CE2 4.08Å; W727-F731 HydrophobicContact CH2-CE2 4.39Å; W727-F731 HydrophobicContact CH2-CZ 4.24Å; W727-F731 HydrophobicContact CZ2-CE2 4.46Å; W727-F731 HydrophobicContact CZ3-CD2 4.4Å; W727-F731 HydrophobicContact CZ3-CE1 4.29Å; W727-F731 AromaticContact CZ3-CE2 3.92Å; W727-F731 HydrophobicContact CZ3-CE2 3.92Å; W727-F731 AromaticContact CZ3-CZ 3.87Å; W727-F731 HydrophobicContact CZ3-CZ 3.87Å; W727-F731 WeakPolarHBondContact O-CB 3.39Å; W727-F731 PolarHBondContact O-N 3.13Å; F731-Y737 WeakPolarHBondContact CA-OH 3.22Å; F731-Y737 HydrophobicContact CB-CE2 4.19Å; F731-Y737 AromaticContact CD1-CD1 3.42Å; F731-Y737 HydrophobicContact CD1-CD1 3.42Å; F731-Y737 VanDerWaalsContact CD1-CD1 3.42Å; F731-Y737 AromaticContact CD1-CD2 3.8Å; F731-Y737 HydrophobicContact CD1-CD2 3.8Å; F731-Y737 AromaticContact CD1-CE1 3.41Å; F731-Y737 HydrophobicContact CD1-CE1 3.41Å; F731-Y737 VanDerWaalsContact CD1-CE1 3.41Å; F731-Y737 AromaticContact CD1-CE2 3.81Å; F731-Y737 HydrophobicContact CD1-CE2 3.81Å; F731-Y737 AromaticContact CD1-CG 3.62Å; F731-Y737 HydrophobicContact CD1-CG 3.62Å; F731-Y737 AromaticContact CD1-CZ 3.65Å; F731-Y737 AromaticContact CE1-CD1 3.54Å; F731-Y737 HydrophobicContact CE1-CD1 3.54Å; F731-Y737 HydrophobicContact CE1-CD2 4.49Å; F731-Y737 AromaticContact CE1-CE1 3.89Å; F731-Y737 HydrophobicContact CE1-CE1 3.89Å; F731-Y737 AromaticContact CE1-CG 3.87Å; F731-Y737 HydrophobicContact CE1-CG 3.87Å; F731-Y737 HydrophobicContact CG-CE1 4.3Å; F731-Y737 HydrophobicContact CG-CE2 4.5Å; F731-V763 HydrophobicContact CE1-CG1 3.98Å; F731-V763 HydrophobicContact CZ-CG1 4.15Å
732	Q	42	Very low	42	Very low	117 Å²	117	80 Å²	80	55%	0.547	37%	0.372	S	S	.	.			trans	-72.8	142.2	178.8	-64.5	-178.8	1.7	0	0	111	Y735 Y737	Q732-Y735 HydrophobicContact CB-CD2 3.46Å; Q732-Y735 VanDerWaalsContact CB-CD2 3.46Å; Q732-Y735 HydrophobicContact CB-CE2 3.81Å; Q732-Y735 HydrophobicContact CB-CG 4.23Å; Q732-Y737 PolarHBondContact N-OH 3.47Å
733	I	39	Very low	42.3	Very low	94 Å²	94	76.2 Å²	76.2	48%	0.482	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	138.4	179.6	-56.8	174.5	0	0	0	109.7	Y681 Y735	Y681-I733 WeakPolarHBondContact OH-CD1 3.35Å; I733-Y735 VanDerWaalsContact C-N 3.28Å; I733-Y735 PolarHBondContact O-N 2.91Å
734	G	36.5	Very low	42.5	Very low	48 Å²	48	73.3 Å²	73.3	50%	0.495	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.4	-9.2	178.3	0	0	0	0	0	116.1	N652	N652-G734 PolarHBondContact O-N 3.29Å
735	Y	40	Very low	42.8	Very low	106 Å²	106	78.2 Å²	78.2	42%	0.416	36%	0.362	S	S	.	.			trans	-80.1	146.9	174.7	-74.7	-101.2	0	0	0	111.5	Q732 I733 Y737 I765	Q732-Y735 HydrophobicContact CB-CD2 3.46Å; Q732-Y735 VanDerWaalsContact CB-CD2 3.46Å; Q732-Y735 HydrophobicContact CB-CE2 3.81Å; Q732-Y735 HydrophobicContact CB-CG 4.23Å; I733-Y735 VanDerWaalsContact C-N 3.28Å; I733-Y735 PolarHBondContact O-N 2.91Å; Y735-Y737 WeakPolarHBondContact O-CD2 3.03Å; Y735-I765 HydrophobicContact CD1-CG2 3.85Å
736	H	43.1	Very low	42.9	Very low	89 Å²	89	78.6 Å²	78.6	41%	0.412	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	122.3	176.3	-68.6	63.5	0	0	0	109.4	V651 L766	V651-H736 VanDerWaalsContact CG2-CD2 3.5Å; V651-H736 WeakPolarHBondContact CG2-CD2 3.24Å; V651-H736 WeakPolarHBondContact CG2-NE2 3.38Å; H736-L766 HydrophobicContact CB-CB 4.08Å; H736-L766 HydrophobicContact CB-CD1 4.21Å; H736-L766 PolarHBondContact O-N 3.16Å
737	Y	46.5	Very low	43	Very low	7 Å²	7	75.6 Å²	75.6	3%	0.027	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	125.3	-177.3	-68.3	-88.9	0	0	0	110.3	V649 L650 F731 Q732 Y735 V763 S764 I765	V649-Y737 CarbonylContact C-O 3.52Å; V649-Y737 WeakPolarHBondContact CA-O 3.47Å; L650-Y737 PolarHBondContact N-O 3.28Å; L650-Y737 PolarHBondContact O-N 3.39Å; F731-Y737 WeakPolarHBondContact CA-OH 3.22Å; F731-Y737 HydrophobicContact CB-CE2 4.19Å; F731-Y737 AromaticContact CD1-CD1 3.42Å; F731-Y737 HydrophobicContact CD1-CD1 3.42Å; F731-Y737 VanDerWaalsContact CD1-CD1 3.42Å; F731-Y737 AromaticContact CD1-CD2 3.8Å; F731-Y737 HydrophobicContact CD1-CD2 3.8Å; F731-Y737 AromaticContact CD1-CE1 3.41Å; F731-Y737 HydrophobicContact CD1-CE1 3.41Å; F731-Y737 VanDerWaalsContact CD1-CE1 3.41Å; F731-Y737 AromaticContact CD1-CE2 3.81Å; F731-Y737 HydrophobicContact CD1-CE2 3.81Å; F731-Y737 AromaticContact CD1-CG 3.62Å; F731-Y737 HydrophobicContact CD1-CG 3.62Å; F731-Y737 AromaticContact CD1-CZ 3.65Å; F731-Y737 AromaticContact CE1-CD1 3.54Å; F731-Y737 HydrophobicContact CE1-CD1 3.54Å; F731-Y737 HydrophobicContact CE1-CD2 4.49Å; F731-Y737 AromaticContact CE1-CE1 3.89Å; F731-Y737 HydrophobicContact CE1-CE1 3.89Å; F731-Y737 AromaticContact CE1-CG 3.87Å; F731-Y737 HydrophobicContact CE1-CG 3.87Å; F731-Y737 HydrophobicContact CG-CE1 4.3Å; F731-Y737 HydrophobicContact CG-CE2 4.5Å; Q732-Y737 PolarHBondContact N-OH 3.47Å; Y735-Y737 WeakPolarHBondContact O-CD2 3.03Å; Y737-V763 HydrophobicContact CD1-CG1 4.43Å; Y737-S764 WeakPolarHBondContact CA-O 3.45Å; Y737-I765 HydrophobicContact CD1-CG1 3.92Å; Y737-I765 HydrophobicContact CE1-CD1 4.02Å; Y737-I765 HydrophobicContact CE1-CG1 3.48Å; Y737-I765 VanDerWaalsContact CE1-CG1 3.48Å
738	Q	49.4	Very low	42.6	Very low	53 Å²	53	76.4 Å²	76.4	25%	0.248	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	117.9	173.8	-175.8	-174.8	-5.8	0	0	109.1	T647 V649 V740 V763 S764 L766	T647-Q738 HydrophobicContact CG2-CG 3.45Å; T647-Q738 VanDerWaalsContact CG2-CG 3.45Å; V649-Q738 HydrophobicContact CG2-CG 4.45Å; Q738-V740 HydrophobicContact CG-CG2 4.35Å; Q738-V763 WeakPolarHBondContact O-CA 3.4Å; Q738-S764 PolarHBondContact N-O 3.03Å; Q738-S764 PolarHBondContact O-N 3.02Å; Q738-L766 HydrophobicContact CB-CD1 4.3Å; Q738-L766 HydrophobicContact CB-CG 4.25Å
739	L	48.7	Very low	42.2	Very low	4 Å²	4	76 Å²	76	2%	0.021	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	124	176.6	-63.2	104.1	0	0	0	109.6	T647 I648 L650 W727 L760 V763	T647-L739 WeakPolarHBondContact CA-O 3.43Å; I648-L739 PolarHBondContact N-O 3.48Å; I648-L739 PolarHBondContact O-N 3.37Å; L650-L739 HydrophobicContact CB-CD1 4.23Å; L650-L739 HydrophobicContact CD1-CD1 3.65Å; L650-L739 HydrophobicContact CG-CD1 3.83Å; W727-L739 HydrophobicContact CH2-CD2 4.43Å; L739-L760 HydrophobicContact CB-CD1 3.79Å; L739-L760 HydrophobicContact CD2-CD1 3.99Å; L739-L760 HydrophobicContact CD2-CD2 4.2Å; L739-L760 HydrophobicContact CG-CD1 4.39Å; L739-V763 HydrophobicContact CD2-CG2 3.97Å; L739-V763 HydrophobicContact CG-CG1 4.42Å; L739-V763 HydrophobicContact CG-CG2 4.29Å
740	V	44.2	Very low	41.8	Very low	19 Å²	19	70.6 Å²	70.6	12%	0.115	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	127.1	-177.2	-173.7	0	0	0	0	110.6	C646 Q738 I761 N762	C646-V740 CarbonylContact O-C 3.58Å; C646-V740 WeakPolarHBondContact O-CA 3.25Å; Q738-V740 HydrophobicContact CG-CG2 4.35Å; V740-I761 HydrophobicContact CB-CG1 4.2Å; V740-I761 HydrophobicContact CG1-CD1 4.01Å; V740-I761 HydrophobicContact CG1-CG1 4.05Å; V740-I761 VanDerWaalsContact O-CG1 3.23Å; V740-I761 WeakPolarHBondContact O-CG1 3.38Å; V740-I761 PolarHBondContact O-N 3.24Å; V740-N762 HydrophobicContact CB-CB 4.29Å; V740-N762 PolarHBondContact N-O 3.38Å; V740-N762 PolarHBondContact O-N 2.98Å
741	W	47.7	Very low	41.5	Very low	74 Å²	74	70.9 Å²	70.9	28%	0.28	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	143.7	-175.3	-56.7	78.9	0	0	0	111.7	S645 C646 R758 Q759 L760	S645-W741 CarbonylContact C-O 3.59Å; S645-W741 WeakPolarHBondContact CA-O 3.3Å; C646-W741 HydrophobicContact CB-CB 4.27Å; C646-W741 PolarHBondContact N-O 3.01Å; C646-W741 PolarHBondContact O-N 2.74Å; W741-R758 HydrophobicContact CB-CB 4.33Å; W741-R758 HydrophobicContact CE3-CB 4.38Å; W741-Q759 CarbonylContact C-O 3.52Å; W741-Q759 WeakPolarHBondContact CA-O 3.37Å; W741-L760 HydrophobicContact CD2-CB 3.92Å; W741-L760 HydrophobicContact CD2-CD1 4.05Å; W741-L760 HydrophobicContact CE3-CB 3.67Å; W741-L760 VanDerWaalsContact CE3-N 3.27Å; W741-L760 HydrophobicContact CG-CD1 4.4Å; W741-L760 HydrophobicContact CH2-CB 3.77Å; W741-L760 HydrophobicContact CH2-CD2 4.44Å; W741-L760 HydrophobicContact CH2-CG 4.49Å; W741-L760 HydrophobicContact CZ2-CB 4.01Å; W741-L760 HydrophobicContact CZ2-CD1 3.92Å; W741-L760 HydrophobicContact CZ2-CD2 4.33Å; W741-L760 HydrophobicContact CZ2-CG 4.33Å; W741-L760 HydrophobicContact CZ3-CB 3.6Å
742	V	43.8	Very low	41.4	Very low	55 Å²	55	77.5 Å²	77.5	33%	0.333	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	137.5	178.8	175.6	0	0	0	0	110.1	R758 Q759 I761	V742-R758 CarbonylContact O-C 3.57Å; V742-R758 VanDerWaalsContact O-CA 3.29Å; V742-R758 WeakPolarHBondContact O-CA 3.49Å; V742-Q759 PolarHBondContact N-O 3.04Å; V742-Q759 PolarHBondContact O-N 2.97Å; V742-I761 HydrophobicContact CB-CG2 4.23Å; V742-I761 HydrophobicContact CG2-CD1 3.54Å; V742-I761 HydrophobicContact CG2-CG1 3.94Å; V742-I761 HydrophobicContact CG2-CG2 4.1Å
743	N	45.8	Very low	41.2	Very low	52 Å²	52	79.3 Å²	79.3	28%	0.278	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	135.3	173.2	-77.7	-4.9	0	0	0	110.5	L757 R758	N743-L757 WeakPolarHBondContact CA-O 3.31Å; N743-R758 WeakPolarHBondContact OD1-CG 3.26Å; N743-R758 PolarHBondContact OD1-NE 3.12Å
744	I	38.8	Very low	41	Very low	34 Å²	34	79.6 Å²	79.6	17%	0.174	44%	0.438	C	S	.	.			trans	-97.4	131.3	166.5	-41.4	105.3	0	0	0	108	Y564 L757 Q759	Y564-I744 HydrophobicContact CD1-CD1 4.41Å; Y564-I744 HydrophobicContact CE1-CB 4.33Å; Y564-I744 HydrophobicContact CE1-CD1 3.5Å; Y564-I744 VanDerWaalsContact CE1-CD1 3.5Å; Y564-I744 HydrophobicContact CE1-CG1 3.72Å; Y564-I744 HydrophobicContact CE1-CG2 4.24Å; I744-L757 HydrophobicContact CD1-CB 4.09Å; I744-L757 PolarHBondContact N-O 2.87Å; I744-Q759 HydrophobicContact CD1-CB 3.82Å; I744-Q759 VanDerWaalsContact CD1-N 3.34Å; I744-Q759 HydrophobicContact CG1-CB 3.9Å
745	D	47.5	Very low	41.2	Very low	105 Å²	105	81.9 Å²	81.9	56%	0.561	45%	0.447	S	S	*	.			trans	68.3	107	174.9	-55.1	-33	0	0	0	118.1	S747	D745-S747 VanDerWaalsContact C-N 3.32Å
746	N	42.4	Very low	41.1	Very low	128 Å²	128	80.2 Å²	80.2	68%	0.684	45%	0.449	S	S	*	.	S	Bend	trans	-81.6	-5.6	166.3	-81.1	-0.2	0	0	0	113.2
747	S	37.5	Very low	40.9	Very low	103 Å²	103	78.9 Å²	78.9	72%	0.72	45%	0.445	S	S	*	.	S	Bend	trans	-95.7	-9.4	-160.7	52.2	0	0	0	0	115.6	D745	D745-S747 VanDerWaalsContact C-N 3.32Å
748	T	35.6	Very low	40.7	Very low	78 Å²	78	83.1 Å²	83.1	48%	0.479	46%	0.461	S	S	.	.	S	Bend	trans	-117.2	112.9	177.2	51.1	0	0	0	0	110.4	F750	T748-F750 WeakPolarHBondContact O-CD2 3.49Å; T748-F750 WeakPolarHBondContact O-CE2 3.4Å; T748-F750 PolarHBondContact O-N 2.98Å
749	S	35.6	Very low	40.2	Very low	112 Å²	112	83.8 Å²	83.8	78%	0.783	46%	0.464	S	S	*	.			trans	-62.3	97.5	171.5	54.6	0	0	0	0	109.9	T751	S749-T751 PolarHBondContact O-N 3.1Å
750	F	33.5	Very low	39.9	Very low	75 Å²	75	84.9 Å²	84.9	33%	0.329	47%	0.469	S	S	.	.			trans	-65.6	120.8	175.9	-69.3	-82.7	0	0	0	109.3	T748 N752 Q754 L757	T748-F750 WeakPolarHBondContact O-CD2 3.49Å; T748-F750 WeakPolarHBondContact O-CE2 3.4Å; T748-F750 PolarHBondContact O-N 2.98Å; F750-N752 PolarHBondContact O-N 3.25Å; F750-N752 VanDerWaalsContact O-N 3.16Å; F750-Q754 HydrophobicContact CD1-CB 4.14Å; F750-L757 HydrophobicContact CZ-CD1 4.31Å
751	T	33.9	Very low	39.9	Very low	112 Å²	112	88.5 Å²	88.5	69%	0.687	49%	0.487	S	S	*	.			trans	-76.4	102.4	178.3	47.6	0	0	0	0	110.1	S749 D753	S749-T751 PolarHBondContact O-N 3.1Å; T751-D753 PolarHBondContact O-N 2.93Å
752	N	38.4	Very low	39.6	Very low	163 Å²	163	89.1 Å²	89.1	87%	0.872	50%	0.496	S	S	*	.	S	Bend	trans	42	-39.4	166.4	-74.9	3.6	0	0	0	121.4	F750	F750-N752 PolarHBondContact O-N 3.25Å; F750-N752 VanDerWaalsContact O-N 3.16Å
753	D	36.5	Very low	39.5	Very low	155 Å²	155	89.5 Å²	89.5	83%	0.829	50%	0.498	S	S	*	.	S	Bend	trans	-109.2	12.2	-167.2	-53.1	-24.8	0	0	0	112.5	T751	T751-D753 PolarHBondContact O-N 2.93Å
754	Q	36.3	Very low	39.6	Very low	99 Å²	99	88.8 Å²	88.8	46%	0.463	50%	0.498	S	S	.	.	S	Bend	trans	-121.2	124.9	179	-68.3	-170.4	-12.6	0	0	111.4	F750	F750-Q754 HydrophobicContact CD1-CB 4.14Å
755	S	40.2	Very low	39.7	Very low	97 Å²	97	90.9 Å²	90.9	68%	0.678	51%	0.508	S	S	*	.	P	Polyproline II helix	trans	-73.9	141.7	178.8	24	0	0	0	0	111.5	L757	S755-L757 PolarHBondContact O-N 3.34Å
756	P	38.5	Very low	39.5	Very low	70 Å²	70	88 Å²	88	46%	0.455	49%	0.493	S	S	.	.	P	Polyproline II helix	trans	-66.2	129.6	-175.8	25.6	-34.1	0	0	0	112
757	L	39	Very low	39.4	Very low	61 Å²	61	87.6 Å²	87.6	32%	0.319	49%	0.491	S	S	.	.	P	Polyproline II helix	trans	-63.9	130.7	177.9	-83.9	146.8	0	0	0	111.4	L565 N743 I744 F750 S755	L565-L757 HydrophobicContact CB-CD2 4.23Å; N743-L757 WeakPolarHBondContact CA-O 3.31Å; I744-L757 HydrophobicContact CD1-CB 4.09Å; I744-L757 PolarHBondContact N-O 2.87Å; F750-L757 HydrophobicContact CZ-CD1 4.31Å; S755-L757 PolarHBondContact O-N 3.34Å
758	R	41.7	Very low	39.3	Very low	97 Å²	97	90.6 Å²	90.6	37%	0.366	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	131.3	-178.5	-71.8	179.6	-179.9	-171	2.2	112.7	W741 V742 N743	W741-R758 HydrophobicContact CB-CB 4.33Å; W741-R758 HydrophobicContact CE3-CB 4.38Å; V742-R758 CarbonylContact O-C 3.57Å; V742-R758 VanDerWaalsContact O-CA 3.29Å; V742-R758 WeakPolarHBondContact O-CA 3.49Å; N743-R758 WeakPolarHBondContact OD1-CG 3.26Å; N743-R758 PolarHBondContact OD1-NE 3.12Å
759	Q	39.3	Very low	39	Very low	66 Å²	66	92.2 Å²	92.2	31%	0.308	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	129.9	175.5	-173.7	179.2	6.2	0	0	110	Y564 W741 V742 I744 I761	Y564-Q759 PolarHBondContact OH-OE1 3.39Å; Y564-Q759 VanDerWaalsContact OH-OE1 3.11Å; W741-Q759 CarbonylContact C-O 3.52Å; W741-Q759 WeakPolarHBondContact CA-O 3.37Å; V742-Q759 PolarHBondContact N-O 3.04Å; V742-Q759 PolarHBondContact O-N 2.97Å; I744-Q759 HydrophobicContact CD1-CB 3.82Å; I744-Q759 VanDerWaalsContact CD1-N 3.34Å; I744-Q759 HydrophobicContact CG1-CB 3.9Å; Q759-I761 HydrophobicContact CB-CG2 4.47Å; Q759-I761 HydrophobicContact CG-CG2 4.24Å; Q759-I761 PolarHBondContact O-N 2.85Å
760	L	42.2	Very low	38.5	Very low	27 Å²	27	91.7 Å²	91.7	14%	0.141	51%	0.505	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	117.2	165.8	177	69	0	0	0	108.4	I562 L739 W741 N762 V763	I562-L760 HydrophobicContact CD1-CB 3.73Å; I562-L760 HydrophobicContact CD1-CD2 3.89Å; I562-L760 HydrophobicContact CD1-CG 4.16Å; L739-L760 HydrophobicContact CB-CD1 3.79Å; L739-L760 HydrophobicContact CD2-CD1 3.99Å; L739-L760 HydrophobicContact CD2-CD2 4.2Å; L739-L760 HydrophobicContact CG-CD1 4.39Å; W741-L760 HydrophobicContact CD2-CB 3.92Å; W741-L760 HydrophobicContact CD2-CD1 4.05Å; W741-L760 HydrophobicContact CE3-CB 3.67Å; W741-L760 VanDerWaalsContact CE3-N 3.27Å; W741-L760 HydrophobicContact CG-CD1 4.4Å; W741-L760 HydrophobicContact CH2-CB 3.77Å; W741-L760 HydrophobicContact CH2-CD2 4.44Å; W741-L760 HydrophobicContact CH2-CG 4.49Å; W741-L760 HydrophobicContact CZ2-CB 4.01Å; W741-L760 HydrophobicContact CZ2-CD1 3.92Å; W741-L760 HydrophobicContact CZ2-CD2 4.33Å; W741-L760 HydrophobicContact CZ2-CG 4.33Å; W741-L760 HydrophobicContact CZ3-CB 3.6Å; L760-N762 WeakPolarHBondContact CD1-O 3.13Å; L760-V763 HydrophobicContact CD1-CG2 4.11Å; L760-V763 HydrophobicContact CD2-CG2 3.78Å; L760-V763 HydrophobicContact CG-CG2 4.2Å
761	I	42.9	Very low	38.1	Very low	95 Å²	95	94.8 Å²	94.8	49%	0.487	52%	0.524	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	-19.8	-176.8	58.7	153.6	0	0	0	113.5	V740 V742 Q759	V740-I761 HydrophobicContact CB-CG1 4.2Å; V740-I761 HydrophobicContact CG1-CD1 4.01Å; V740-I761 HydrophobicContact CG1-CG1 4.05Å; V740-I761 VanDerWaalsContact O-CG1 3.23Å; V740-I761 WeakPolarHBondContact O-CG1 3.38Å; V740-I761 PolarHBondContact O-N 3.24Å; V742-I761 HydrophobicContact CB-CG2 4.23Å; V742-I761 HydrophobicContact CG2-CD1 3.54Å; V742-I761 HydrophobicContact CG2-CG1 3.94Å; V742-I761 HydrophobicContact CG2-CG2 4.1Å; Q759-I761 HydrophobicContact CB-CG2 4.47Å; Q759-I761 HydrophobicContact CG-CG2 4.24Å; Q759-I761 PolarHBondContact O-N 2.85Å
762	N	42.3	Very low	37.6	Very low	88 Å²	88	95.7 Å²	95.7	47%	0.471	52%	0.523	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.3	145	-177.7	-165.2	3.4	0	0	0	111.9	V740 L760	V740-N762 HydrophobicContact CB-CB 4.29Å; V740-N762 PolarHBondContact N-O 3.38Å; V740-N762 PolarHBondContact O-N 2.98Å; L760-N762 WeakPolarHBondContact CD1-O 3.13Å
763	V	41.9	Very low	36.9	Very low	62 Å²	62	93.9 Å²	93.9	38%	0.376	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	112.7	170.3	-177.4	0	0	0	0	107.9	F731 Y737 Q738 L739 L760	F731-V763 HydrophobicContact CE1-CG1 3.98Å; F731-V763 HydrophobicContact CZ-CG1 4.15Å; Y737-V763 HydrophobicContact CD1-CG1 4.43Å; Q738-V763 WeakPolarHBondContact O-CA 3.4Å; L739-V763 HydrophobicContact CD2-CG2 3.97Å; L739-V763 HydrophobicContact CG-CG1 4.42Å; L739-V763 HydrophobicContact CG-CG2 4.29Å; L760-V763 HydrophobicContact CD1-CG2 4.11Å; L760-V763 HydrophobicContact CD2-CG2 3.78Å; L760-V763 HydrophobicContact CG-CG2 4.2Å
764	S	47.2	Very low	36.5	Very low	38 Å²	38	95.7 Å²	95.7	27%	0.266	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	145.6	177.7	57.8	0	0	0	0	112	Y737 Q738	Y737-S764 WeakPolarHBondContact CA-O 3.45Å; Q738-S764 PolarHBondContact N-O 3.03Å; Q738-S764 PolarHBondContact O-N 3.02Å
765	I	41.4	Very low	36	Very low	77 Å²	77	99.4 Å²	99.4	40%	0.395	53%	0.527	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	124.1	168.6	-60.2	174.1	0	0	0	107.3	Y735 Y737 N767	Y735-I765 HydrophobicContact CD1-CG2 3.85Å; Y737-I765 HydrophobicContact CD1-CG1 3.92Å; Y737-I765 HydrophobicContact CE1-CD1 4.02Å; Y737-I765 HydrophobicContact CE1-CG1 3.48Å; Y737-I765 VanDerWaalsContact CE1-CG1 3.48Å; I765-N767 VanDerWaalsContact C-N 3.25Å; I765-N767 PolarHBondContact O-N 2.89Å
766	L	43.5	Very low	35.2	Very low	46 Å²	46	101.2 Å²	101.2	24%	0.241	53%	0.528	C	S	.	.			trans	-74.7	82.6	172.5	-72.9	167.7	0	0	0	109.1	V649 H736 Q738 N768	V649-L766 HydrophobicContact CG1-CD1 3.97Å; V649-L766 HydrophobicContact CG2-CD1 4.33Å; H736-L766 HydrophobicContact CB-CB 4.08Å; H736-L766 HydrophobicContact CB-CD1 4.21Å; H736-L766 PolarHBondContact O-N 3.16Å; Q738-L766 HydrophobicContact CB-CD1 4.3Å; Q738-L766 HydrophobicContact CB-CG 4.25Å; L766-N768 PolarHBondContact O-N 2.84Å
767	N	39.2	Very low	34.5	Very low	119 Å²	119	105.2 Å²	105.2	64%	0.636	55%	0.545	S	S	*	.			trans	-62.7	126.3	171.5	-73.9	-24.7	0	0	0	109.5	I765 S769	I765-N767 VanDerWaalsContact C-N 3.25Å; I765-N767 PolarHBondContact O-N 2.89Å; N767-S769 PolarHBondContact O-N 2.89Å
768	N	36.6	Very low	33.7	Very low	165 Å²	165	106.8 Å²	106.8	88%	0.882	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56	92.9	-174.6	-71.8	-24.2	0	0	0	113.6	L766	L766-N768 PolarHBondContact O-N 2.84Å
769	S	30	Very low	32.9	Very low	113 Å²	113	108.9 Å²	108.9	79%	0.79	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-156.6	-17.3	163.2	70.1	0	0	0	0	115.8	N767 L771	N767-S769 PolarHBondContact O-N 2.89Å; S769-L771 PolarHBondContact O-N 3.11Å
770	T	24.9	Very low	32.2	Very low	100 Å²	100	110 Å²	110	61%	0.613	59%	0.59	S	S	*	*			trans	-80.6	115.1	171.4	39.2	0	0	0	0	110.1	I772	T770-I772 PolarHBondContact O-N 2.83Å
771	L	23.5	Very low	31.4	Very low	141 Å²	141	113.6 Å²	113.6	74%	0.738	61%	0.609	S	S	*	*			trans	-73.2	73.7	177.5	-156.7	133.3	0	0	0	109	S769 N773	S769-L771 PolarHBondContact O-N 3.11Å; L771-N773 PolarHBondContact O-N 2.96Å; L771-N773 VanDerWaalsContact O-N 3.12Å
772	I	23.3	Very low	30.7	Very low	130 Å²	130	114 Å²	114	67%	0.667	62%	0.616	S	S	*	*			trans	-56.5	118.5	175	-63.8	175.3	0	0	0	106.8	T770 R774	T770-I772 PolarHBondContact O-N 2.83Å; I772-R774 PolarHBondContact O-N 3.01Å; I772-R774 VanDerWaalsContact O-N 3.08Å
773	N	24.9	Very low	30	Very low	125 Å²	125	112 Å²	112	67%	0.668	61%	0.612	S	S	*	*			trans	-47.6	117.3	-168.2	-91.2	-21.3	0	0	0	111.4	L771 E775 N776	L771-N773 PolarHBondContact O-N 2.96Å; L771-N773 VanDerWaalsContact O-N 3.12Å; N773-E775 PolarHBondContact O-N 3.19Å; N773-N776 PolarHBondContact O-N 3.16Å
774	R	27.3	Very low	29.4	Very low	194 Å²	194	112.6 Å²	112.6	73%	0.732	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.1	-6.3	-170.2	-79.1	-178.9	167.2	177.6	-4.7	115.2	I772	I772-R774 PolarHBondContact O-N 3.01Å; I772-R774 VanDerWaalsContact O-N 3.08Å
775	E	26.4	Very low	28.6	Very low	177 Å²	177	114.8 Å²	114.8	83%	0.827	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.2	-20.2	-175	-60.6	-175.6	159.3	0	0	113.4	N773	N773-E775 PolarHBondContact O-N 3.19Å
776	N	24.3	Very low	28.1	Very low	134 Å²	134	114.6 Å²	114.6	72%	0.717	62%	0.621	S	S	*	*	S	Bend	trans	-102.8	10.4	-176.9	-76	-3.2	0	0	0	115	N773 S778	N773-N776 PolarHBondContact O-N 3.16Å; N776-S778 PolarHBondContact O-N 2.65Å
777	L	23.4	Very low	27.4	Very low	155 Å²	155	117.2 Å²	117.2	81%	0.812	64%	0.636	S	S	*	*			trans	-82	78.3	155.8	-81.5	168.9	0	0	0	107.9	L779	L777-L779 PolarHBondContact O-N 2.81Å
778	S	22.3	Very low	26.9	Very low	94 Å²	94	117.1 Å²	117.1	66%	0.657	63%	0.634	S	S	*	*			trans	-57.7	104.9	163.5	38.4	0	0	0	0	108.1	N776 V780	N776-S778 PolarHBondContact O-N 2.65Å; S778-V780 PolarHBondContact O-N 3.01Å
779	L	23.9	Very low	26.6	Very low	141 Å²	141	113.2 Å²	113.2	74%	0.738	61%	0.612	S	S	*	*			trans	-39.6	131.8	166.4	-69.7	140.4	0	0	0	108.9	L777 N781	L777-L779 PolarHBondContact O-N 2.81Å; L779-N781 PolarHBondContact O-N 3.16Å
780	V	24.7	Very low	26.7	Very low	89 Å²	89	115 Å²	115	54%	0.539	61%	0.607	S	S	.	*			trans	-55.2	105.6	172.7	178.7	0	0	0	0	107	S778 N784	S778-V780 PolarHBondContact O-N 3.01Å; V780-N784 HydrophobicContact CG1-CB 3.97Å
781	N	26.4	Very low	27	Very low	102 Å²	102	117.4 Å²	117.4	55%	0.545	61%	0.612	S	S	.	*			trans	-62.4	147.8	-177.6	-172.6	-1.7	0	0	0	108.1	L779 A783 N784 L785	L779-N781 PolarHBondContact O-N 3.16Å; N781-A783 PolarHBondContact O-N 2.65Å; N781-N784 PolarHBondContact O-N 3.4Å; N781-L785 PolarHBondContact O-N 2.95Å
782	V	26.8	Very low	27.3	Very low	103 Å²	103	114 Å²	114	62%	0.624	61%	0.61	S	S	*	*	H	α-helix	trans	-54.9	-27.8	178	179.7	0	0	0	0	111	L785 N786	V782-L785 PolarHBondContact O-N 2.83Å; V782-N786 WeakPolarHBondContact O-CB 3.29Å; V782-N786 PolarHBondContact O-N 2.8Å
783	A	29.1	Very low	27.7	Very low	47 Å²	47	113 Å²	113	39%	0.388	62%	0.615	S	S	.	*	H	α-helix	trans	-54.6	-55.9	169.2	0	0	0	0	0	113.2	N781 L785 N786 D787	N781-A783 PolarHBondContact O-N 2.65Å; A783-L785 PolarHBondContact O-N 2.72Å; A783-N786 CarbonylContact O-C 3.53Å; A783-N786 WeakPolarHBondContact O-CA 3.25Å; A783-N786 VanDerWaalsContact O-CB 3.3Å; A783-N786 WeakPolarHBondContact O-CB 3.15Å; A783-N786 PolarHBondContact O-N 2.95Å; A783-D787 PolarHBondContact O-N 2.84Å
784	N	28.4	Very low	28.1	Very low	74 Å²	74	115 Å²	115	40%	0.396	62%	0.618	S	S	.	*	H	α-helix	trans	-65.4	-27.5	-177.9	-55	42.5	0	0	0	112.2	V780 N781 I788	V780-N784 HydrophobicContact CG1-CB 3.97Å; N781-N784 PolarHBondContact O-N 3.4Å; N784-I788 WeakPolarHBondContact O-CG1 3.2Å; N784-I788 PolarHBondContact O-N 3.32Å
785	L	29.6	Very low	28.2	Very low	85 Å²	85	115 Å²	115	45%	0.445	62%	0.619	S	S	.	*	H	α-helix	trans	-78.7	-34.1	174.8	-140.4	158.1	0	0	0	111.2	N781 V782 A783 D787 I788 I789	N781-L785 PolarHBondContact O-N 2.95Å; V782-L785 PolarHBondContact O-N 2.83Å; A783-L785 PolarHBondContact O-N 2.72Å; L785-D787 VanDerWaalsContact C-N 3.32Å; L785-I788 PolarHBondContact O-N 3.01Å; L785-I789 HydrophobicContact CD2-CD1 3.72Å; L785-I789 HydrophobicContact CD2-CG1 4.28Å; L785-I789 VanDerWaalsContact O-CG1 3.32Å; L785-I789 WeakPolarHBondContact O-CG1 3.41Å; L785-I789 PolarHBondContact O-N 2.99Å
786	N	30.6	Very low	28.4	Very low	73 Å²	73	111.4 Å²	111.4	39%	0.39	61%	0.611	S	S	.	*	H	α-helix	trans	-62.5	-36.3	167.9	-87.9	-3.7	0	0	0	112.1	V782 A783 I789 H790	V782-N786 WeakPolarHBondContact O-CB 3.29Å; V782-N786 PolarHBondContact O-N 2.8Å; A783-N786 CarbonylContact O-C 3.53Å; A783-N786 WeakPolarHBondContact O-CA 3.25Å; A783-N786 VanDerWaalsContact O-CB 3.3Å; A783-N786 WeakPolarHBondContact O-CB 3.15Å; A783-N786 PolarHBondContact O-N 2.95Å; N786-I789 CarbonylContact O-C 3.59Å; N786-I789 PolarHBondContact O-N 2.65Å; N786-H790 VanDerWaalsContact O-CB 3.29Å; N786-H790 WeakPolarHBondContact O-CB 3.27Å; N786-H790 PolarHBondContact O-CD2 2.92Å; N786-H790 PolarHBondContact O-N 2.79Å
787	D	29.8	Very low	28.7	Very low	101 Å²	101	108.5 Å²	108.5	54%	0.54	60%	0.595	S	S	.	*	H	α-helix	trans	-63.4	-43.7	175.8	-63.6	-34	0	0	0	111.2	A783 L785 I789 H790 E791	A783-D787 PolarHBondContact O-N 2.84Å; L785-D787 VanDerWaalsContact C-N 3.32Å; D787-I789 VanDerWaalsContact C-N 3.28Å; D787-I789 PolarHBondContact O-N 2.95Å; D787-H790 PolarHBondContact O-N 2.79Å; D787-E791 PolarHBondContact O-N 2.62Å
788	I	29.2	Very low	29.1	Very low	117 Å²	117	103.3 Å²	103.3	60%	0.6	58%	0.579	S	S	*	*	H	α-helix	trans	-61.4	-35.5	174.2	-64.5	166.6	0	0	0	111.8	N784 L785	N784-I788 WeakPolarHBondContact O-CG1 3.2Å; N784-I788 PolarHBondContact O-N 3.32Å; L785-I788 PolarHBondContact O-N 3.01Å
789	I	30.1	Very low	29.4	Very low	82 Å²	82	101.8 Å²	101.8	42%	0.421	57%	0.568	S	S	.	*	H	α-helix	trans	-77.4	-34.5	177.6	-68.2	166.7	0	0	0	111.7	L785 N786 D787	L785-I789 HydrophobicContact CD2-CD1 3.72Å; L785-I789 HydrophobicContact CD2-CG1 4.28Å; L785-I789 VanDerWaalsContact O-CG1 3.32Å; L785-I789 WeakPolarHBondContact O-CG1 3.41Å; L785-I789 PolarHBondContact O-N 2.99Å; N786-I789 CarbonylContact O-C 3.59Å; N786-I789 PolarHBondContact O-N 2.65Å; D787-I789 VanDerWaalsContact C-N 3.28Å; D787-I789 PolarHBondContact O-N 2.95Å
790	H	31.2	Very low	29.7	Very low	150 Å²	150	99.3 Å²	99.3	69%	0.694	56%	0.555	S	S	*	*	H	α-helix	trans	-86.1	-23.4	-176.9	-82.2	-57.8	0	0	0	114.4	N786 D787 G792	N786-H790 VanDerWaalsContact O-CB 3.29Å; N786-H790 WeakPolarHBondContact O-CB 3.27Å; N786-H790 PolarHBondContact O-CD2 2.92Å; N786-H790 PolarHBondContact O-N 2.79Å; D787-H790 PolarHBondContact O-N 2.79Å; H790-G792 PolarHBondContact O-N 3.13Å
791	E	31.1	Very low	29.8	Very low	152 Å²	152	101.3 Å²	101.3	71%	0.71	56%	0.562	S	S	*	*	S	Bend	trans	-74.8	29.7	165.3	-66.9	-156.4	144.4	0	0	113.1	D787 S793	D787-E791 PolarHBondContact O-N 2.62Å; E791-S793 PolarHBondContact O-N 3.36Å
792	G	31.4	Very low	30	Very low	68 Å²	68	102.7 Å²	102.7	70%	0.701	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	59.6	-173.7	0	0	0	0	0	115.6	H790	H790-G792 PolarHBondContact O-N 3.13Å
793	S	31.3	Very low	30.2	Very low	110 Å²	110	98.8 Å²	98.8	77%	0.769	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-145.5	-2.2	170.2	61.3	0	0	0	0	115.8	E791	E791-S793 PolarHBondContact O-N 3.36Å
794	K	33.3	Very low	30.4	Very low	167 Å²	167	98.5 Å²	98.5	73%	0.726	53%	0.534	S	S	*	.	S	Bend	trans	-125.5	-10.6	-175.6	-73.1	-172.2	177.6	177.6	0	117.6
795	Y	29.7	Very low	30.9	Very low	194 Å²	194	95.1 Å²	95.1	76%	0.761	52%	0.517	S	S	*	.			trans	-136	116.3	-176.6	-60.6	-70.1	0	0	0	112.8	I797	Y795-I797 PolarHBondContact O-N 3.38Å
796	P	31.1	Very low	31.3	Very low	102 Å²	102	92 Å²	92	66%	0.662	50%	0.5	S	S	*	.			trans	-74.7	112.3	175.1	29.1	-32	0	0	0	110.5	G798	P796-G798 PolarHBondContact O-N 2.57Å; P796-G798 VanDerWaalsContact O-N 3.09Å
797	I	30.4	Very low	31.8	Very low	72 Å²	72	89.9 Å²	89.9	37%	0.369	49%	0.489	S	S	.	.	G	3₁₀ helix	trans	-63.2	-15.7	-178.1	-68.8	169.1	0	0	0	113.1	Y795 C799 L882	Y795-I797 PolarHBondContact O-N 3.38Å; I797-C799 PolarHBondContact O-N 3.22Å; I797-L882 HydrophobicContact CG2-CD2 4.36Å
798	G	29.9	Very low	32	Very low	47 Å²	47	86.7 Å²	86.7	49%	0.485	47%	0.471	S	S	.	.	G	3₁₀ helix	trans	-63.8	0.6	-177	0	0	0	0	0	117.3	P796	P796-G798 PolarHBondContact O-N 2.57Å; P796-G798 VanDerWaalsContact O-N 3.09Å
799	C	29.7	Very low	32.2	Very low	61 Å²	61	83.3 Å²	83.3	41%	0.412	45%	0.452	S	S	.	.	G	3₁₀ helix	trans	-91.2	3.1	-175.7	-60.7	0	0	0	0	115.1	L656 I797 L801	L656-C799 HydrophobicContact CD2-CB 4.13Å; I797-C799 PolarHBondContact O-N 3.22Å; C799-L801 PolarHBondContact O-N 3.27Å
800	L	29.8	Very low	32.2	Very low	90 Å²	90	84.6 Å²	84.6	47%	0.471	46%	0.455	S	S	.	.			trans	-84.9	89.9	178.8	-65.5	175.7	0	0	0	112	F803	L800-F803 HydrophobicContact CB-CD2 4.48Å; L800-F803 HydrophobicContact CD1-CD2 4.36Å; L800-F803 HydrophobicContact CD1-CE2 4.21Å
801	L	27.4	Very low	32	Very low	131 Å²	131	83.3 Å²	83.3	69%	0.686	45%	0.449	S	S	*	.			trans	-84.4	151.4	166.9	-77.1	163.8	0	0	0	111.3	C799	C799-L801 PolarHBondContact O-N 3.27Å
802	N	29.5	Very low	31.7	Very low	130 Å²	130	80.1 Å²	80.1	70%	0.695	44%	0.443	S	S	*	.	S	Bend	trans	61.2	39.4	-177.8	-57	-21.2	0	0	0	114.7	E804	N802-E804 PolarHBondContact O-N 3.11Å
803	F	32.2	Very low	31.4	Very low	22 Å²	22	82.1 Å²	82.1	10%	0.096	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	117.1	176.4	-167.2	-109.9	0	0	0	110.9	L800 A805 L821 V823 L882	L800-F803 HydrophobicContact CB-CD2 4.48Å; L800-F803 HydrophobicContact CD1-CD2 4.36Å; L800-F803 HydrophobicContact CD1-CE2 4.21Å; F803-A805 HydrophobicContact CD1-CB 3.71Å; F803-A805 HydrophobicContact CE1-CB 3.41Å; F803-A805 VanDerWaalsContact CE1-CB 3.41Å; F803-A805 HydrophobicContact CZ-CB 4.26Å; F803-L821 HydrophobicContact CE1-CD1 4.46Å; F803-L821 HydrophobicContact CE1-CD2 4.39Å; F803-L821 HydrophobicContact CZ-CD2 4.11Å; F803-V823 HydrophobicContact CD2-CG1 3.72Å; F803-V823 HydrophobicContact CE1-CG2 4.31Å; F803-V823 HydrophobicContact CE2-CB 4.04Å; F803-V823 HydrophobicContact CE2-CG1 3.31Å; F803-V823 HydrophobicContact CE2-CG2 3.5Å; F803-V823 VanDerWaalsContact CE2-CG2 3.5Å; F803-V823 HydrophobicContact CZ-CB 4.2Å; F803-V823 HydrophobicContact CZ-CG1 3.89Å; F803-V823 HydrophobicContact CZ-CG2 3.3Å; F803-L882 HydrophobicContact CE1-CD1 4.17Å; F803-L882 HydrophobicContact CZ-CD1 4.28Å
804	E	32.1	Very low	31.2	Very low	40 Å²	40	82.8 Å²	82.8	19%	0.187	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	117.7	162.1	-69	-153.2	136.7	0	0	109.7	N802 T824 R876 F877 T878	N802-E804 PolarHBondContact O-N 3.11Å; E804-T824 WeakPolarHBondContact CB-O 3.07Å; E804-T824 PolarHBondContact O-N 3.28Å; E804-T824 VanDerWaalsContact O-N 3.11Å; E804-T824 VanDerWaalsContact O-O 3.12Å; E804-R876 IonicContact OE1-CZ 3.71Å; E804-R876 IonicContact OE1-NE 3.63Å; E804-R876 PolarHBondContact OE1-NE 2.99Å; E804-R876 IonicContact OE1-NH2 3.76Å; E804-R876 PolarHBondContact OE1-NH2 2.98Å; E804-R876 IonicContact OE2-CZ 2.77Å; E804-R876 IonicContact OE2-NE 2.66Å; E804-R876 IonicContact OE2-NH2 3.43Å; E804-R876 PolarHBondContact OE2-NH2 2.91Å; E804-F877 WeakPolarHBondContact CA-O 3.49Å; E804-T878 WeakPolarHBondContact OE1-CG2 3.19Å
805	A	39.7	Very low	31	Very low	3 Å²	3	81.6 Å²	81.6	3%	0.025	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	139.8	178.3	0	0	0	0	0	111.8	F803 L821 W822 R876 F877	F803-A805 HydrophobicContact CD1-CB 3.71Å; F803-A805 HydrophobicContact CE1-CB 3.41Å; F803-A805 VanDerWaalsContact CE1-CB 3.41Å; F803-A805 HydrophobicContact CZ-CB 4.26Å; A805-L821 HydrophobicContact CB-CD1 3.81Å; A805-W822 CarbonylContact C-O 3.49Å; A805-W822 WeakPolarHBondContact CA-O 3.38Å; A805-R876 WeakPolarHBondContact O-CA 3.38Å; A805-F877 PolarHBondContact N-O 3.15Å; A805-F877 PolarHBondContact O-N 2.97Å
806	I	37.1	Very low	31	Very low	20 Å²	20	78.5 Å²	78.5	10%	0.103	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	112.8	170.2	-57.8	178.2	0	0	0	106.2	L808 W822 T824 L829 C875	I806-L808 HydrophobicContact CG2-CG 4.38Å; I806-W822 PolarHBondContact N-O 3.32Å; I806-W822 WeakPolarHBondContact O-CB 3.12Å; I806-W822 PolarHBondContact O-N 3.22Å; I806-T824 HydrophobicContact CD1-CG2 3.91Å; I806-T824 HydrophobicContact CG1-CG2 4.22Å; I806-L829 HydrophobicContact CD1-CD1 4.13Å; I806-C875 WeakPolarHBondContact CA-O 3.24Å
807	I	41.8	Very low	30.9	Very low	29 Å²	29	77.1 Å²	77.1	15%	0.149	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	120.3	170.5	-59.8	-175	0	0	0	107.8	L821 C875 F877	I807-L821 HydrophobicContact CD1-CD1 4.25Å; I807-L821 HydrophobicContact CG1-CD1 3.8Å; I807-C875 PolarHBondContact N-O 3.03Å; I807-F877 HydrophobicContact CB-CE2 4.19Å; I807-F877 HydrophobicContact CD1-CD2 4.09Å; I807-F877 HydrophobicContact CD1-CE2 3.5Å; I807-F877 HydrophobicContact CD1-CZ 4.03Å; I807-F877 HydrophobicContact CG1-CD2 4.09Å; I807-F877 HydrophobicContact CG1-CE2 3.75Å
808	L	34.4	Very low	30.8	Very low	34 Å²	34	78.2 Å²	78.2	18%	0.178	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	99.5	176.8	-79.9	164.8	0	0	0	109.7	I806 I820 W822 Y874	I806-L808 HydrophobicContact CG2-CG 4.38Å; L808-I820 PolarHBondContact N-O 3.48Å; L808-W822 HydrophobicContact CD1-CD2 3.87Å; L808-W822 HydrophobicContact CD1-CE3 3.85Å; L808-W822 HydrophobicContact CD1-CG 4.28Å; L808-W822 HydrophobicContact CD1-CZ3 4.29Å; L808-Y874 HydrophobicContact CD2-CD1 3.7Å; L808-Y874 HydrophobicContact CD2-CE1 3.3Å
809	F	32.4	Very low	30.9	Very low	45 Å²	45	79.1 Å²	79.1	20%	0.197	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	111.6	174.7	-165.7	-97.7	0	0	0	110.6	Q811 T866 I872	F809-Q811 HydrophobicContact CE1-CB 4.2Å; F809-T866 HydrophobicContact CD2-CG2 4.21Å; F809-T866 HydrophobicContact CE2-CG2 3.71Å; F809-T866 HydrophobicContact CZ-CG2 4.15Å; F809-I872 WeakPolarHBondContact O-CA 3.44Å; F809-I872 WeakPolarHBondContact O-CG2 3.42Å
810	K	30.1	Very low	31	Very low	109 Å²	109	80.7 Å²	80.7	47%	0.474	46%	0.459	S	S	.	.			trans	-137.5	93.2	175.9	-174.3	174.6	-178	176.9	0	111.6	C812 I872	K810-C812 PolarHBondContact O-N 3.14Å; K810-I872 HydrophobicContact CB-CG1 4.28Å; K810-I872 HydrophobicContact CD-CD1 3.85Å; K810-I872 HydrophobicContact CD-CG1 4.45Å; K810-I872 HydrophobicContact CG-CD1 3.97Å; K810-I872 HydrophobicContact CG-CG1 4.03Å
811	Q	27.6	Very low	31.2	Very low	123 Å²	123	79 Å²	79	58%	0.575	45%	0.45	S	S	*	.			trans	-78.1	57.7	178	-161.6	-174.8	7.2	0	0	112.8	F809	F809-Q811 HydrophobicContact CE1-CB 4.2Å
812	C	25.1	Very low	31.5	Very low	86 Å²	86	77.9 Å²	77.9	58%	0.581	44%	0.437	S	S	*	.			trans	-154.5	63.8	172	-99.6	0	0	0	0	111.9	K810	K810-C812 PolarHBondContact O-N 3.14Å
813	C	24.4	Very low	31.7	Very low	110 Å²	110	75.6 Å²	75.6	74%	0.743	43%	0.428	S	S	*	.	S	Bend	trans	-162.1	146.6	155.7	-100.9	0	0	0	0	108.6	L815	C813-L815 PolarHBondContact O-N 2.92Å
814	S	28.5	Very low	31.8	Very low	123 Å²	123	76 Å²	76	86%	0.86	43%	0.432	S	S	*	.	S	Bend	trans	-80.5	41.9	-178.8	60.4	0	0	0	0	113.5
815	L	27.3	Very low	31.7	Very low	142 Å²	142	80.2 Å²	80.2	74%	0.743	46%	0.461	S	S	*	.	S	Bend	trans	-91.8	119.6	159.9	-70.7	166.2	0	0	0	105.4	C813 G817	C813-L815 PolarHBondContact O-N 2.92Å; L815-G817 PolarHBondContact O-N 3.43Å
816	N	29.7	Very low	31.2	Very low	130 Å²	130	83.8 Å²	83.8	70%	0.695	48%	0.484	S	S	*	.			trans	-59.8	82.4	-159.5	-73.4	-29.1	0	0	0	114.9	D818	N816-D818 PolarHBondContact O-N 3.16Å
817	G	29.6	Very low	31.1	Very low	73 Å²	73	89 Å²	89	75%	0.753	51%	0.513	S	S	*	.	S	Bend	trans	67.9	1.4	167.7	0	0	0	0	0	116.3	L815 C819	L815-G817 PolarHBondContact O-N 3.43Å; G817-C819 PolarHBondContact O-N 2.87Å
818	D	28.2	Very low	30.7	Very low	94 Å²	94	94.2 Å²	94.2	50%	0.503	54%	0.537	S	S	.	.			trans	-77.8	125.3	-172.1	-69.1	-44.1	0	0	0	112.5	N816	N816-D818 PolarHBondContact O-N 3.16Å
819	C	32.9	Very low	31	Very low	66 Å²	66	96.8 Å²	96.8	45%	0.446	55%	0.55	S	S	.	.			trans	-79	127.9	177.5	-65.7	0	0	0	0	110.2	G817 L821	G817-C819 PolarHBondContact O-N 2.87Å; C819-L821 PolarHBondContact O-N 3.42Å
820	I	30.7	Very low	31.1	Very low	95 Å²	95	97.1 Å²	97.1	49%	0.487	56%	0.557	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-84.7	105.6	175.9	-58	178	0	0	0	109	L808 W822	L808-I820 PolarHBondContact N-O 3.48Å; I820-W822 HydrophobicContact CG2-CG 4.32Å
821	L	33.7	Very low	31.4	Very low	54 Å²	54	100.6 Å²	100.6	28%	0.283	57%	0.572	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-81.6	110	167.9	-178.4	69	0	0	0	108.9	F803 A805 I807 C819 V823 L882 L897	F803-L821 HydrophobicContact CE1-CD1 4.46Å; F803-L821 HydrophobicContact CE1-CD2 4.39Å; F803-L821 HydrophobicContact CZ-CD2 4.11Å; A805-L821 HydrophobicContact CB-CD1 3.81Å; I807-L821 HydrophobicContact CD1-CD1 4.25Å; I807-L821 HydrophobicContact CG1-CD1 3.8Å; C819-L821 PolarHBondContact O-N 3.42Å; L821-V823 HydrophobicContact CG-CG2 4.41Å; L821-L882 HydrophobicContact CD2-CD1 4.09Å; L821-L897 HydrophobicContact CD2-CD1 4.37Å
822	W	35.2	Very low	31.8	Very low	107 Å²	107	98.3 Å²	98.3	41%	0.405	57%	0.569	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-98.5	121.1	170.6	-90.2	14.4	0	0	0	110.3	A805 I806 L808 I820	A805-W822 CarbonylContact C-O 3.49Å; A805-W822 WeakPolarHBondContact CA-O 3.38Å; I806-W822 PolarHBondContact N-O 3.32Å; I806-W822 WeakPolarHBondContact O-CB 3.12Å; I806-W822 PolarHBondContact O-N 3.22Å; L808-W822 HydrophobicContact CD1-CD2 3.87Å; L808-W822 HydrophobicContact CD1-CE3 3.85Å; L808-W822 HydrophobicContact CD1-CG 4.28Å; L808-W822 HydrophobicContact CD1-CZ3 4.29Å; I820-W822 HydrophobicContact CG2-CG 4.32Å
823	V	33.1	Very low	32.3	Very low	83 Å²	83	97.2 Å²	97.2	50%	0.503	56%	0.557	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-97.9	127.9	176.3	-170	0	0	0	0	108.2	F803 L821	F803-V823 HydrophobicContact CD2-CG1 3.72Å; F803-V823 HydrophobicContact CE1-CG2 4.31Å; F803-V823 HydrophobicContact CE2-CB 4.04Å; F803-V823 HydrophobicContact CE2-CG1 3.31Å; F803-V823 HydrophobicContact CE2-CG2 3.5Å; F803-V823 VanDerWaalsContact CE2-CG2 3.5Å; F803-V823 HydrophobicContact CZ-CB 4.2Å; F803-V823 HydrophobicContact CZ-CG1 3.89Å; F803-V823 HydrophobicContact CZ-CG2 3.3Å; L821-V823 HydrophobicContact CG-CG2 4.41Å
824	T	34.5	Very low	32.8	Very low	31 Å²	31	94.8 Å²	94.8	19%	0.19	54%	0.541	C	S	.	.			trans	-142.4	136	-179.9	115.5	0	0	0	0	110.1	E804 I806 C826	E804-T824 WeakPolarHBondContact CB-O 3.07Å; E804-T824 PolarHBondContact O-N 3.28Å; E804-T824 VanDerWaalsContact O-N 3.11Å; E804-T824 VanDerWaalsContact O-O 3.12Å; I806-T824 HydrophobicContact CD1-CG2 3.91Å; I806-T824 HydrophobicContact CG1-CG2 4.22Å; T824-C826 VanDerWaalsContact C-N 3.32Å; T824-C826 PolarHBondContact OG1-N 2.94Å
825	T	30.1	Very low	33.3	Very low	128 Å²	128	96.2 Å²	96.2	79%	0.785	54%	0.539	S	S	*	.			trans	-92.3	10.1	172.9	51.4	0	0	0	0	113
826	C	29.5	Very low	33.6	Very low	77 Å²	77	94.3 Å²	94.3	52%	0.52	53%	0.525	S	S	.	.			trans	-88.9	113.2	-178.2	-75.4	0	0	0	0	111.3	T824 E828	T824-C826 VanDerWaalsContact C-N 3.32Å; T824-C826 PolarHBondContact OG1-N 2.94Å; C826-E828 PolarHBondContact O-N 2.85Å
827	N	33.5	Very low	33.7	Very low	130 Å²	130	93.9 Å²	93.9	70%	0.695	52%	0.523	S	S	*	.	S	Bend	trans	-57.4	-35.3	175.2	-68.9	-9.2	0	0	0	112.8	R876	N827-R876 PolarHBondContact O-NH1 2.83Å; N827-R876 PolarHBondContact O-NH2 3.21Å
828	E	35.4	Very low	33.9	Very low	139 Å²	139	97.3 Å²	97.3	65%	0.65	52%	0.524	S	S	*	.	S	Bend	trans	-83.6	124.2	174.3	-67.6	-168.9	-159	0	0	110.8	C826 P830	C826-E828 PolarHBondContact O-N 2.85Å; E828-P830 WeakPolarHBondContact O-CD 3.41Å
829	L	39	Very low	34.2	Very low	88 Å²	88	95.3 Å²	95.3	46%	0.461	51%	0.513	S	S	.	.			trans	-56.6	122.5	169.5	-145	89.8	0	0	0	108.3	I806 K831	I806-L829 HydrophobicContact CD1-CD1 4.13Å; L829-K831 PolarHBondContact O-N 3.17Å
830	P	35.5	Very low	34.3	Very low	52 Å²	52	98.5 Å²	98.5	34%	0.338	53%	0.526	S	S	.	.			trans	-65.6	104.4	-170.5	20.6	-30.5	0	0	0	111.5	E828 S832 L833	E828-P830 WeakPolarHBondContact O-CD 3.41Å; P830-S832 PolarHBondContact O-N 3.45Å; P830-L833 HydrophobicContact CG-CD1 4.29Å; P830-L833 PolarHBondContact O-N 3.18Å; P830-L833 VanDerWaalsContact O-N 3.16Å
831	K	35.8	Very low	34.7	Very low	182 Å²	182	98.5 Å²	98.5	79%	0.791	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-13.5	178.3	-68.6	172.6	179	157.8	0	114.2	L829	L829-K831 PolarHBondContact O-N 3.17Å
832	S	36.6	Very low	34.9	Very low	75 Å²	75	99.1 Å²	99.1	52%	0.524	53%	0.532	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	21.4	177.6	62	0	0	0	0	114.8	P830 S834	P830-S832 PolarHBondContact O-N 3.45Å; S832-S834 PolarHBondContact O-N 2.78Å; S832-S834 VanDerWaalsContact O-N 3.08Å
833	L	35.7	Very low	35.2	Very low	62 Å²	62	95.4 Å²	95.4	33%	0.325	52%	0.521	S	S	.	.			trans	-71.2	23.1	156.4	-98.3	139	0	0	0	112.5	P830 N835 F836	P830-L833 HydrophobicContact CG-CD1 4.29Å; P830-L833 PolarHBondContact O-N 3.18Å; P830-L833 VanDerWaalsContact O-N 3.16Å; L833-N835 PolarHBondContact O-N 3Å; L833-F836 HydrophobicContact CD2-CD2 4.25Å; L833-F836 PolarHBondContact O-N 3.07Å
834	S	34.6	Very low	35.6	Very low	59 Å²	59	92.3 Å²	92.3	41%	0.413	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	24.4	-174.8	60.6	0	0	0	0	115.4	S832 N837	S832-S834 PolarHBondContact O-N 2.78Å; S832-S834 VanDerWaalsContact O-N 3.08Å; S834-N837 WeakPolarHBondContact CA-OD1 3.46Å; S834-N837 WeakPolarHBondContact CB-OD1 3.37Å; S834-N837 PolarHBondContact O-ND2 2.86Å; S834-N837 PolarHBondContact O-OD1 3.38Å
835	N	37.8	Very low	35.9	Very low	153 Å²	153	92 Å²	92	82%	0.818	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.4	0.5	162.5	-77.2	-2.2	0	0	0	111.8	L833	L833-N835 PolarHBondContact O-N 3Å
836	F	34.2	Very low	36.6	Very low	102 Å²	102	88.5 Å²	88.5	45%	0.447	47%	0.472	S	S	.	.	S	Bend	trans	-114.8	61	162.6	-68.1	-69.3	0	0	0	109.6	L833 D838 I839	L833-F836 HydrophobicContact CD2-CD2 4.25Å; L833-F836 PolarHBondContact O-N 3.07Å; F836-D838 PolarHBondContact O-N 3.47Å; F836-D838 VanDerWaalsContact O-N 3.12Å; F836-I839 HydrophobicContact CB-CD1 3.83Å; F836-I839 HydrophobicContact CB-CG1 4.28Å
837	N	31.6	Very low	37.3	Very low	122 Å²	122	85.1 Å²	85.1	65%	0.652	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-2.7	-169.5	-78.1	-27.8	0	0	0	116.3	S834	S834-N837 WeakPolarHBondContact CA-OD1 3.46Å; S834-N837 WeakPolarHBondContact CB-OD1 3.37Å; S834-N837 PolarHBondContact O-ND2 2.86Å; S834-N837 PolarHBondContact O-OD1 3.38Å
838	D	34.8	Very low	38	Very low	144 Å²	144	81.8 Å²	81.8	77%	0.77	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.3	28.1	-176.5	-57.1	-51.7	0	0	0	113	F836 Q912	F836-D838 PolarHBondContact O-N 3.47Å; F836-D838 VanDerWaalsContact O-N 3.12Å; D838-Q912 PolarHBondContact O-NE2 3.49Å
839	I	33.8	Very low	38.4	Very low	52 Å²	52	75.8 Å²	75.8	27%	0.267	40%	0.403	S	S	.	.			trans	-97.7	81	171.9	-51.5	-179.9	0	0	0	109.2	F836 I841 Y874	F836-I839 HydrophobicContact CB-CD1 3.83Å; F836-I839 HydrophobicContact CB-CG1 4.28Å; I839-I841 HydrophobicContact CG2-CG1 4.44Å; I839-I841 PolarHBondContact O-N 2.86Å; I839-I841 VanDerWaalsContact O-N 3.09Å; I839-Y874 HydrophobicContact CD1-CE2 3.96Å; I839-Y874 VanDerWaalsContact CD1-OH 3.28Å; I839-Y874 WeakPolarHBondContact CD1-OH 3.22Å
840	D	35.5	Very low	38.8	Very low	134 Å²	134	73.4 Å²	73.4	72%	0.717	39%	0.394	S	S	*	.			trans	-61.6	109.3	162.5	-84.7	-29.3	0	0	0	108.9	T842	D840-T842 PolarHBondContact O-N 2.83Å; D840-T842 VanDerWaalsContact O-N 3.12Å
841	I	38.3	Very low	39.2	Very low	95 Å²	95	78 Å²	78	49%	0.487	40%	0.404	S	S	.	.			trans	-75.4	98.3	174.6	-66.7	169.1	0	0	0	107.5	I839 V844 V910	I839-I841 HydrophobicContact CG2-CG1 4.44Å; I839-I841 PolarHBondContact O-N 2.86Å; I839-I841 VanDerWaalsContact O-N 3.09Å; I841-V844 HydrophobicContact CG2-CG2 3.96Å; I841-V910 HydrophobicContact CB-CG1 4.25Å; I841-V910 HydrophobicContact CD1-CG1 3.8Å; I841-V910 HydrophobicContact CG1-CG1 3.68Å; I841-V910 HydrophobicContact CG2-CG1 3.62Å
842	T	39.4	Very low	39.4	Very low	67 Å²	67	74.1 Å²	74.1	41%	0.411	39%	0.388	S	S	.	.			trans	-84.6	-18.6	-175.7	59	0	0	0	0	113.9	D840 N911 Q912	D840-T842 PolarHBondContact O-N 2.83Å; D840-T842 VanDerWaalsContact O-N 3.12Å; T842-N911 PolarHBondContact OG1-O 2.88Å; T842-Q912 VanDerWaalsContact OG1-C 3.24Å; T842-Q912 PolarHBondContact OG1-O 2.94Å; T842-Q912 VanDerWaalsContact OG1-O 3.07Å
843	T	41.3	Very low	39.3	Very low	29 Å²	29	74.2 Å²	74.2	18%	0.178	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.9	146	174.8	3.5	0	0	0	0	112.6	Y845 N911 L934	T843-Y845 WeakPolarHBondContact CB-OH 3.37Å; T843-Y845 HydrophobicContact CG2-CE2 4.24Å; T843-Y845 WeakPolarHBondContact CG2-OH 3.24Å; T843-Y845 PolarHBondContact OG1-OH 2.85Å; T843-N911 PolarHBondContact O-N 2.94Å; T843-L934 HydrophobicContact CG2-CD1 3.87Å; T843-L934 HydrophobicContact CG2-CD2 4.42Å; T843-L934 HydrophobicContact CG2-CG 4.32Å
844	V	40.5	Very low	39.5	Very low	18 Å²	18	77.9 Å²	77.9	11%	0.109	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	130.3	176.1	-174.4	0	0	0	0	109	I841 I908 I909 V910 D935	I841-V844 HydrophobicContact CG2-CG2 3.96Å; V844-I908 HydrophobicContact CG1-CG2 3.51Å; V844-I909 WeakPolarHBondContact CA-O 3.29Å; V844-V910 HydrophobicContact CG1-CG2 4.22Å; V844-V910 HydrophobicContact CG2-CG2 4.27Å; V844-D935 HydrophobicContact CB-CB 4.15Å; V844-D935 HydrophobicContact CG1-CB 3.85Å; V844-D935 PolarHBondContact O-N 2.84Å
845	Y	40.5	Very low	39.7	Very low	23 Å²	23	79.9 Å²	79.9	9%	0.09	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	129.5	179.2	-61.7	-89.9	0	0	0	110.6	T843 I908 I909 T915 L919 I932 L934	T843-Y845 WeakPolarHBondContact CB-OH 3.37Å; T843-Y845 HydrophobicContact CG2-CE2 4.24Å; T843-Y845 WeakPolarHBondContact CG2-OH 3.24Å; T843-Y845 PolarHBondContact OG1-OH 2.85Å; Y845-I908 CarbonylContact O-C 3.59Å; Y845-I908 WeakPolarHBondContact O-CA 3.46Å; Y845-I909 PolarHBondContact N-O 3.49Å; Y845-I909 PolarHBondContact O-N 3.1Å; Y845-T915 HydrophobicContact CD2-CG2 4.24Å; Y845-T915 HydrophobicContact CE2-CG2 3.49Å; Y845-T915 VanDerWaalsContact CE2-CG2 3.49Å; Y845-T915 PolarHBondContact OH-OG1 3.31Å; Y845-L919 HydrophobicContact CE1-CD1 4.27Å; Y845-I932 HydrophobicContact CD1-CG2 4.35Å; Y845-L934 HydrophobicContact CD1-CD1 4.19Å; Y845-L934 HydrophobicContact CE1-CD1 3.54Å
846	K	45	Very low	39.7	Very low	56 Å²	56	73.8 Å²	73.8	24%	0.243	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	115.6	172.8	-173.7	170.9	-167.7	146	0	109.9	S933 D935	K846-S933 PolarHBondContact N-O 2.8Å; K846-S933 PolarHBondContact O-N 2.85Å; K846-S933 PolarHBondContact O-OG 2.91Å; K846-D935 HydrophobicContact CB-CB 4.27Å
847	V	44.9	Very low	40	Very low	6 Å²	6	73.4 Å²	73.4	4%	0.036	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	107.3	176.6	-175.1	0	0	0	0	108.6	H906 I907 I909 L930 I932	V847-H906 VanDerWaalsContact O-CA 3.27Å; V847-H906 WeakPolarHBondContact O-CA 3.41Å; V847-I907 HydrophobicContact CB-CB 4.28Å; V847-I907 PolarHBondContact N-O 3.08Å; V847-I907 PolarHBondContact O-N 3.27Å; V847-I909 HydrophobicContact CG2-CD1 3.61Å; V847-I909 HydrophobicContact CG2-CG1 4.42Å; V847-L930 HydrophobicContact CG1-CD2 3.81Å; V847-I932 HydrophobicContact CG1-CG1 4.22Å; V847-I932 HydrophobicContact CG2-CG1 4.15Å; V847-I932 HydrophobicContact CG2-CG2 4.34Å
848	N	48	Very low	40.5	Very low	59 Å²	59	68.5 Å²	68.5	32%	0.316	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	123	173.8	-53.9	-78.6	0	0	0	109.1	M931	N848-M931 HydrophobicContact CB-CB 4.21Å; N848-M931 PolarHBondContact N-O 2.98Å; N848-M931 PolarHBondContact ND2-O 3.08Å; N848-M931 PolarHBondContact O-N 3.41Å; N848-M931 VanDerWaalsContact O-N 3.08Å
849	L	43.6	Very low	40.5	Very low	13 Å²	13	67.3 Å²	67.3	7%	0.068	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	115.6	179.3	-75.2	152.8	0	0	0	109.9	L861 F880 Y901 S905 I907 L930	L849-L861 HydrophobicContact CD2-CD2 4.21Å; L849-F880 HydrophobicContact CD1-CE1 3.85Å; L849-F880 HydrophobicContact CD1-CE2 4.48Å; L849-F880 HydrophobicContact CD1-CZ 3.4Å; L849-F880 VanDerWaalsContact CD1-CZ 3.4Å; L849-Y901 HydrophobicContact CB-CD2 4.12Å; L849-Y901 HydrophobicContact CB-CE2 4.16Å; L849-S905 PolarHBondContact N-O 3.48Å; L849-I907 HydrophobicContact CD1-CD1 4.15Å; L849-I907 HydrophobicContact CD1-CG1 4.19Å; L849-L930 HydrophobicContact CD2-CD2 3.48Å; L849-L930 VanDerWaalsContact CD2-CD2 3.48Å; L849-L930 HydrophobicContact CG-CD2 4.3Å
850	S	48.3	Very low	41	Very low	38 Å²	38	68.7 Å²	68.7	27%	0.266	35%	0.354	S	S	.	.			trans	-95.1	130.6	168.8	71.2	0	0	0	0	110.2	K852 S929	S850-K852 PolarHBondContact O-N 3.04Å; S850-S929 PolarHBondContact N-O 2.89Å; S850-S929 PolarHBondContact OG-O 2.86Å
851	R	43.2	Very low	41.4	Very low	148 Å²	148	63 Å²	63	56%	0.558	32%	0.324	S	S	*	.			trans	-71	26.8	-171.8	-160.2	178.6	-172.5	-166.6	1.2	114.8	I853 Y901 D903	R851-I853 VanDerWaalsContact C-N 3.35Å; R851-I853 PolarHBondContact O-N 2.77Å; R851-Y901 HydrophobicContact CB-CE2 4.45Å; R851-Y901 HydrophobicContact CG-CE2 4.43Å; R851-D903 WeakPolarHBondContact CB-OD1 3.29Å
852	K	40.6	Very low	41.5	Very low	102 Å²	102	61.1 Å²	61.1	44%	0.443	31%	0.314	S	S	.	.			trans	-73.3	-16.4	-169.6	-76.9	-174.9	173.8	179.9	0	115.2	S850	S850-K852 PolarHBondContact O-N 3.04Å
853	I	34.1	Very low	41.7	Very low	76 Å²	76	60.6 Å²	60.6	39%	0.39	31%	0.313	S	S	.	.	S	Bend	trans	-127.8	127.4	-178.6	-54.7	179.1	0	0	0	109.2	R851 S855	R851-I853 VanDerWaalsContact C-N 3.35Å; R851-I853 PolarHBondContact O-N 2.77Å; I853-S855 PolarHBondContact O-N 2.63Å
854	K	40	Very low	41.9	Very low	140 Å²	140	60.7 Å²	60.7	61%	0.609	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	125.6	175.4	-76.9	-175.1	173.9	-175.1	0	109.5	V856	K854-V856 PolarHBondContact O-N 3.07Å
855	S	39.5	Very low	42.2	Very low	101 Å²	101	61.1 Å²	61.1	71%	0.706	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	39.8	74.1	169.5	60.3	0	0	0	0	114	I853 N857	I853-S855 PolarHBondContact O-N 2.63Å; S855-N857 PolarHBondContact O-N 3.42Å; S855-N857 VanDerWaalsContact O-N 3.12Å
856	V	37.6	Very low	42.3	Very low	24 Å²	24	62.7 Å²	62.7	15%	0.145	33%	0.325	C	S	.	.			trans	-53.9	119.4	149.3	-179.9	0	0	0	0	105.3	K854 N858 D860 L861 L926	K854-V856 PolarHBondContact O-N 3.07Å; V856-N858 PolarHBondContact O-N 3.4Å; V856-D860 HydrophobicContact CG1-CB 3.92Å; V856-L861 HydrophobicContact CG1-CD1 4.24Å; V856-L861 HydrophobicContact CG1-CG 3.91Å; V856-L926 HydrophobicContact CG2-CD2 4.33Å
857	N	39.6	Very low	42.1	Very low	94 Å²	94	63.2 Å²	63.2	50%	0.503	33%	0.333	S	S	.	.			trans	-59.7	132.2	177.7	-99.8	-28.7	0	0	0	106.8	S855 L859 D860	S855-N857 PolarHBondContact O-N 3.42Å; S855-N857 VanDerWaalsContact O-N 3.12Å; N857-L859 PolarHBondContact O-N 2.86Å; N857-D860 WeakPolarHBondContact O-CB 3.37Å; N857-D860 PolarHBondContact O-N 3.3Å
858	N	41.4	Very low	41.9	Very low	19 Å²	19	67.7 Å²	67.7	10%	0.102	36%	0.364	C	S	.	.	H	α-helix	trans	-61.4	-20.1	-176.9	-74.7	-49.7	0	0	0	112.6	V856 D860 L861 I862 L899	V856-N858 PolarHBondContact O-N 3.4Å; N858-D860 VanDerWaalsContact C-N 3.34Å; N858-D860 PolarHBondContact O-N 2.78Å; N858-L861 PolarHBondContact O-N 2.87Å; N858-I862 WeakPolarHBondContact O-CB 3.32Å; N858-I862 WeakPolarHBondContact O-CG1 3.09Å; N858-I862 PolarHBondContact O-N 3.34Å; N858-L899 PolarHBondContact ND2-N 3.28Å; N858-L899 PolarHBondContact ND2-O 3.23Å; N858-L899 PolarHBondContact OD1-O 2.76Å
859	L	34.7	Very low	41.6	Very low	120 Å²	120	69.6 Å²	69.6	63%	0.628	37%	0.374	S	S	*	.	H	α-helix	trans	-56.2	-40.1	164.7	-83.7	163.2	0	0	0	113.5	N857 S863	N857-L859 PolarHBondContact O-N 2.86Å; L859-S863 WeakPolarHBondContact O-CA 3.37Å; L859-S863 WeakPolarHBondContact O-CB 3.34Å; L859-S863 PolarHBondContact O-N 2.81Å; L859-S863 PolarHBondContact O-OG 3.33Å
860	D	44.2	Very low	41.5	Very low	80 Å²	80	77.1 Å²	77.1	43%	0.428	41%	0.409	S	S	.	.	H	α-helix	trans	-70.8	-40.2	178.9	-57.6	-35.3	0	0	0	111.1	V856 N857 N858 S863 L864	V856-D860 HydrophobicContact CG1-CB 3.92Å; N857-D860 WeakPolarHBondContact O-CB 3.37Å; N857-D860 PolarHBondContact O-N 3.3Å; N858-D860 VanDerWaalsContact C-N 3.34Å; N858-D860 PolarHBondContact O-N 2.78Å; D860-S863 PolarHBondContact O-OG 2.83Å; D860-L864 WeakPolarHBondContact O-CB 3.4Å; D860-L864 PolarHBondContact O-N 2.88Å
861	L	44.2	Very low	41.1	Very low	16 Å²	16	78.4 Å²	78.4	8%	0.084	42%	0.416	C	S	.	.	H	α-helix	trans	-66.4	-43.5	175.6	-83.5	166.4	0	0	0	112.5	L849 V856 N858 L864 F865	L849-L861 HydrophobicContact CD2-CD2 4.21Å; V856-L861 HydrophobicContact CG1-CD1 4.24Å; V856-L861 HydrophobicContact CG1-CG 3.91Å; N858-L861 PolarHBondContact O-N 2.87Å; L861-L864 VanDerWaalsContact O-CB 3.29Å; L861-L864 WeakPolarHBondContact O-CB 3.23Å; L861-F865 WeakPolarHBondContact O-CD2 3.49Å; L861-F865 VanDerWaalsContact O-CE2 3.22Å; L861-F865 WeakPolarHBondContact O-CE2 3.19Å
862	I	41	Very low	41	Very low	54 Å²	54	73.6 Å²	73.6	28%	0.277	40%	0.4	S	S	.	.	H	α-helix	trans	-75.1	-42.4	179.3	-65.7	171.1	0	0	0	110.2	N858 L864 F865 T866	N858-I862 WeakPolarHBondContact O-CB 3.32Å; N858-I862 WeakPolarHBondContact O-CG1 3.09Å; N858-I862 PolarHBondContact O-N 3.34Å; I862-L864 PolarHBondContact O-N 2.88Å; I862-F865 WeakPolarHBondContact O-CA 3.33Å; I862-F865 PolarHBondContact O-N 3.03Å; I862-T866 HydrophobicContact CG2-CG2 4Å; I862-T866 PolarHBondContact O-N 3.47Å
863	S	43	Very low	41.4	Very low	57 Å²	57	69.1 Å²	69.1	40%	0.399	38%	0.381	S	S	.	.	H	α-helix	trans	-66.2	-23.8	177.8	66.9	0	0	0	0	113.7	L859 D860 F865 T866	L859-S863 WeakPolarHBondContact O-CA 3.37Å; L859-S863 WeakPolarHBondContact O-CB 3.34Å; L859-S863 PolarHBondContact O-N 2.81Å; L859-S863 PolarHBondContact O-OG 3.33Å; D860-S863 PolarHBondContact O-OG 2.83Å; S863-F865 PolarHBondContact O-N 2.87Å; S863-T866 WeakPolarHBondContact CA-OG1 3.44Å; S863-T866 PolarHBondContact O-N 3.05Å
864	L	46.4	Very low	42.2	Very low	31 Å²	31	67.1 Å²	67.1	16%	0.162	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.2	-34.5	165.9	-131.1	85.9	0	0	0	112.2	D860 L861 I862 M918 I922 L926	D860-L864 WeakPolarHBondContact O-CB 3.4Å; D860-L864 PolarHBondContact O-N 2.88Å; L861-L864 VanDerWaalsContact O-CB 3.29Å; L861-L864 WeakPolarHBondContact O-CB 3.23Å; I862-L864 PolarHBondContact O-N 2.88Å; L864-M918 WeakPolarHBondContact O-CE 3.19Å; L864-I922 HydrophobicContact CD2-CD1 3.72Å; L864-I922 HydrophobicContact CD2-CG1 4.04Å; L864-I922 HydrophobicContact CD2-CG2 4.21Å; L864-I922 HydrophobicContact CG-CD1 4.33Å; L864-I922 HydrophobicContact CG-CG1 4.24Å; L864-L926 HydrophobicContact CD1-CD1 4.37Å
865	F	46.5	Very low	42.8	Very low	27 Å²	27	60.8 Å²	60.8	12%	0.118	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.6	-19.1	-177.5	-54.1	-56.2	0	0	0	113.7	L861 I862 S863 T867 L873 I907 I909	L861-F865 WeakPolarHBondContact O-CD2 3.49Å; L861-F865 VanDerWaalsContact O-CE2 3.22Å; L861-F865 WeakPolarHBondContact O-CE2 3.19Å; I862-F865 WeakPolarHBondContact O-CA 3.33Å; I862-F865 PolarHBondContact O-N 3.03Å; S863-F865 PolarHBondContact O-N 2.87Å; F865-T867 VanDerWaalsContact C-N 3.27Å; F865-T867 PolarHBondContact O-N 2.84Å; F865-L873 HydrophobicContact CB-CD1 4.42Å; F865-L873 VanDerWaalsContact O-CD1 3.23Å; F865-L873 WeakPolarHBondContact O-CD1 3.44Å; F865-I907 HydrophobicContact CE2-CD1 4.38Å; F865-I909 HydrophobicContact CD1-CD1 4.3Å; F865-I909 HydrophobicContact CE1-CD1 3.37Å; F865-I909 HydrophobicContact CE1-CG1 4.1Å; F865-I909 HydrophobicContact CZ-CD1 3.75Å; F865-I909 HydrophobicContact CZ-CG1 4.34Å
866	T	41.6	Very low	43.4	Very low	56 Å²	56	58.4 Å²	58.4	34%	0.344	32%	0.318	S	S	.	.			trans	-88	26.5	176.4	71.6	0	0	0	0	113.6	F809 I862 S863 S868	F809-T866 HydrophobicContact CD2-CG2 4.21Å; F809-T866 HydrophobicContact CE2-CG2 3.71Å; F809-T866 HydrophobicContact CZ-CG2 4.15Å; I862-T866 HydrophobicContact CG2-CG2 4Å; I862-T866 PolarHBondContact O-N 3.47Å; S863-T866 WeakPolarHBondContact CA-OG1 3.44Å; S863-T866 PolarHBondContact O-N 3.05Å; T866-S868 PolarHBondContact O-N 2.85Å
867	T	41.1	Very low	44.2	Very low	67 Å²	67	57.9 Å²	57.9	41%	0.411	31%	0.314	S	S	.	.			trans	-72.2	85	-174.6	55.9	0	0	0	0	113	F865 N869	F865-T867 VanDerWaalsContact C-N 3.27Å; F865-T867 PolarHBondContact O-N 2.84Å; T867-N869 PolarHBondContact O-N 3.2Å
868	S	42.3	Very low	44.7	Very low	99 Å²	99	53.6 Å²	53.6	69%	0.692	29%	0.291	S	S	*	.	S	Bend	trans	50.7	-11.4	158.2	69.2	0	0	0	0	121	T866	T866-S868 PolarHBondContact O-N 2.85Å
869	N	39.9	Very low	45	Very low	99 Å²	99	55.4 Å²	55.4	53%	0.529	30%	0.301	S	S	.	.	S	Bend	trans	-109.9	146.9	-168	-67.5	5.7	0	0	0	110	T867 T871	T867-N869 PolarHBondContact O-N 3.2Å; N869-T871 PolarHBondContact O-N 2.86Å
870	Q	41.4	Very low	45.6	Very low	171 Å²	171	49.9 Å²	49.9	80%	0.799	27%	0.271	S	S	*	.			trans	-74.1	26.8	-166.6	-62	169.5	-29.6	0	0	114.4
871	T	41.6	Very low	45.7	Very low	65 Å²	65	47.4 Å²	47.4	40%	0.399	26%	0.26	S	S	.	.			trans	-88.1	131.4	-176	45	0	0	0	0	111.5	N869 L873	N869-T871 PolarHBondContact O-N 2.86Å; T871-L873 PolarHBondContact O-N 3.09Å
872	I	40.6	Very low	45.6	Very low	47 Å²	47	47.2 Å²	47.2	24%	0.241	26%	0.259	C	S	.	.			trans	-75.2	108.7	170.8	-56.8	175.1	0	0	0	108	F809 K810 Y874	F809-I872 WeakPolarHBondContact O-CA 3.44Å; F809-I872 WeakPolarHBondContact O-CG2 3.42Å; K810-I872 HydrophobicContact CB-CG1 4.28Å; K810-I872 HydrophobicContact CD-CD1 3.85Å; K810-I872 HydrophobicContact CD-CG1 4.45Å; K810-I872 HydrophobicContact CG-CD1 3.97Å; K810-I872 HydrophobicContact CG-CG1 4.03Å; I872-Y874 HydrophobicContact CB-CE2 4.23Å; I872-Y874 HydrophobicContact CG2-CD2 3.85Å; I872-Y874 HydrophobicContact CG2-CE2 3.34Å
873	L	47.7	Very low	45.6	Very low	8 Å²	8	46.2 Å²	46.2	4%	0.042	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	123.3	173.4	-86.1	157.5	0	0	0	109.1	F865 T871 I909 N911	F865-L873 HydrophobicContact CB-CD1 4.42Å; F865-L873 VanDerWaalsContact O-CD1 3.23Å; F865-L873 WeakPolarHBondContact O-CD1 3.44Å; T871-L873 PolarHBondContact O-N 3.09Å; L873-I909 HydrophobicContact CD2-CG2 3.71Å; L873-N911 HydrophobicContact CD2-CB 4.19Å
874	Y	51.8	Low	45.4	Very low	35 Å²	35	50.1 Å²	50.1	14%	0.137	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	112.9	174.1	-72.6	-100	0	0	0	108.2	L808 I839 I872 V910	L808-Y874 HydrophobicContact CD2-CD1 3.7Å; L808-Y874 HydrophobicContact CD2-CE1 3.3Å; I839-Y874 HydrophobicContact CD1-CE2 3.96Å; I839-Y874 VanDerWaalsContact CD1-OH 3.28Å; I839-Y874 WeakPolarHBondContact CD1-OH 3.22Å; I872-Y874 HydrophobicContact CB-CE2 4.23Å; I872-Y874 HydrophobicContact CG2-CD2 3.85Å; I872-Y874 HydrophobicContact CG2-CE2 3.34Å; Y874-V910 PolarHBondContact N-O 3.21Å; Y874-V910 PolarHBondContact O-N 2.99Å
875	C	52.4	Low	44.9	Very low	7 Å²	7	51.8 Å²	51.8	5%	0.047	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	116.4	178.4	-65.7	0	0	0	0	110.2	I806 I807 F877 I907 I908	I806-C875 WeakPolarHBondContact CA-O 3.24Å; I807-C875 PolarHBondContact N-O 3.03Å; C875-F877 HydrophobicContact CB-CD2 4.28Å; C875-F877 HydrophobicContact CB-CE2 3.51Å; C875-F877 HydrophobicContact CB-CZ 4.06Å; C875-I907 HydrophobicContact CB-CG2 4.3Å; C875-I908 WeakPolarHBondContact CA-O 3.3Å
876	R	53	Low	44.3	Very low	51 Å²	51	55.9 Å²	55.9	19%	0.192	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	119.9	169.5	176.8	-179.6	177.2	166.2	1.8	109	E804 A805 N827 T878 I907 I908	E804-R876 IonicContact OE1-CZ 3.71Å; E804-R876 IonicContact OE1-NE 3.63Å; E804-R876 PolarHBondContact OE1-NE 2.99Å; E804-R876 IonicContact OE1-NH2 3.76Å; E804-R876 PolarHBondContact OE1-NH2 2.98Å; E804-R876 IonicContact OE2-CZ 2.77Å; E804-R876 IonicContact OE2-NE 2.66Å; E804-R876 IonicContact OE2-NH2 3.43Å; E804-R876 PolarHBondContact OE2-NH2 2.91Å; A805-R876 WeakPolarHBondContact O-CA 3.38Å; N827-R876 PolarHBondContact O-NH1 2.83Å; N827-R876 PolarHBondContact O-NH2 3.21Å; R876-T878 HydrophobicContact CG-CG2 4.04Å; R876-I907 WeakPolarHBondContact O-CA 3.48Å; R876-I908 HydrophobicContact CB-CB 4.31Å; R876-I908 PolarHBondContact N-O 3.33Å; R876-I908 PolarHBondContact O-N 3.46Å
877	F	53.3	Low	43.9	Very low	13 Å²	13	58.7 Å²	58.7	6%	0.057	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	130.1	175.8	-66.3	-98.4	0	0	0	108.8	E804 A805 I807 C875 F880 L899 I907	E804-F877 WeakPolarHBondContact CA-O 3.49Å; A805-F877 PolarHBondContact N-O 3.15Å; A805-F877 PolarHBondContact O-N 2.97Å; I807-F877 HydrophobicContact CB-CE2 4.19Å; I807-F877 HydrophobicContact CD1-CD2 4.09Å; I807-F877 HydrophobicContact CD1-CE2 3.5Å; I807-F877 HydrophobicContact CD1-CZ 4.03Å; I807-F877 HydrophobicContact CG1-CD2 4.09Å; I807-F877 HydrophobicContact CG1-CE2 3.75Å; C875-F877 HydrophobicContact CB-CD2 4.28Å; C875-F877 HydrophobicContact CB-CE2 3.51Å; C875-F877 HydrophobicContact CB-CZ 4.06Å; F877-F880 HydrophobicContact CB-CD2 3.69Å; F877-F880 HydrophobicContact CB-CE2 3.94Å; F877-F880 HydrophobicContact CB-CG 4.4Å; F877-F880 HydrophobicContact CD1-CD2 4.11Å; F877-F880 HydrophobicContact CD1-CE1 4.3Å; F877-F880 AromaticContact CD1-CE2 3.76Å; F877-F880 HydrophobicContact CD1-CE2 3.76Å; F877-F880 AromaticContact CD1-CZ 3.84Å; F877-F880 HydrophobicContact CD1-CZ 3.84Å; F877-F880 HydrophobicContact CG-CD2 4.42Å; F877-F880 HydrophobicContact CG-CE2 4.34Å; F877-L899 HydrophobicContact CD1-CD1 4.07Å; F877-L899 HydrophobicContact CE1-CD1 4.09Å; F877-I907 HydrophobicContact CD1-CD1 4.13Å; F877-I907 HydrophobicContact CD1-CG1 3.87Å; F877-I907 HydrophobicContact CD1-CG2 4.39Å; F877-I907 HydrophobicContact CE1-CD1 3.66Å; F877-I907 HydrophobicContact CE1-CG1 3.87Å; F877-I907 HydrophobicContact CE1-CG2 4.11Å; F877-I907 HydrophobicContact CZ-CG2 4.21Å
878	T	50.8	Low	43.4	Very low	4 Å²	4	65.8 Å²	65.8	3%	0.025	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	142.6	-177.9	62.6	0	0	0	0	111.2	E804 R876 F880 S905 H906	E804-T878 WeakPolarHBondContact OE1-CG2 3.19Å; R876-T878 HydrophobicContact CG-CG2 4.04Å; T878-F880 WeakPolarHBondContact O-CD2 3.43Å; T878-F880 WeakPolarHBondContact O-CE2 3.41Å; T878-F880 PolarHBondContact O-N 3.16Å; T878-S905 WeakPolarHBondContact O-CA 3.43Å; T878-H906 PolarHBondContact N-O 2.91Å; T878-H906 PolarHBondContact O-N 2.95Å; T878-H906 PolarHBondContact OG1-CD2 2.59Å; T878-H906 VanDerWaalsContact OG1-CD2 3.3Å; T878-H906 PolarHBondContact OG1-CE1 3.45Å; T878-H906 PolarHBondContact OG1-N 3.16Å; T878-H906 PolarHBondContact OG1-ND1 3.32Å; T878-H906 PolarHBondContact OG1-NE2 3.3Å; T878-H906 PolarHBondContact OG1-O 3.04Å
879	N	47.9	Very low	43.1	Very low	57 Å²	57	66.4 Å²	66.4	31%	0.305	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	54.6	30.3	-176.6	-54.3	-42	0	0	0	114.4	L904 S905	N879-L904 PolarHBondContact ND2-O 3.26Å; N879-S905 PolarHBondContact O-OG 2.74Å
880	F	48	Very low	42.8	Very low	3 Å²	3	67.9 Å²	67.9	1%	0.013	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	158.6	169.1	-69.1	-100.8	0	0	0	109.9	L849 F877 T878 L899 N900 Y901 I907	L849-F880 HydrophobicContact CD1-CE1 3.85Å; L849-F880 HydrophobicContact CD1-CE2 4.48Å; L849-F880 HydrophobicContact CD1-CZ 3.4Å; L849-F880 VanDerWaalsContact CD1-CZ 3.4Å; F877-F880 HydrophobicContact CB-CD2 3.69Å; F877-F880 HydrophobicContact CB-CE2 3.94Å; F877-F880 HydrophobicContact CB-CG 4.4Å; F877-F880 HydrophobicContact CD1-CD2 4.11Å; F877-F880 HydrophobicContact CD1-CE1 4.3Å; F877-F880 AromaticContact CD1-CE2 3.76Å; F877-F880 HydrophobicContact CD1-CE2 3.76Å; F877-F880 AromaticContact CD1-CZ 3.84Å; F877-F880 HydrophobicContact CD1-CZ 3.84Å; F877-F880 HydrophobicContact CG-CD2 4.42Å; F877-F880 HydrophobicContact CG-CE2 4.34Å; T878-F880 WeakPolarHBondContact O-CD2 3.43Å; T878-F880 WeakPolarHBondContact O-CE2 3.41Å; T878-F880 PolarHBondContact O-N 3.16Å; F880-L899 HydrophobicContact CD1-CB 4.01Å; F880-N900 CarbonylContact C-O 3.54Å; F880-N900 VanDerWaalsContact CA-O 3.32Å; F880-N900 WeakPolarHBondContact CA-O 3.49Å; F880-Y901 HydrophobicContact CE1-CG 4.42Å; F880-I907 HydrophobicContact CE2-CG1 4.01Å; F880-I907 HydrophobicContact CZ-CD1 4.14Å; F880-I907 HydrophobicContact CZ-CG1 3.68Å
881	S	46.1	Very low	42.2	Very low	28 Å²	28	63 Å²	63	20%	0.196	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	153	163.7	59.5	0	0	0	0	110	L899 N900	S881-L899 CarbonylContact O-C 3.6Å; S881-L899 WeakPolarHBondContact O-CA 3.26Å; S881-N900 PolarHBondContact N-O 3.2Å; S881-N900 PolarHBondContact O-N 3.04Å; S881-N900 WeakPolarHBondContact OG-CB 3.25Å
882	L	41.3	Very low	41.7	Very low	12 Å²	12	65.2 Å²	65.2	6%	0.063	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	115.4	-174	-161.2	151	0	0	0	108.4	I797 F803 L821 I885 L897 L899	I797-L882 HydrophobicContact CG2-CD2 4.36Å; F803-L882 HydrophobicContact CE1-CD1 4.17Å; F803-L882 HydrophobicContact CZ-CD1 4.28Å; L821-L882 HydrophobicContact CD2-CD1 4.09Å; L882-I885 HydrophobicContact CD2-CG1 4.34Å; L882-L897 HydrophobicContact CD1-CD2 3.69Å; L882-L897 HydrophobicContact CD1-CG 4.3Å; L882-L897 HydrophobicContact CG-CD2 4.1Å; L882-L899 HydrophobicContact CB-CD2 4.48Å; L882-L899 HydrophobicContact CD1-CD2 4.28Å; L882-L899 HydrophobicContact CG-CD2 4.31Å
883	S	40.4	Very low	41.4	Very low	34 Å²	34	65.8 Å²	65.8	24%	0.238	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	151.3	173	53.5	0	0	0	0	111.2	H898 N900	S883-H898 PolarHBondContact N-O 3.12Å; S883-H898 WeakPolarHBondContact OG-CB 3.47Å; S883-H898 PolarHBondContact OG-O 2.77Å; S883-N900 PolarHBondContact OG-ND2 3.14Å
884	E	39	Very low	40.6	Very low	139 Å²	139	70.2 Å²	70.2	65%	0.65	40%	0.395	S	S	*	.			trans	-30.8	125.6	-174.8	-166.8	174.1	176.5	0	0	115.8	I886	E884-I886 PolarHBondContact O-N 2.87Å
885	I	35.9	Very low	39.8	Very low	66 Å²	66	72.6 Å²	72.6	34%	0.338	41%	0.413	S	S	.	.			trans	-78.2	111.1	171	-57.6	172	0	0	0	106.8	L882 P887	L882-I885 HydrophobicContact CD2-CG1 4.34Å; I885-P887 WeakPolarHBondContact O-CD 3.22Å
886	I	34.2	Very low	39.1	Very low	112 Å²	112	74.2 Å²	74.2	57%	0.574	43%	0.425	S	S	*	.			trans	-79.7	112.2	176.7	-58.3	174.9	0	0	0	108.5	E884 R888	E884-I886 PolarHBondContact O-N 2.87Å; I886-R888 PolarHBondContact O-N 3.1Å
887	P	32.5	Very low	38.5	Very low	116 Å²	116	73.2 Å²	73.2	75%	0.753	42%	0.423	S	S	*	.			trans	-74.4	90.7	178.5	31.4	-34.2	0	0	0	109.8	I885 S889	I885-P887 WeakPolarHBondContact O-CD 3.22Å; P887-S889 PolarHBondContact O-N 3.01Å; P887-S889 VanDerWaalsContact O-N 3.12Å
888	R	31.3	Very low	38	Very low	216 Å²	216	76.5 Å²	76.5	82%	0.815	44%	0.438	S	S	*	.			trans	-69.2	108.3	164.9	-99.4	-175	173	162.2	0.4	108.9	I886 S890	I886-R888 PolarHBondContact O-N 3.1Å; R888-S890 PolarHBondContact O-N 3.2Å
889	S	36.4	Very low	37.9	Very low	111 Å²	111	76.9 Å²	76.9	78%	0.776	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	133.8	174	42.5	0	0	0	0	111.1	P887	P887-S889 PolarHBondContact O-N 3.01Å; P887-S889 VanDerWaalsContact O-N 3.12Å
890	S	32.9	Very low	37.9	Very low	131 Å²	131	78 Å²	78	92%	0.916	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.2	10	171.7	77.1	0	0	0	0	121.4	R888	R888-S890 PolarHBondContact O-N 3.2Å
891	S	28.4	Very low	38.1	Very low	68 Å²	68	79.9 Å²	79.9	48%	0.476	45%	0.453	S	S	.	.			trans	-121.5	111.1	165.2	59.6	0	0	0	0	113	S893	S891-S893 PolarHBondContact O-N 2.86Å
892	S	32.8	Very low	38.2	Very low	111 Å²	111	81.7 Å²	81.7	78%	0.776	46%	0.463	S	S	*	.			trans	-79.4	53.6	-178.4	63.9	0	0	0	0	113.2
893	S	34.2	Very low	38.5	Very low	60 Å²	60	85.4 Å²	85.4	42%	0.42	48%	0.483	S	S	.	.	S	Bend	trans	-143	132.6	170.5	56	0	0	0	0	107	S891 T895	S891-S893 PolarHBondContact O-N 2.86Å; S893-T895 PolarHBondContact O-N 3.14Å; S893-T895 PolarHBondContact O-OG1 3.41Å; S893-T895 WeakPolarHBondContact OG-CG2 3.32Å
894	L	31.2	Very low	38.9	Very low	100 Å²	100	90 Å²	90	52%	0.524	50%	0.504	S	S	.	.			trans	-73.9	57.3	-171.6	-144.6	124.6	0	0	0	112.9	S896 L897	L894-S896 PolarHBondContact O-N 3.2Å; L894-L897 HydrophobicContact CD2-CD1 4.42Å
895	T	33.1	Very low	39.4	Very low	86 Å²	86	83.4 Å²	83.4	53%	0.528	47%	0.474	S	S	.	.			trans	-93.8	75.9	-170.3	50.9	0	0	0	0	112.2	S893	S893-T895 PolarHBondContact O-N 3.14Å; S893-T895 PolarHBondContact O-OG1 3.41Å; S893-T895 WeakPolarHBondContact OG-CG2 3.32Å
896	S	38.5	Very low	40.1	Very low	41 Å²	41	82.1 Å²	82.1	29%	0.287	47%	0.466	S	S	.	.			trans	172.9	57.1	148.5	44.6	0	0	0	0	112	L894 H898	L894-S896 PolarHBondContact O-N 3.2Å; S896-H898 PolarHBondContact O-N 3.15Å
897	L	39.8	Very low	41	Very low	29 Å²	29	76.8 Å²	76.8	15%	0.152	44%	0.439	C	S	.	.			trans	-75.6	92.9	173	-152.3	155.7	0	0	0	108.9	L821 L882 L894 L899	L821-L897 HydrophobicContact CD2-CD1 4.37Å; L882-L897 HydrophobicContact CD1-CD2 3.69Å; L882-L897 HydrophobicContact CD1-CG 4.3Å; L882-L897 HydrophobicContact CG-CD2 4.1Å; L894-L897 HydrophobicContact CD2-CD1 4.42Å; L897-L899 HydrophobicContact CD2-CD1 4.34Å; L897-L899 HydrophobicContact CD2-CD2 3.63Å; L897-L899 HydrophobicContact CD2-CG 3.76Å; L897-L899 PolarHBondContact O-N 3.03Å
898	H	44.4	Very low	41.9	Very low	83 Å²	83	72.6 Å²	72.6	38%	0.384	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	106.9	-179.4	-85.1	-96.3	0	0	0	111	S883 S896	S883-H898 PolarHBondContact N-O 3.12Å; S883-H898 WeakPolarHBondContact OG-CB 3.47Å; S883-H898 PolarHBondContact OG-O 2.77Å; S896-H898 PolarHBondContact O-N 3.15Å
899	L	46.9	Very low	43	Very low	12 Å²	12	63.2 Å²	63.2	6%	0.063	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	126.1	170.5	-62.8	173.8	0	0	0	110.1	N858 F877 F880 S881 L882 L897	N858-L899 PolarHBondContact ND2-N 3.28Å; N858-L899 PolarHBondContact ND2-O 3.23Å; N858-L899 PolarHBondContact OD1-O 2.76Å; F877-L899 HydrophobicContact CD1-CD1 4.07Å; F877-L899 HydrophobicContact CE1-CD1 4.09Å; F880-L899 HydrophobicContact CD1-CB 4.01Å; S881-L899 CarbonylContact O-C 3.6Å; S881-L899 WeakPolarHBondContact O-CA 3.26Å; L882-L899 HydrophobicContact CB-CD2 4.48Å; L882-L899 HydrophobicContact CD1-CD2 4.28Å; L882-L899 HydrophobicContact CG-CD2 4.31Å; L897-L899 HydrophobicContact CD2-CD1 4.34Å; L897-L899 HydrophobicContact CD2-CD2 3.63Å; L897-L899 HydrophobicContact CD2-CG 3.76Å; L897-L899 PolarHBondContact O-N 3.03Å
900	N	47.8	Very low	43.7	Very low	79 Å²	79	59 Å²	59	42%	0.422	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	146.6	167.4	-72.6	-41.8	0	0	0	109.1	F880 S881 S883	F880-N900 CarbonylContact C-O 3.54Å; F880-N900 VanDerWaalsContact CA-O 3.32Å; F880-N900 WeakPolarHBondContact CA-O 3.49Å; S881-N900 PolarHBondContact N-O 3.2Å; S881-N900 PolarHBondContact O-N 3.04Å; S881-N900 WeakPolarHBondContact OG-CB 3.25Å; S883-N900 PolarHBondContact OG-ND2 3.14Å
901	Y	53	Low	44.6	Very low	44 Å²	44	53.6 Å²	53.6	17%	0.173	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	161.8	-173.7	70.4	-93.9	0	0	0	112.8	L849 R851 F880	L849-Y901 HydrophobicContact CB-CD2 4.12Å; L849-Y901 HydrophobicContact CB-CE2 4.16Å; R851-Y901 HydrophobicContact CB-CE2 4.45Å; R851-Y901 HydrophobicContact CG-CE2 4.43Å; F880-Y901 HydrophobicContact CE1-CG 4.42Å
902	T	48.8	Very low	45.5	Very low	65 Å²	65	54.7 Å²	54.7	40%	0.399	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	171.2	-179.8	68	0	0	0	0	110.1	L904 S905	T902-L904 PolarHBondContact O-N 2.97Å; T902-L904 VanDerWaalsContact O-N 3.08Å; T902-L904 PolarHBondContact OG1-N 2.91Å; T902-S905 PolarHBondContact N-OG 2.9Å; T902-S905 VanDerWaalsContact O-CB 3.31Å; T902-S905 WeakPolarHBondContact O-CB 3.5Å; T902-S905 PolarHBondContact O-N 2.72Å; T902-S905 PolarHBondContact O-OG 3.22Å; T902-S905 PolarHBondContact OG1-OG 3.02Å
903	D	48.2	Very low	46.2	Very low	91 Å²	91	56.3 Å²	56.3	49%	0.487	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	-5.3	175	-53.3	-59.2	0	0	0	113.6	R851	R851-D903 WeakPolarHBondContact CB-OD1 3.29Å
904	L	47.4	Very low	47	Very low	129 Å²	129	59 Å²	59	68%	0.675	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.7	-3	173.2	-58.8	178.2	0	0	0	112.8	N879 T902 H906	N879-L904 PolarHBondContact ND2-O 3.26Å; T902-L904 PolarHBondContact O-N 2.97Å; T902-L904 VanDerWaalsContact O-N 3.08Å; T902-L904 PolarHBondContact OG1-N 2.91Å; L904-H906 PolarHBondContact O-ND1 2.71Å
905	S	49.2	Very low	47.8	Very low	2 Å²	2	54.8 Å²	54.8	1%	0.014	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	127.5	-178	-54.5	0	0	0	0	111.2	L849 T878 N879 T902	L849-S905 PolarHBondContact N-O 3.48Å; T878-S905 WeakPolarHBondContact O-CA 3.43Å; N879-S905 PolarHBondContact O-OG 2.74Å; T902-S905 PolarHBondContact N-OG 2.9Å; T902-S905 VanDerWaalsContact O-CB 3.31Å; T902-S905 WeakPolarHBondContact O-CB 3.5Å; T902-S905 PolarHBondContact O-N 2.72Å; T902-S905 PolarHBondContact O-OG 3.22Å; T902-S905 PolarHBondContact OG1-OG 3.02Å
906	H	51.6	Low	48.6	Very low	38 Å²	38	55.4 Å²	55.4	18%	0.176	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	144.4	177.6	52.1	-76.3	0	0	0	110.7	V847 T878 L904	V847-H906 VanDerWaalsContact O-CA 3.27Å; V847-H906 WeakPolarHBondContact O-CA 3.41Å; T878-H906 PolarHBondContact N-O 2.91Å; T878-H906 PolarHBondContact O-N 2.95Å; T878-H906 PolarHBondContact OG1-CD2 2.59Å; T878-H906 VanDerWaalsContact OG1-CD2 3.3Å; T878-H906 PolarHBondContact OG1-CE1 3.45Å; T878-H906 PolarHBondContact OG1-N 3.16Å; T878-H906 PolarHBondContact OG1-ND1 3.32Å; T878-H906 PolarHBondContact OG1-NE2 3.3Å; T878-H906 PolarHBondContact OG1-O 3.04Å; L904-H906 PolarHBondContact O-ND1 2.71Å
907	I	53.3	Low	49	Very low	1 Å²	1	57.7 Å²	57.7	1%	0.005	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	123.3	175	-50.5	173.6	0	0	0	106.7	V847 L849 F865 C875 R876 F877 F880 I909	V847-I907 HydrophobicContact CB-CB 4.28Å; V847-I907 PolarHBondContact N-O 3.08Å; V847-I907 PolarHBondContact O-N 3.27Å; L849-I907 HydrophobicContact CD1-CD1 4.15Å; L849-I907 HydrophobicContact CD1-CG1 4.19Å; F865-I907 HydrophobicContact CE2-CD1 4.38Å; C875-I907 HydrophobicContact CB-CG2 4.3Å; R876-I907 WeakPolarHBondContact O-CA 3.48Å; F877-I907 HydrophobicContact CD1-CD1 4.13Å; F877-I907 HydrophobicContact CD1-CG1 3.87Å; F877-I907 HydrophobicContact CD1-CG2 4.39Å; F877-I907 HydrophobicContact CE1-CD1 3.66Å; F877-I907 HydrophobicContact CE1-CG1 3.87Å; F877-I907 HydrophobicContact CE1-CG2 4.11Å; F877-I907 HydrophobicContact CZ-CG2 4.21Å; F880-I907 HydrophobicContact CE2-CG1 4.01Å; F880-I907 HydrophobicContact CZ-CD1 4.14Å; F880-I907 HydrophobicContact CZ-CG1 3.68Å; I907-I909 HydrophobicContact CG2-CG1 4.14Å
908	I	50.9	Low	49.3	Very low	28 Å²	28	58.4 Å²	58.4	14%	0.144	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	118.2	173.1	-59.6	169.6	0	0	0	107.1	V844 Y845 C875 R876 V910	V844-I908 HydrophobicContact CG1-CG2 3.51Å; Y845-I908 CarbonylContact O-C 3.59Å; Y845-I908 WeakPolarHBondContact O-CA 3.46Å; C875-I908 WeakPolarHBondContact CA-O 3.3Å; R876-I908 HydrophobicContact CB-CB 4.31Å; R876-I908 PolarHBondContact N-O 3.33Å; R876-I908 PolarHBondContact O-N 3.46Å; I908-V910 HydrophobicContact CG2-CG2 4.43Å
909	I	53.7	Low	49.4	Very low	19 Å²	19	57.4 Å²	57.4	10%	0.097	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	125.1	-179	-52.4	158.8	0	0	0	108.2	V844 Y845 V847 F865 L873 I907	V844-I909 WeakPolarHBondContact CA-O 3.29Å; Y845-I909 PolarHBondContact N-O 3.49Å; Y845-I909 PolarHBondContact O-N 3.1Å; V847-I909 HydrophobicContact CG2-CD1 3.61Å; V847-I909 HydrophobicContact CG2-CG1 4.42Å; F865-I909 HydrophobicContact CD1-CD1 4.3Å; F865-I909 HydrophobicContact CE1-CD1 3.37Å; F865-I909 HydrophobicContact CE1-CG1 4.1Å; F865-I909 HydrophobicContact CZ-CD1 3.75Å; F865-I909 HydrophobicContact CZ-CG1 4.34Å; L873-I909 HydrophobicContact CD2-CG2 3.71Å; I907-I909 HydrophobicContact CG2-CG1 4.14Å
910	V	52.1	Low	49.4	Very low	22 Å²	22	63 Å²	63	13%	0.133	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	120.4	177.3	174.4	0	0	0	0	107.7	I841 V844 Y874 I908	I841-V910 HydrophobicContact CB-CG1 4.25Å; I841-V910 HydrophobicContact CD1-CG1 3.8Å; I841-V910 HydrophobicContact CG1-CG1 3.68Å; I841-V910 HydrophobicContact CG2-CG1 3.62Å; V844-V910 HydrophobicContact CG1-CG2 4.22Å; V844-V910 HydrophobicContact CG2-CG2 4.27Å; Y874-V910 PolarHBondContact N-O 3.21Å; Y874-V910 PolarHBondContact O-N 2.99Å; I908-V910 HydrophobicContact CG2-CG2 4.43Å
911	N	50.5	Low	49.2	Very low	17 Å²	17	67.3 Å²	67.3	9%	0.091	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	152.6	-173.2	-170.4	11.2	0	0	0	111.4	T842 T843 L873 M913	T842-N911 PolarHBondContact OG1-O 2.88Å; T843-N911 PolarHBondContact O-N 2.94Å; L873-N911 HydrophobicContact CD2-CB 4.19Å; N911-M913 PolarHBondContact ND2-O 2.93Å; N911-M913 VanDerWaalsContact ND2-O 3.09Å
912	Q	47.4	Very low	48.8	Very low	91 Å²	91	67 Å²	67	43%	0.425	35%	0.351	S	S	.	.	S	Bend	trans	-92.2	-18.4	-176.3	-165.7	174.2	23	0	0	113.6	D838 T842	D838-Q912 PolarHBondContact O-NE2 3.49Å; T842-Q912 VanDerWaalsContact OG1-C 3.24Å; T842-Q912 PolarHBondContact OG1-O 2.94Å; T842-Q912 VanDerWaalsContact OG1-O 3.07Å
913	M	49	Very low	48.3	Very low	146 Å²	146	67.5 Å²	67.5	72%	0.719	36%	0.357	S	S	*	.	S	Bend	trans	-144.6	157.6	-176.9	-78.5	-147.4	176.2	0	0	116.5	N911 T915	N911-M913 PolarHBondContact ND2-O 2.93Å; N911-M913 VanDerWaalsContact ND2-O 3.09Å; M913-T915 PolarHBondContact O-N 3.19Å
914	N	50.7	Low	48.2	Very low	115 Å²	115	68.9 Å²	68.9	62%	0.615	37%	0.369	S	S	*	.			trans	-49	115	-164.3	-168	-7.1	0	0	0	115.3	D916	N914-D916 PolarHBondContact O-N 3.02Å; N914-D916 PolarHBondContact OD1-N 2.83Å
915	T	48.5	Very low	47.9	Very low	13 Å²	13	70.5 Å²	70.5	8%	0.08	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-8.8	-170.4	48.8	0	0	0	0	115.6	Y845 M913 S917 M918 L919	Y845-T915 HydrophobicContact CD2-CG2 4.24Å; Y845-T915 HydrophobicContact CE2-CG2 3.49Å; Y845-T915 VanDerWaalsContact CE2-CG2 3.49Å; Y845-T915 PolarHBondContact OH-OG1 3.31Å; M913-T915 PolarHBondContact O-N 3.19Å; T915-S917 PolarHBondContact O-N 3.14Å; T915-M918 WeakPolarHBondContact O-CA 3.28Å; T915-M918 PolarHBondContact O-N 3.32Å; T915-L919 PolarHBondContact O-N 2.98Å
916	D	50.1	Low	47.4	Very low	99 Å²	99	72.4 Å²	72.4	53%	0.529	38%	0.383	S	S	.	.	H	α-helix	trans	-52.8	-35	-176.7	-80.2	-22.1	0	0	0	112.4	N914 N920	N914-D916 PolarHBondContact O-N 3.02Å; N914-D916 PolarHBondContact OD1-N 2.83Å; D916-N920 WeakPolarHBondContact O-CB 3.29Å; D916-N920 PolarHBondContact O-N 3.23Å; D916-N920 PolarHBondContact O-ND2 3.31Å
917	S	46.7	Very low	47	Very low	89 Å²	89	74.1 Å²	74.1	62%	0.622	40%	0.399	S	S	*	.	H	α-helix	trans	-74	-25.7	177.3	71.4	0	0	0	0	114.5	T915 K921	T915-S917 PolarHBondContact O-N 3.14Å; S917-K921 WeakPolarHBondContact O-CG 3.48Å
918	M	45.1	Very low	46.5	Very low	44 Å²	44	79.8 Å²	79.8	22%	0.217	43%	0.43	C	S	.	.	H	α-helix	trans	-85.9	-46.4	176.8	-108.9	-158.8	87	0	0	111.6	L864 T915 N920 K921 I922	L864-M918 WeakPolarHBondContact O-CE 3.19Å; T915-M918 WeakPolarHBondContact O-CA 3.28Å; T915-M918 PolarHBondContact O-N 3.32Å; M918-N920 VanDerWaalsContact C-N 3.29Å; M918-N920 PolarHBondContact O-N 3.04Å; M918-K921 WeakPolarHBondContact O-CA 3.36Å; M918-K921 WeakPolarHBondContact O-CB 3.42Å; M918-K921 PolarHBondContact O-N 2.87Å; M918-I922 PolarHBondContact O-N 2.98Å
919	L	47.4	Very low	46.1	Very low	62 Å²	62	78.9 Å²	78.9	33%	0.325	43%	0.425	S	S	.	.	H	α-helix	trans	-61.2	-39.3	179.5	-72.1	166.8	0	0	0	111.3	Y845 T915 K921 I922 I932	Y845-L919 HydrophobicContact CE1-CD1 4.27Å; T915-L919 PolarHBondContact O-N 2.98Å; L919-K921 PolarHBondContact O-N 2.91Å; L919-I922 HydrophobicContact CD2-CD1 4.29Å; L919-I922 PolarHBondContact O-N 3.39Å; L919-I922 VanDerWaalsContact O-N 3.15Å; L919-I932 HydrophobicContact CD2-CD1 3.67Å; L919-I932 HydrophobicContact CD2-CG2 4.23Å
920	N	46.6	Very low	45.7	Very low	129 Å²	129	79 Å²	79	69%	0.69	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-19.7	173.3	-76.6	-50.4	0	0	0	113.9	D916 M918	D916-N920 WeakPolarHBondContact O-CB 3.29Å; D916-N920 PolarHBondContact O-N 3.23Å; D916-N920 PolarHBondContact O-ND2 3.31Å; M918-N920 VanDerWaalsContact C-N 3.29Å; M918-N920 PolarHBondContact O-N 3.04Å
921	K	44	Very low	45.5	Very low	170 Å²	170	83.2 Å²	83.2	74%	0.739	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-13.9	173.3	-80.1	-179.8	176.8	-179.7	0	113.9	S917 M918 L919 S923	S917-K921 WeakPolarHBondContact O-CG 3.48Å; M918-K921 WeakPolarHBondContact O-CA 3.36Å; M918-K921 WeakPolarHBondContact O-CB 3.42Å; M918-K921 PolarHBondContact O-N 2.87Å; L919-K921 PolarHBondContact O-N 2.91Å; K921-S923 PolarHBondContact O-N 3.43Å
922	I	43.1	Very low	45.2	Very low	38 Å²	38	85.3 Å²	85.3	20%	0.195	46%	0.456	C	S	.	.	S	Bend	trans	-79.5	47.5	173.6	-55.9	167.6	0	0	0	108.7	L864 M918 L919 T924	L864-I922 HydrophobicContact CD2-CD1 3.72Å; L864-I922 HydrophobicContact CD2-CG1 4.04Å; L864-I922 HydrophobicContact CD2-CG2 4.21Å; L864-I922 HydrophobicContact CG-CD1 4.33Å; L864-I922 HydrophobicContact CG-CG1 4.24Å; M918-I922 PolarHBondContact O-N 2.98Å; L919-I922 HydrophobicContact CD2-CD1 4.29Å; L919-I922 PolarHBondContact O-N 3.39Å; L919-I922 VanDerWaalsContact O-N 3.15Å; I922-T924 PolarHBondContact O-N 3.36Å
923	S	38.3	Very low	45.1	Very low	75 Å²	75	83.1 Å²	83.1	52%	0.524	45%	0.451	S	S	.	.			trans	-74.6	119.7	-158.1	59.3	0	0	0	0	113.3	K921 Q925	K921-S923 PolarHBondContact O-N 3.43Å; S923-Q925 VanDerWaalsContact C-N 3.25Å; S923-Q925 PolarHBondContact O-N 2.87Å
924	T	45.8	Very low	44.7	Very low	119 Å²	119	79.3 Å²	79.3	73%	0.73	43%	0.433	S	S	*	.	S	Bend	trans	62.6	-20.8	155.3	59.1	0	0	0	0	120.5	I922	I922-T924 PolarHBondContact O-N 3.36Å
925	Q	41	Very low	44.4	Very low	163 Å²	163	75.4 Å²	75.4	76%	0.762	41%	0.413	S	S	*	.	S	Bend	trans	-93.3	-22.1	178.6	-72.8	-171.4	-16.3	0	0	114.1	S923	S923-Q925 VanDerWaalsContact C-N 3.25Å; S923-Q925 PolarHBondContact O-N 2.87Å
926	L	39.9	Very low	44.2	Very low	43 Å²	43	80.5 Å²	80.5	23%	0.225	44%	0.439	C	S	.	.	S	Bend	trans	-117.3	0.7	-177.4	-71.6	170.3	0	0	0	114.4	V856 L864 D928 S929 L930	V856-L926 HydrophobicContact CG2-CD2 4.33Å; L864-L926 HydrophobicContact CD1-CD1 4.37Å; L926-D928 PolarHBondContact O-N 2.83Å; L926-D928 VanDerWaalsContact O-N 3.14Å; L926-S929 PolarHBondContact O-N 2.86Å; L926-S929 PolarHBondContact O-OG 3.44Å; L926-S929 VanDerWaalsContact O-OG 3.1Å; L926-L930 HydrophobicContact CB-CD1 4.16Å; L926-L930 PolarHBondContact O-N 3.24Å
927	S	42.5	Very low	44	Very low	73 Å²	73	83.5 Å²	83.5	51%	0.51	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-24.4	175.6	47.8	0	0	0	0	113.4
928	D	42.8	Very low	43.7	Very low	121 Å²	121	88.2 Å²	88.2	65%	0.647	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-13.7	-173.5	-65.7	14.6	0	0	0	112.8	L926	L926-D928 PolarHBondContact O-N 2.83Å; L926-D928 VanDerWaalsContact O-N 3.14Å
929	S	43.2	Very low	43.1	Very low	8 Å²	8	90.5 Å²	90.5	6%	0.056	47%	0.469	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.5	-26.2	-178.2	50.9	0	0	0	0	114.9	S850 L926	S850-S929 PolarHBondContact N-O 2.89Å; S850-S929 PolarHBondContact OG-O 2.86Å; L926-S929 PolarHBondContact O-N 2.86Å; L926-S929 PolarHBondContact O-OG 3.44Å; L926-S929 VanDerWaalsContact O-OG 3.1Å
930	L	44.2	Very low	42.3	Very low	21 Å²	21	95.8 Å²	95.8	11%	0.11	50%	0.497	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	109.5	-172.8	-64.6	172.1	0	0	0	111.8	V847 L849 L926 I932	V847-L930 HydrophobicContact CG1-CD2 3.81Å; L849-L930 HydrophobicContact CD2-CD2 3.48Å; L849-L930 VanDerWaalsContact CD2-CD2 3.48Å; L849-L930 HydrophobicContact CG-CD2 4.3Å; L926-L930 HydrophobicContact CB-CD1 4.16Å; L926-L930 PolarHBondContact O-N 3.24Å; L930-I932 HydrophobicContact CB-CG1 4.38Å; L930-I932 PolarHBondContact O-N 3.5Å
931	M	48.7	Very low	41.5	Very low	112 Å²	112	92.9 Å²	92.9	55%	0.552	49%	0.487	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.1	94.2	168.9	-84.3	-64	-56.6	0	0	109.4	N848	N848-M931 HydrophobicContact CB-CB 4.21Å; N848-M931 PolarHBondContact N-O 2.98Å; N848-M931 PolarHBondContact ND2-O 3.08Å; N848-M931 PolarHBondContact O-N 3.41Å; N848-M931 VanDerWaalsContact O-N 3.08Å
932	I	44.1	Very low	40.7	Very low	60 Å²	60	90.9 Å²	90.9	31%	0.308	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	122.1	174.5	-51.1	180	0	0	0	108.8	Y845 V847 L919 L930	Y845-I932 HydrophobicContact CD1-CG2 4.35Å; V847-I932 HydrophobicContact CG1-CG1 4.22Å; V847-I932 HydrophobicContact CG2-CG1 4.15Å; V847-I932 HydrophobicContact CG2-CG2 4.34Å; L919-I932 HydrophobicContact CD2-CD1 3.67Å; L919-I932 HydrophobicContact CD2-CG2 4.23Å; L930-I932 HydrophobicContact CB-CG1 4.38Å; L930-I932 PolarHBondContact O-N 3.5Å
933	S	44.6	Very low	40.1	Very low	46 Å²	46	96.2 Å²	96.2	32%	0.322	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	146.6	172.4	52.7	0	0	0	0	110.3	K846	K846-S933 PolarHBondContact N-O 2.8Å; K846-S933 PolarHBondContact O-N 2.85Å; K846-S933 PolarHBondContact O-OG 2.91Å
934	L	41.7	Very low	39.4	Very low	66 Å²	66	99 Å²	99	35%	0.346	53%	0.532	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60	136.1	162.4	-141.4	90	0	0	0	108.1	T843 Y845 N936	T843-L934 HydrophobicContact CG2-CD1 3.87Å; T843-L934 HydrophobicContact CG2-CD2 4.42Å; T843-L934 HydrophobicContact CG2-CG 4.32Å; Y845-L934 HydrophobicContact CD1-CD1 4.19Å; Y845-L934 HydrophobicContact CE1-CD1 3.54Å; L934-N936 PolarHBondContact O-N 2.92Å; L934-N936 PolarHBondContact O-OD1 2.85Å
935	D	44.7	Very low	38.5	Very low	33 Å²	33	99.1 Å²	99.1	18%	0.176	53%	0.533	C	S	.	.			trans	-86.8	95.5	175.6	-138.1	-12.1	0	0	0	108.8	V844 K846 E937	V844-D935 HydrophobicContact CB-CB 4.15Å; V844-D935 HydrophobicContact CG1-CB 3.85Å; V844-D935 PolarHBondContact O-N 2.84Å; K846-D935 HydrophobicContact CB-CB 4.27Å; D935-E937 PolarHBondContact O-N 3.33Å
936	N	44.5	Very low	37.7	Very low	119 Å²	119	100.9 Å²	100.9	64%	0.636	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	2.4	-168.2	-72.1	-4.2	0	0	0	114.9	L934 Y938	L934-N936 PolarHBondContact O-N 2.92Å; L934-N936 PolarHBondContact O-OD1 2.85Å; N936-Y938 PolarHBondContact O-N 2.8Å
937	E	44.9	Very low	36.9	Very low	163 Å²	163	107.3 Å²	107.3	76%	0.762	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	-15.7	175.4	-70.3	-169.5	168.8	0	0	113.2	D935	D935-E937 PolarHBondContact O-N 3.33Å
938	Y	40.1	Very low	36	Very low	187 Å²	187	108.9 Å²	108.9	73%	0.733	58%	0.575	S	S	*	*	S	Bend	trans	-122.1	-2.2	-171.5	-78.7	-81.6	0	0	0	117.5	N936	N936-Y938 PolarHBondContact O-N 2.8Å
939	D	32.2	Very low	35	Very low	93 Å²	93	112.4 Å²	112.4	50%	0.497	59%	0.585	S	S	.	*			trans	-149.9	132	174.9	-135.2	-24.6	0	0	0	115.7	S941	D939-S941 VanDerWaalsContact C-N 3.34Å; D939-S941 PolarHBondContact O-N 2.79Å
940	N	32	Very low	33.9	Very low	172 Å²	172	119.6 Å²	119.6	92%	0.92	62%	0.622	S	S	*	*			trans	-91.4	28.2	-168.3	-83.3	-54	0	0	0	114
941	S	28.3	Very low	32.9	Very low	68 Å²	68	125.7 Å²	125.7	48%	0.476	65%	0.654	S	S	.	*			trans	-104.5	132.2	-176.7	70.1	0	0	0	0	113.2	D939 I943	D939-S941 VanDerWaalsContact C-N 3.34Å; D939-S941 PolarHBondContact O-N 2.79Å; S941-I943 PolarHBondContact O-N 2.81Å
942	P	28.2	Very low	31.6	Very low	129 Å²	129	126.6 Å²	126.6	84%	0.838	66%	0.66	S	S	*	*			trans	-87.9	111.2	-173	32.5	-32.6	0	0	0	111.7
943	I	29.8	Very low	30.6	Very low	150 Å²	150	128.5 Å²	128.5	77%	0.769	68%	0.678	S	S	*	*			trans	-119.2	134	174.5	-60.2	-175.7	0	0	0	112.1	S941 T945	S941-I943 PolarHBondContact O-N 2.81Å; I943-T945 PolarHBondContact O-N 2.98Å
944	V	25.3	Very low	29.6	Very low	132 Å²	132	131 Å²	131	80%	0.8	69%	0.688	S	S	*	*			trans	-52.9	119	-168.7	-179.1	0	0	0	0	113.6	K946	V944-K946 PolarHBondContact O-N 2.83Å; V944-K946 VanDerWaalsContact O-N 3.14Å
945	T	26	Very low	28.9	Very low	123 Å²	123	133.2 Å²	133.2	76%	0.755	70%	0.7	S	S	*	*			trans	-63.7	107.2	164.8	38.9	0	0	0	0	110.7	I943 E947	I943-T945 PolarHBondContact O-N 2.98Å; T945-E947 PolarHBondContact O-N 3.07Å
946	K	24.9	Very low	28.2	Very low	199 Å²	199	139.1 Å²	139.1	87%	0.865	72%	0.721	S	S	*	*			trans	-69.8	109.2	159.4	-81.8	-176.5	177.4	173.5	0	107.9	V944 P948	V944-K946 PolarHBondContact O-N 2.83Å; V944-K946 VanDerWaalsContact O-N 3.14Å; K946-P948 VanDerWaalsContact O-CD 3.29Å; K946-P948 WeakPolarHBondContact O-CD 3.4Å; K946-P948 VanDerWaalsContact O-N 3.15Å
947	E	22.4	Very low	27.6	Very low	179 Å²	179	137.4 Å²	137.4	84%	0.836	71%	0.712	S	S	*	*			trans	-52.8	114.8	-177.9	-66.1	-176.2	139.1	0	0	111.7	T945 K949	T945-E947 PolarHBondContact O-N 3.07Å; E947-K949 PolarHBondContact O-N 3.45Å
948	P	23.2	Very low	27.5	Very low	105 Å²	105	131.4 Å²	131.4	68%	0.682	68%	0.682	S	S	*	*			trans	-73.8	119.5	174.5	29.1	-31.2	0	0	0	108.9	K946 L950	K946-P948 VanDerWaalsContact O-CD 3.29Å; K946-P948 WeakPolarHBondContact O-CD 3.4Å; K946-P948 VanDerWaalsContact O-N 3.15Å; P948-L950 PolarHBondContact O-N 2.93Å
949	K	21.5	Very low	27.5	Very low	196 Å²	196	123.9 Å²	123.9	85%	0.852	66%	0.655	S	S	*	*			trans	-59.4	125.4	177.2	-85.3	179.8	176.3	175.4	0	110.7	E947 L951	E947-K949 PolarHBondContact O-N 3.45Å; K949-L951 PolarHBondContact O-N 2.95Å
950	L	21.1	Very low	27.3	Very low	158 Å²	158	121 Å²	121	83%	0.827	65%	0.647	S	S	*	*			trans	-58.5	102.6	-176.9	-154.9	154.7	0	0	0	110.9	P948 I952	P948-L950 PolarHBondContact O-N 2.93Å; L950-I952 HydrophobicContact CD2-CG1 4.25Å
951	L	22.3	Very low	27.3	Very low	149 Å²	149	123.5 Å²	123.5	78%	0.78	64%	0.643	S	S	*	*			trans	-123.5	120.2	172.8	-88.8	168	0	0	0	110.2	K949	K949-L951 PolarHBondContact O-N 2.95Å
952	I	22.3	Very low	27.2	Very low	132 Å²	132	125.5 Å²	125.5	68%	0.677	66%	0.658	S	S	*	*			trans	-67.3	153.3	-163.2	-65.6	164.9	0	0	0	111.6	L950 N954	L950-I952 HydrophobicContact CD2-CG1 4.25Å; I952-N954 PolarHBondContact O-N 3.21Å
953	S	23.6	Very low	27.2	Very low	100 Å²	100	126.3 Å²	126.3	70%	0.699	65%	0.654	S	S	*	*			trans	-57.6	124.2	-174	50.8	0	0	0	0	114.5
954	N	23.9	Very low	26.9	Very low	97 Å²	97	123.7 Å²	123.7	52%	0.519	65%	0.649	S	S	.	*			trans	-104	78.2	169.4	-70.5	-6.5	0	0	0	110.4	I952	I952-N954 PolarHBondContact O-N 3.21Å
955	N	26.8	Very low	26.9	Very low	113 Å²	113	124 Å²	124	60%	0.604	65%	0.651	S	S	*	*	S	Bend	trans	-77.7	139.6	154	-82.3	-2	0	0	0	107.6	D957	N955-D957 VanDerWaalsContact C-N 3.31Å; N955-D957 PolarHBondContact O-N 3.16Å
956	Y	28.8	Very low	27.1	Very low	158 Å²	158	121.2 Å²	121.2	62%	0.62	65%	0.647	S	S	*	*			trans	-20.4	80.2	-175.2	-103	-93.2	0	0	0	115.6	W958	Y956-W958 VanDerWaalsContact C-N 3.33Å; Y956-W958 PolarHBondContact O-N 2.99Å
957	D	32.5	Very low	27	Very low	82 Å²	82	122.2 Å²	122.2	44%	0.439	65%	0.646	S	S	.	*			trans	-82	86.4	-179.3	-174.9	9	0	0	0	108.5	N955 I959 G960	N955-D957 VanDerWaalsContact C-N 3.31Å; N955-D957 PolarHBondContact O-N 3.16Å; D957-I959 PolarHBondContact O-N 3.14Å; D957-I959 VanDerWaalsContact OD1-CA 3.32Å; D957-I959 WeakPolarHBondContact OD1-CA 3.16Å; D957-I959 WeakPolarHBondContact OD1-CB 3.1Å; D957-I959 PolarHBondContact OD1-N 2.74Å; D957-G960 PolarHBondContact O-N 3.46Å; D957-G960 PolarHBondContact OD1-N 3.37Å; D957-G960 VanDerWaalsContact OD1-N 3.14Å; D957-G960 WeakPolarHBondContact OD2-CA 3.35Å; D957-G960 PolarHBondContact OD2-N 3.09Å
958	W	43.1	Very low	27.3	Very low	37 Å²	37	118.3 Å²	118.3	14%	0.14	64%	0.639	C	S	.	*	T	Hydrogen-bonded Turn	trans	-65.8	3.3	171.6	59.3	-82.3	0	0	0	112.6	Y956 L974 I979 V981 I1019 S1023 A1026 Y1223	Y956-W958 VanDerWaalsContact C-N 3.33Å; Y956-W958 PolarHBondContact O-N 2.99Å; W958-L974 WeakPolarHBondContact O-CD1 3.47Å; W958-L974 WeakPolarHBondContact O-CD2 3.35Å; W958-I979 HydrophobicContact CE3-CD1 3.98Å; W958-I979 HydrophobicContact CZ3-CD1 3.75Å; W958-V981 HydrophobicContact CH2-CG1 4.19Å; W958-V981 HydrophobicContact CH2-CG2 4.2Å; W958-V981 HydrophobicContact CZ2-CG1 4.11Å; W958-V981 HydrophobicContact CZ3-CG2 4.26Å; W958-I1019 HydrophobicContact CH2-CD1 4.37Å; W958-S1023 PolarHBondContact NE1-OG 2.91Å; W958-A1026 HydrophobicContact CH2-CB 3.44Å; W958-A1026 VanDerWaalsContact CH2-CB 3.44Å; W958-A1026 HydrophobicContact CZ2-CB 4.33Å; W958-A1026 HydrophobicContact CZ3-CB 3.83Å; W958-Y1223 HydrophobicContact CZ3-CE2 4.15Å
959	I	39.4	Very low	27.7	Very low	30 Å²	30	120.9 Å²	120.9	15%	0.154	65%	0.647	C	S	.	*	T	Hydrogen-bonded Turn	trans	-105.4	-19.1	171.9	-51.4	158.3	0	0	0	110.4	D957 S1025 K1221	D957-I959 PolarHBondContact O-N 3.14Å; D957-I959 VanDerWaalsContact OD1-CA 3.32Å; D957-I959 WeakPolarHBondContact OD1-CA 3.16Å; D957-I959 WeakPolarHBondContact OD1-CB 3.1Å; D957-I959 PolarHBondContact OD1-N 2.74Å; I959-S1025 WeakPolarHBondContact CD1-O 3.45Å; I959-K1221 HydrophobicContact CG2-CB 4.23Å; I959-K1221 HydrophobicContact CG2-CD 3.91Å; I959-K1221 HydrophobicContact CG2-CG 3.89Å; I959-K1221 WeakPolarHBondContact O-CE 3.34Å; I959-K1221 PolarHBondContact O-NZ 3.21Å
960	G	29	Very low	28.1	Very low	33 Å²	33	118.6 Å²	118.6	34%	0.34	64%	0.642	S	S	.	*			trans	-68.9	146	-177.6	0	0	0	0	0	114.9	D957	D957-G960 PolarHBondContact O-N 3.46Å; D957-G960 PolarHBondContact OD1-N 3.37Å; D957-G960 VanDerWaalsContact OD1-N 3.14Å; D957-G960 WeakPolarHBondContact OD2-CA 3.35Å; D957-G960 PolarHBondContact OD2-N 3.09Å
961	R	30.2	Very low	28.5	Very low	223 Å²	223	117.8 Å²	117.8	84%	0.842	63%	0.634	S	S	*	*			trans	-119.1	146.4	170.3	-145.2	-176.4	-164.8	-172.2	3.4	108.3
962	S	27.6	Very low	29	Very low	111 Å²	111	112.5 Å²	112.5	78%	0.776	62%	0.616	S	S	*	*			trans	53.8	101.2	168.5	55.3	0	0	0	0	117.8
963	I	27.6	Very low	29.6	Very low	146 Å²	146	110.8 Å²	110.8	75%	0.749	61%	0.608	S	S	*	*			trans	-98	136	136.8	-62	178.3	0	0	0	106.4
964	S	24.7	Very low	30.2	Very low	95 Å²	95	108.8 Å²	108.8	66%	0.664	59%	0.589	S	S	*	*			trans	-74	141.3	-165.7	47.3	0	0	0	0	114.2
965	T	24.9	Very low	30.8	Very low	139 Å²	139	111 Å²	111	85%	0.853	60%	0.595	S	S	*	*	S	Bend	trans	49.1	105.7	148.6	56.3	0	0	0	0	117.8
966	G	28.8	Very low	31.7	Very low	64 Å²	64	111.2 Å²	111.2	66%	0.66	59%	0.59	S	S	*	*	S	Bend	trans	-168.7	-63.2	164.6	0	0	0	0	0	113.1
967	Y	24.5	Very low	32.9	Very low	220 Å²	220	109.3 Å²	109.3	86%	0.863	59%	0.587	S	S	*	*			trans	-131.7	135.9	-167.4	-70.5	-83.2	0	0	0	113.6
968	S	28	Very low	34.7	Very low	96 Å²	96	109.6 Å²	109.6	67%	0.671	59%	0.585	S	S	*	*	S	Bend	trans	-70.7	140.1	-175.9	47.7	0	0	0	0	113.6	I970	S968-I970 PolarHBondContact O-N 3.32Å
969	N	31.5	Very low	36.1	Very low	160 Å²	160	109.1 Å²	109.1	86%	0.856	59%	0.585	S	S	*	*			trans	60.5	31.2	152.5	-57.8	5.8	0	0	0	118.3
970	I	29.9	Very low	37.8	Very low	148 Å²	148	113.9 Å²	113.9	76%	0.759	61%	0.611	S	S	*	*			trans	-101.9	85.5	155.6	-54.3	178.7	0	0	0	107.7	S968 G972	S968-I970 PolarHBondContact O-N 3.32Å; I970-G972 PolarHBondContact O-N 3.25Å
971	E	28.8	Very low	39.9	Very low	140 Å²	140	113.2 Å²	113.2	65%	0.654	60%	0.6	S	S	*	*			trans	-59.5	118.5	167.2	-73.1	-176.1	140.8	0	0	108.7	F975	E971-F975 HydrophobicContact CB-CB 4.37Å; E971-F975 HydrophobicContact CB-CD2 3.96Å; E971-F975 HydrophobicContact CG-CD2 3.93Å; E971-F975 HydrophobicContact CG-CE2 4.45Å; E971-F975 HydrophobicContact CG-CG 4.48Å
972	G	32.4	Very low	42.1	Very low	38 Å²	38	107.2 Å²	107.2	39%	0.392	58%	0.582	S	S	.	*			trans	-66.2	155	169.2	0	0	0	0	0	110.4	I970 L974 F975	I970-G972 PolarHBondContact O-N 3.25Å; G972-L974 PolarHBondContact O-N 3.37Å; G972-F975 PolarHBondContact O-N 3.42Å
973	D	35.9	Very low	44.3	Very low	96 Å²	96	102.1 Å²	102.1	51%	0.513	55%	0.546	S	S	.	.	G	3₁₀ helix	trans	-51.6	-10	-176.8	-85.7	19.7	0	0	0	116	F975 K976	D973-F975 PolarHBondContact O-N 2.84Å; D973-K976 HydrophobicContact CB-CD 4.1Å; D973-K976 VanDerWaalsContact O-CB 3.23Å; D973-K976 WeakPolarHBondContact O-CB 3.3Å; D973-K976 PolarHBondContact O-N 2.92Å; D973-K976 WeakPolarHBondContact OD1-CE 3.01Å; D973-K976 IonicContact OD1-NZ 3.61Å; D973-K976 PolarHBondContact OD1-NZ 2.93Å; D973-K976 WeakPolarHBondContact OD2-CE 3.32Å; D973-K976 IonicContact OD2-NZ 4Å; D973-K976 PolarHBondContact OD2-NZ 3.34Å
974	L	36.5	Very low	46.6	Very low	59 Å²	59	97.4 Å²	97.4	31%	0.309	53%	0.525	S	S	.	.	G	3₁₀ helix	trans	-69.5	-6.8	170.1	-74.6	162.2	0	0	0	115.5	W958 G972	W958-L974 WeakPolarHBondContact O-CD1 3.47Å; W958-L974 WeakPolarHBondContact O-CD2 3.35Å; G972-L974 PolarHBondContact O-N 3.37Å
975	F	35.4	Very low	49.2	Very low	144 Å²	144	93 Å²	93	63%	0.632	49%	0.493	S	S	*	.	G	3₁₀ helix	trans	-94.9	-8.2	163.4	-73.8	-73.9	0	0	0	113.4	E971 G972 D973 E977	E971-F975 HydrophobicContact CB-CB 4.37Å; E971-F975 HydrophobicContact CB-CD2 3.96Å; E971-F975 HydrophobicContact CG-CD2 3.93Å; E971-F975 HydrophobicContact CG-CE2 4.45Å; E971-F975 HydrophobicContact CG-CG 4.48Å; G972-F975 PolarHBondContact O-N 3.42Å; D973-F975 PolarHBondContact O-N 2.84Å; F975-E977 PolarHBondContact O-N 2.91Å
976	K	45.7	Very low	51.7	Low	116 Å²	116	89.3 Å²	89.3	50%	0.504	47%	0.471	S	S	.	.	S	Bend	trans	-65.3	123.7	163.9	-62.1	178.4	178	167.8	0	106.7	D973 H978	D973-K976 HydrophobicContact CB-CD 4.1Å; D973-K976 VanDerWaalsContact O-CB 3.23Å; D973-K976 WeakPolarHBondContact O-CB 3.3Å; D973-K976 PolarHBondContact O-N 2.92Å; D973-K976 WeakPolarHBondContact OD1-CE 3.01Å; D973-K976 IonicContact OD1-NZ 3.61Å; D973-K976 PolarHBondContact OD1-NZ 2.93Å; D973-K976 WeakPolarHBondContact OD2-CE 3.32Å; D973-K976 IonicContact OD2-NZ 4Å; D973-K976 PolarHBondContact OD2-NZ 3.34Å; K976-H978 PolarHBondContact O-N 3.08Å
977	E	55.7	Low	54	Low	119 Å²	119	91.6 Å²	91.6	56%	0.556	46%	0.459	S	S	*	.	S	Bend	trans	-54.5	-29.8	179.6	-73.9	-163.6	167.4	0	0	112.5	F975 K1159 Y1160	F975-E977 PolarHBondContact O-N 2.91Å; E977-K1159 VanDerWaalsContact O-CA 3.3Å; E977-K1159 WeakPolarHBondContact O-CA 3.22Å; E977-K1159 WeakPolarHBondContact O-CG 3.08Å; E977-K1159 WeakPolarHBondContact OE2-CE 3.04Å; E977-K1159 IonicContact OE2-NZ 2.6Å; E977-K1159 PolarHBondContact OE2-NZ 3.12Å; E977-Y1160 PolarHBondContact O-N 3.19Å
978	H	69.7	Low	56.5	Low	88 Å²	88	81.1 Å²	81.1	41%	0.407	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	129.2	-173.5	-56.6	61.7	0	0	0	109.5	K976 L1158 I1226	K976-H978 PolarHBondContact O-N 3.08Å; H978-L1158 WeakPolarHBondContact CA-O 3.44Å; H978-I1226 HydrophobicContact CB-CD1 4.42Å; H978-I1226 WeakPolarHBondContact CD2-CD1 3.3Å
979	I	71.3	Confident	58.7	Low	26 Å²	26	78 Å²	78	13%	0.133	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	144.5	172.5	64.4	174.6	0	0	0	110.5	W958 V981 T1157 L1158 Y1223	W958-I979 HydrophobicContact CE3-CD1 3.98Å; W958-I979 HydrophobicContact CZ3-CD1 3.75Å; I979-V981 HydrophobicContact CD1-CG2 3.86Å; I979-V981 HydrophobicContact CG1-CG2 4.06Å; I979-T1157 CarbonylContact O-C 3.58Å; I979-T1157 WeakPolarHBondContact O-CA 3.29Å; I979-L1158 HydrophobicContact CD1-CB 4.43Å; I979-L1158 HydrophobicContact CD1-CD1 4.41Å; I979-L1158 HydrophobicContact CG1-CB 3.81Å; I979-L1158 HydrophobicContact CG1-CD1 4.46Å; I979-L1158 PolarHBondContact N-O 2.78Å; I979-L1158 PolarHBondContact O-N 2.81Å; I979-Y1223 HydrophobicContact CD1-CD1 4.09Å; I979-Y1223 HydrophobicContact CD1-CE1 3.55Å; I979-Y1223 HydrophobicContact CG1-CE1 4.34Å
980	N	76	Confident	61.1	Low	130 Å²	130	70.8 Å²	70.8	70%	0.695	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.6	124.3	172.1	-75.6	-29	0	0	0	109.3	F1156 T1157	N980-F1156 CarbonylContact C-O 3.49Å; N980-F1156 WeakPolarHBondContact CA-O 3.23Å; N980-T1157 WeakPolarHBondContact OD1-CB 3.4Å; N980-T1157 WeakPolarHBondContact OD1-CG2 3.43Å; N980-T1157 PolarHBondContact OD1-OG1 3.25Å
981	V	73.7	Confident	63.5	Low	20 Å²	20	63.8 Å²	63.8	12%	0.121	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	127.9	-175.3	-174.5	0	0	0	0	110	W958 I979 A983 F1156 L1158	W958-V981 HydrophobicContact CH2-CG1 4.19Å; W958-V981 HydrophobicContact CH2-CG2 4.2Å; W958-V981 HydrophobicContact CZ2-CG1 4.11Å; W958-V981 HydrophobicContact CZ3-CG2 4.26Å; I979-V981 HydrophobicContact CD1-CG2 3.86Å; I979-V981 HydrophobicContact CG1-CG2 4.06Å; V981-A983 HydrophobicContact CG1-CB 4.07Å; V981-F1156 PolarHBondContact N-O 2.89Å; V981-F1156 PolarHBondContact O-N 2.78Å; V981-L1158 HydrophobicContact CG2-CD1 4.25Å
982	Q	75.5	Confident	66	Low	97 Å²	97	58 Å²	58	45%	0.453	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	114	169.5	-177.1	165.4	-34.2	0	0	108.9	R1155	Q982-R1155 HydrophobicContact CB-CG 4.06Å; Q982-R1155 HydrophobicContact CG-CG 4.12Å
983	A	74.6	Confident	68.3	Low	3 Å²	3	56.4 Å²	56.4	3%	0.025	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	161.1	-171.2	0	0	0	0	0	113	V981 I1019 T1020 D1021 N1153 C1154 F1156	V981-A983 HydrophobicContact CG1-CB 4.07Å; A983-I1019 HydrophobicContact CB-CB 3.96Å; A983-I1019 HydrophobicContact CB-CD1 4.09Å; A983-I1019 HydrophobicContact CB-CG1 4.34Å; A983-T1020 CarbonylContact C-O 3.56Å; A983-T1020 WeakPolarHBondContact CA-O 3.28Å; A983-T1020 WeakPolarHBondContact CB-O 3.3Å; A983-D1021 HydrophobicContact CB-CB 4.43Å; A983-N1153 WeakPolarHBondContact O-CA 3.19Å; A983-C1154 PolarHBondContact N-O 3.06Å; A983-C1154 PolarHBondContact O-N 2.8Å; A983-F1156 HydrophobicContact CB-CD2 4.16Å; A983-F1156 HydrophobicContact CB-CE2 3.99Å; A983-F1156 WeakPolarHBondContact O-CE2 3.48Å
984	T	76.4	Confident	70.4	Confident	48 Å²	48	53.5 Å²	53.5	29%	0.294	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	134.6	170.9	-40.4	0	0	0	0	110.5	T986 I1019 T1020 N1153	T984-T986 PolarHBondContact O-N 3.23Å; T984-I1019 CarbonylContact O-C 3.55Å; T984-I1019 VanDerWaalsContact O-CA 3.24Å; T984-I1019 WeakPolarHBondContact O-CA 3.23Å; T984-T1020 PolarHBondContact N-O 3Å; T984-T1020 PolarHBondContact O-N 3.48Å; T984-N1153 WeakPolarHBondContact CA-OD1 3.07Å; T984-N1153 VanDerWaalsContact CB-OD1 3.23Å; T984-N1153 WeakPolarHBondContact CB-OD1 3.09Å; T984-N1153 WeakPolarHBondContact CG2-OD1 3.3Å; T984-N1153 PolarHBondContact OG1-OD1 2.73Å
985	I	78.5	Confident	72.1	Confident	2 Å²	2	57.4 Å²	57.4	1%	0.01	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	110.1	163.3	-55.6	-179.3	0	0	0	107.9	F1017 I1019 L1069 F1150 L1151 R1152 F1156	I985-F1017 HydrophobicContact CD1-CD2 4.3Å; I985-F1017 HydrophobicContact CD1-CE2 4.24Å; I985-F1017 HydrophobicContact CG1-CD2 4.13Å; I985-F1017 HydrophobicContact CG1-CE2 4.22Å; I985-F1017 HydrophobicContact CG2-CB 4.21Å; I985-F1017 HydrophobicContact CG2-CD2 3.98Å; I985-F1017 HydrophobicContact CG2-CG 4.42Å; I985-I1019 HydrophobicContact CG1-CG2 4.44Å; I985-L1069 HydrophobicContact CD1-CD1 3.66Å; I985-L1069 HydrophobicContact CD1-CG 4.47Å; I985-F1150 HydrophobicContact CD1-CZ 4.39Å; I985-F1150 HydrophobicContact CG2-CD1 4.32Å; I985-F1150 HydrophobicContact CG2-CE1 3.82Å; I985-F1150 HydrophobicContact CG2-CZ 4.43Å; I985-L1151 HydrophobicContact CG2-CD2 3.89Å; I985-L1151 CarbonylContact O-C 3.55Å; I985-L1151 VanDerWaalsContact O-CA 3.28Å; I985-L1151 WeakPolarHBondContact O-CA 3.38Å; I985-L1151 WeakPolarHBondContact O-CB 3.48Å; I985-L1151 WeakPolarHBondContact O-CD2 3.41Å; I985-R1152 PolarHBondContact N-O 3.28Å; I985-F1156 HydrophobicContact CD1-CE1 4.34Å; I985-F1156 HydrophobicContact CD1-CZ 4.07Å; I985-F1156 HydrophobicContact CG1-CE1 4.31Å; I985-F1156 HydrophobicContact CG1-CZ 3.61Å
986	T	76.4	Confident	73.6	Confident	61 Å²	61	51.9 Å²	51.9	37%	0.374	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	-32.5	-179.3	61.1	0	0	0	0	112.9	T984 V1018 T1020	T984-T986 PolarHBondContact O-N 3.23Å; T986-V1018 PolarHBondContact N-O 3.35Å; T986-V1018 WeakPolarHBondContact OG1-CB 3.34Å; T986-V1018 PolarHBondContact OG1-O 3Å; T986-T1020 HydrophobicContact CG2-CG2 3.28Å
987	R	76.9	Confident	74.2	Confident	113 Å²	113	49.2 Å²	49.2	43%	0.426	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.3	136.8	-174.2	-163.9	167.4	-177.4	147.6	1.2	113.2	L989 F1017 V1018	R987-L989 HydrophobicContact CG-CD2 4.21Å; R987-F1017 CarbonylContact O-C 3.58Å; R987-F1017 WeakPolarHBondContact O-CA 3.29Å; R987-F1017 VanDerWaalsContact O-CB 3.31Å; R987-F1017 WeakPolarHBondContact O-CB 3.09Å; R987-V1018 PolarHBondContact O-N 2.94Å
988	C	78.4	Confident	73.8	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	132.3	160.1	-169.7	0	0	0	0	110.1	L1145 F1150	C988-L1145 HydrophobicContact CB-CB 4.2Å; C988-F1150 HydrophobicContact CB-CE1 3.89Å
989	L	74.6	Confident	72.5	Confident	29 Å²	29	51.4 Å²	51.4	15%	0.152	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	-37.8	178.7	-55.9	-176.1	0	0	0	112.3	R987 R1016 V1018 L1027 F1098 Y1099	R987-L989 HydrophobicContact CG-CD2 4.21Å; L989-R1016 HydrophobicContact CB-CB 4.48Å; L989-R1016 PolarHBondContact N-O 3.49Å; L989-V1018 HydrophobicContact CD1-CG2 3.77Å; L989-V1018 HydrophobicContact CD2-CG2 4.1Å; L989-V1018 HydrophobicContact CG-CG2 4.04Å; L989-L1027 HydrophobicContact CD1-CD1 3.55Å; L989-F1098 WeakPolarHBondContact O-CD2 3.33Å; L989-F1098 PolarHBondContact O-N 3.06Å; L989-F1098 VanDerWaalsContact O-N 3.1Å; L989-Y1099 HydrophobicContact CD2-CE2 3.67Å
990	E	80.2	Confident	70.9	Confident	10 Å²	10	56.7 Å²	56.7	5%	0.047	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	139.1	-174.9	-177.7	172.8	-156.5	0	0	109.5	Q992 I1015 R1016 F1096 N1097	E990-Q992 HydrophobicContact CG-CG 4.15Å; E990-Q992 PolarHBondContact OE1-NE2 3.43Å; E990-I1015 WeakPolarHBondContact O-CA 3.44Å; E990-R1016 HydrophobicContact CB-CB 4.08Å; E990-R1016 HydrophobicContact CB-CG 4.39Å; E990-R1016 PolarHBondContact N-O 3.27Å; E990-R1016 PolarHBondContact O-N 2.97Å; E990-R1016 VanDerWaalsContact OE2-CD 3.3Å; E990-R1016 WeakPolarHBondContact OE2-CD 3.32Å; E990-R1016 IonicContact OE2-CZ 2.95Å; E990-R1016 IonicContact OE2-NE 3.95Å; E990-R1016 IonicContact OE2-NH1 2.63Å; E990-R1016 PolarHBondContact OE2-NH1 2.94Å; E990-F1096 WeakPolarHBondContact CA-O 3.16Å; E990-N1097 WeakPolarHBondContact CG-OD1 3.5Å
991	F	81.5	Confident	69.2	Low	0 Å²	0	53 Å²	53	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	126.1	173.3	-178.7	-83.6	0	0	0	108.3	I993 C1014 I1015 W1084 S1095 F1096 L1141 L1145	F991-I993 HydrophobicContact CD1-CG1 4.34Å; F991-I993 HydrophobicContact CE1-CD1 3.58Å; F991-I993 HydrophobicContact CE1-CG1 3.41Å; F991-I993 VanDerWaalsContact CE1-CG1 3.41Å; F991-I993 HydrophobicContact CZ-CD1 3.85Å; F991-I993 HydrophobicContact CZ-CG1 3.81Å; F991-C1014 CarbonylContact C-O 3.58Å; F991-C1014 WeakPolarHBondContact CA-O 3.13Å; F991-I1015 HydrophobicContact CD2-CD1 3.82Å; F991-I1015 HydrophobicContact CD2-CG1 3.7Å; F991-I1015 HydrophobicContact CD2-CG2 4.29Å; F991-I1015 HydrophobicContact CE2-CD1 3.67Å; F991-I1015 HydrophobicContact CE2-CG1 3.94Å; F991-W1084 AromaticContact CZ-CH2 3.96Å; F991-W1084 HydrophobicContact CZ-CH2 3.96Å; F991-W1084 HydrophobicContact CZ-CZ2 4.31Å; F991-S1095 CarbonylContact O-C 3.57Å; F991-S1095 WeakPolarHBondContact O-CA 3.44Å; F991-F1096 HydrophobicContact CB-CD2 4.36Å; F991-F1096 AromaticContact CD1-CD2 3.91Å; F991-F1096 HydrophobicContact CD1-CD2 3.91Å; F991-F1096 HydrophobicContact CD1-CE2 4.2Å; F991-F1096 PolarHBondContact N-O 2.89Å; F991-F1096 PolarHBondContact O-N 2.89Å; F991-L1141 HydrophobicContact CD1-CD2 3.71Å; F991-L1141 HydrophobicContact CE1-CD2 3.42Å; F991-L1141 VanDerWaalsContact CE1-CD2 3.42Å; F991-L1141 HydrophobicContact CG-CD2 4.46Å; F991-L1141 HydrophobicContact CZ-CD2 3.98Å; F991-L1145 HydrophobicContact CB-CD1 3.87Å; F991-L1145 HydrophobicContact CD2-CD1 3.94Å; F991-L1145 HydrophobicContact CD2-CD2 4.34Å; F991-L1145 HydrophobicContact CG-CD1 3.89Å
992	Q	81.7	Confident	67.6	Low	19 Å²	19	59.5 Å²	59.5	9%	0.089	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	142.1	177.1	-52.3	-173	-7.6	0	0	109.9	E990 I1013 C1014	E990-Q992 HydrophobicContact CG-CG 4.15Å; E990-Q992 PolarHBondContact OE1-NE2 3.43Å; Q992-I1013 WeakPolarHBondContact O-CA 3.47Å; Q992-C1014 HydrophobicContact CB-CB 4.22Å; Q992-C1014 PolarHBondContact N-O 3.2Å; Q992-C1014 PolarHBondContact O-N 2.68Å
993	I	80	Confident	66	Low	5 Å²	5	62 Å²	62	3%	0.026	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	132.8	164.4	-45.5	174.3	0	0	0	106.4	F991 L1011 G1012 I1013 W1084 L1088 L1094	F991-I993 HydrophobicContact CD1-CG1 4.34Å; F991-I993 HydrophobicContact CE1-CD1 3.58Å; F991-I993 HydrophobicContact CE1-CG1 3.41Å; F991-I993 VanDerWaalsContact CE1-CG1 3.41Å; F991-I993 HydrophobicContact CZ-CD1 3.85Å; F991-I993 HydrophobicContact CZ-CG1 3.81Å; I993-L1011 HydrophobicContact CG2-CD2 4.32Å; I993-G1012 WeakPolarHBondContact CA-O 3.32Å; I993-I1013 HydrophobicContact CG1-CG1 4.35Å; I993-I1013 HydrophobicContact CG2-CG1 4.13Å; I993-W1084 HydrophobicContact CD1-CB 4.22Å; I993-W1084 HydrophobicContact CD1-CD2 3.23Å; I993-W1084 HydrophobicContact CD1-CE3 3.35Å; I993-W1084 HydrophobicContact CD1-CG 3.68Å; I993-W1084 HydrophobicContact CD1-CH2 3.89Å; I993-W1084 HydrophobicContact CD1-CZ2 3.82Å; I993-W1084 HydrophobicContact CD1-CZ3 3.68Å; I993-L1088 HydrophobicContact CB-CD1 4.32Å; I993-L1088 HydrophobicContact CG2-CD1 3.64Å; I993-L1094 HydrophobicContact CB-CB 4.4Å; I993-L1094 HydrophobicContact CD1-CD1 4.3Å
994	Y	78.9	Confident	64.4	Low	35 Å²	35	70.5 Å²	70.5	14%	0.137	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	164.1	-176.9	57.2	-87.7	0	0	0	110	L996 G1012 C1014 H1032 F1034	Y994-L996 HydrophobicContact CE2-CD2 3.83Å; Y994-L996 HydrophobicContact CE2-CG 4.49Å; Y994-G1012 PolarHBondContact N-O 3.18Å; Y994-G1012 PolarHBondContact O-N 2.82Å; Y994-C1014 HydrophobicContact CE1-CB 4.3Å; Y994-H1032 VanDerWaalsContact CE1-O 3.27Å; Y994-H1032 WeakPolarHBondContact CE1-O 3.44Å; Y994-H1032 PolarHBondContact OH-O 3.17Å; Y994-F1034 HydrophobicContact CD1-CB 3.81Å; Y994-F1034 HydrophobicContact CD2-CB 4.07Å; Y994-F1034 AromaticContact CD2-CD2 3.59Å; Y994-F1034 HydrophobicContact CD2-CD2 3.59Å; Y994-F1034 HydrophobicContact CD2-CE2 4.38Å; Y994-F1034 HydrophobicContact CD2-CG 4.12Å; Y994-F1034 HydrophobicContact CE1-CB 4.37Å; Y994-F1034 HydrophobicContact CE2-CD2 4.21Å; Y994-F1034 HydrophobicContact CG-CB 3.66Å; Y994-F1034 AromaticContact CG-CD2 3.96Å; Y994-F1034 HydrophobicContact CG-CD2 3.96Å; Y994-F1034 HydrophobicContact CG-CG 4Å
995	R	72.4	Confident	62.9	Low	140 Å²	140	75.6 Å²	75.6	53%	0.528	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	132.9	176.8	-174.1	167.1	169.6	172.6	-9.7	110	D1089	R995-D1089 IonicContact CZ-OD1 3.9Å; R995-D1089 IonicContact NH1-OD1 2.6Å; R995-D1089 PolarHBondContact NH1-OD1 2.99Å
996	L	67.5	Low	61.4	Low	29 Å²	29	80.2 Å²	80.2	15%	0.152	43%	0.425	C	S	.	.			trans	-79.1	135.3	170.6	-67.5	166.1	0	0	0	109.1	Y994 N998 N1010 I1048 P1059	Y994-L996 HydrophobicContact CE2-CD2 3.83Å; Y994-L996 HydrophobicContact CE2-CG 4.49Å; L996-N998 PolarHBondContact O-N 3.27Å; L996-N1010 PolarHBondContact N-O 3.08Å; L996-I1048 HydrophobicContact CD2-CD1 3.91Å; L996-P1059 HydrophobicContact CD1-CB 3.77Å; L996-P1059 HydrophobicContact CD1-CG 4.12Å
997	S	58	Low	60.3	Low	60 Å²	60	82.2 Å²	82.2	42%	0.42	43%	0.434	S	S	.	.			trans	-86.1	109.9	-177.3	52.6	0	0	0	0	111.5
998	N	47.9	Very low	59.3	Low	128 Å²	128	78.9 Å²	78.9	68%	0.684	42%	0.422	S	S	*	.			trans	53.9	93.4	166.3	-67	2.9	0	0	0	117.8	L996	L996-N998 PolarHBondContact O-N 3.27Å
999	N	42.4	Very low	58.3	Low	124 Å²	124	80.4 Å²	80.4	66%	0.663	43%	0.431	S	S	*	.			trans	-93.4	101.9	131.5	-86.6	-0.1	0	0	0	108.3	G1001	N999-G1001 PolarHBondContact O-N 3.04Å; N999-G1001 VanDerWaalsContact O-N 3.14Å
1000	T	38.4	Very low	57.9	Low	137 Å²	137	81.5 Å²	81.5	84%	0.84	44%	0.437	S	S	*	.			trans	-80.8	76.8	161.4	47.2	0	0	0	0	108.5
1001	G	40.1	Very low	57.7	Low	53 Å²	53	81.3 Å²	81.3	55%	0.546	44%	0.437	S	S	.	.			trans	-123.4	131.1	167.1	0	0	0	0	0	108.4	N999 D1003	N999-G1001 PolarHBondContact O-N 3.04Å; N999-G1001 VanDerWaalsContact O-N 3.14Å; G1001-D1003 PolarHBondContact O-N 3.02Å
1002	D	39.8	Very low	57.6	Low	156 Å²	156	81.5 Å²	81.5	83%	0.834	44%	0.439	S	S	*	.			trans	-74.6	19.7	-168.4	-90.6	-45.8	0	0	0	115.3	Q1004	D1002-Q1004 PolarHBondContact O-N 3.04Å
1003	D	41.7	Very low	57.7	Low	151 Å²	151	80.8 Å²	80.8	81%	0.807	44%	0.436	S	S	*	.			trans	-77.5	83.6	179.4	-70.5	-40.9	0	0	0	111.2	G1001 N1005	G1001-D1003 PolarHBondContact O-N 3.02Å; D1003-N1005 PolarHBondContact O-N 3.3Å
1004	Q	41.8	Very low	57.9	Low	180 Å²	180	80.6 Å²	80.6	84%	0.841	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	14.3	-177.1	-65.9	-160.8	-4.5	0	0	116.3	D1002	D1002-Q1004 PolarHBondContact O-N 3.04Å
1005	N	43.4	Very low	58.3	Low	155 Å²	155	78.9 Å²	78.9	83%	0.829	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.5	-20.4	-171.3	-80.2	-36	0	0	0	116.4	D1003	D1003-N1005 PolarHBondContact O-N 3.3Å
1006	D	48.2	Very low	58.8	Low	99 Å²	99	73.5 Å²	73.5	53%	0.529	41%	0.408	S	S	.	.			trans	-116.2	82.2	177.7	-83.6	-61.8	0	0	0	113	F1008 V1009	D1006-F1008 PolarHBondContact O-N 2.81Å; D1006-V1009 HydrophobicContact CB-CG2 3.92Å; D1006-V1009 WeakPolarHBondContact O-CG2 3.5Å; D1006-V1009 PolarHBondContact O-N 3.42Å
1007	D	53.2	Low	59.7	Low	104 Å²	104	72.1 Å²	72.1	56%	0.556	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-12.5	179.4	-129	-20.3	0	0	0	114.5	K1085	D1007-K1085 PolarHBondContact O-NZ 2.91Å; D1007-K1085 IonicContact OD1-NZ 2.72Å; D1007-K1085 PolarHBondContact OD1-NZ 2.84Å
1008	F	55.2	Low	60.7	Low	42 Å²	42	69.8 Å²	69.8	18%	0.184	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-20.2	-173.5	-56.9	-71.4	0	0	0	115.1	D1006 N1010 L1011 L1063 K1078 C1081 C1082	D1006-F1008 PolarHBondContact O-N 2.81Å; F1008-N1010 PolarHBondContact O-N 3.5Å; F1008-L1011 PolarHBondContact O-N 2.97Å; F1008-L1063 HydrophobicContact CB-CD1 4.5Å; F1008-K1078 HydrophobicContact CE1-CB 4.24Å; F1008-K1078 HydrophobicContact CE1-CG 4.39Å; F1008-K1078 WeakPolarHBondContact CE1-O 3.37Å; F1008-K1078 HydrophobicContact CE2-CB 4.44Å; F1008-K1078 HydrophobicContact CE2-CD 4.04Å; F1008-K1078 HydrophobicContact CE2-CG 4Å; F1008-K1078 HydrophobicContact CZ-CB 3.73Å; F1008-K1078 HydrophobicContact CZ-CD 4.19Å; F1008-K1078 HydrophobicContact CZ-CG 3.76Å; F1008-C1081 HydrophobicContact CD1-CB 3.68Å; F1008-C1081 HydrophobicContact CE1-CB 3.81Å; F1008-C1082 VanDerWaalsContact CE1-SG 3.53Å
1009	V	56.8	Low	62.2	Low	32 Å²	32	63.7 Å²	63.7	19%	0.194	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-24.1	-169.4	176.5	0	0	0	0	113.8	D1006 L1011	D1006-V1009 HydrophobicContact CB-CG2 3.92Å; D1006-V1009 WeakPolarHBondContact O-CG2 3.5Å; D1006-V1009 PolarHBondContact O-N 3.42Å; V1009-L1011 PolarHBondContact O-N 3.15Å
1010	N	67.3	Low	63.5	Low	52 Å²	52	59.3 Å²	59.3	28%	0.278	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	9.6	-176.5	-69.7	-45.2	0	0	0	115.3	L996 F1008	L996-N1010 PolarHBondContact N-O 3.08Å; F1008-N1010 PolarHBondContact O-N 3.5Å
1011	L	76.5	Confident	64.7	Low	6 Å²	6	56.2 Å²	56.2	3%	0.031	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	128.6	177.4	-71.1	173.6	0	0	0	112.3	I993 F1008 V1009 L1063 C1081 K1085 L1088	I993-L1011 HydrophobicContact CG2-CD2 4.32Å; F1008-L1011 PolarHBondContact O-N 2.97Å; V1009-L1011 PolarHBondContact O-N 3.15Å; L1011-L1063 HydrophobicContact CB-CD1 4.41Å; L1011-L1063 HydrophobicContact CB-CD2 4.17Å; L1011-C1081 HydrophobicContact CD1-CB 3.94Å; L1011-K1085 HydrophobicContact CD1-CB 4.29Å; L1011-K1085 HydrophobicContact CD2-CB 4.32Å; L1011-L1088 HydrophobicContact CD2-CD1 3.56Å
1012	G	79.3	Confident	65.1	Low	5 Å²	5	57.1 Å²	57.1	5%	0.052	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	140.2	168.4	0	0	0	0	0	111.2	I993 Y994	I993-G1012 WeakPolarHBondContact CA-O 3.32Å; Y994-G1012 PolarHBondContact N-O 3.18Å; Y994-G1012 PolarHBondContact O-N 2.82Å
1013	I	83.5	Confident	65.4	Low	4 Å²	4	52.2 Å²	52.2	2%	0.021	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	136.7	176.5	-63.1	-177	0	0	0	108.9	Q992 I993 I1015 G1031 L1063 A1066 W1077 W1084	Q992-I1013 WeakPolarHBondContact O-CA 3.47Å; I993-I1013 HydrophobicContact CG1-CG1 4.35Å; I993-I1013 HydrophobicContact CG2-CG1 4.13Å; I1013-I1015 HydrophobicContact CG2-CD1 4Å; I1013-I1015 HydrophobicContact CG2-CG1 3.73Å; I1013-G1031 WeakPolarHBondContact O-CA 3.4Å; I1013-L1063 HydrophobicContact CD1-CD2 3.61Å; I1013-L1063 HydrophobicContact CG1-CD2 3.88Å; I1013-A1066 HydrophobicContact CD1-CB 4.04Å; I1013-A1066 HydrophobicContact CG2-CB 4.21Å; I1013-W1077 HydrophobicContact CD1-CH2 3.54Å; I1013-W1077 HydrophobicContact CD1-CZ2 3.91Å; I1013-W1084 HydrophobicContact CD1-CZ3 4.2Å
1014	C	83	Confident	66.1	Low	0 Å²	0	45.5 Å²	45.5	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	130.1	168.8	-173.5	0	0	0	0	109.7	F991 Q992 Y994 L1030 H1032	F991-C1014 CarbonylContact C-O 3.58Å; F991-C1014 WeakPolarHBondContact CA-O 3.13Å; Q992-C1014 HydrophobicContact CB-CB 4.22Å; Q992-C1014 PolarHBondContact N-O 3.2Å; Q992-C1014 PolarHBondContact O-N 2.68Å; Y994-C1014 HydrophobicContact CE1-CB 4.3Å; C1014-L1030 VanDerWaalsContact CA-O 3.32Å; C1014-L1030 WeakPolarHBondContact CA-O 3.32Å; C1014-L1030 PolarHBondContact SG-O 2.98Å; C1014-H1032 WeakPolarHBondContact CB-O 3.36Å
1015	I	86.9	Confident	67.2	Low	0 Å²	0	38.6 Å²	38.6	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	127.3	177.3	-46.4	-178.2	0	0	0	108.3	E990 F991 I1013 F1017 Q1029 L1030 L1069	E990-I1015 WeakPolarHBondContact O-CA 3.44Å; F991-I1015 HydrophobicContact CD2-CD1 3.82Å; F991-I1015 HydrophobicContact CD2-CG1 3.7Å; F991-I1015 HydrophobicContact CD2-CG2 4.29Å; F991-I1015 HydrophobicContact CE2-CD1 3.67Å; F991-I1015 HydrophobicContact CE2-CG1 3.94Å; I1013-I1015 HydrophobicContact CG2-CD1 4Å; I1013-I1015 HydrophobicContact CG2-CG1 3.73Å; I1015-F1017 HydrophobicContact CG2-CD1 4.09Å; I1015-Q1029 CarbonylContact O-C 3.6Å; I1015-Q1029 WeakPolarHBondContact O-CA 3.11Å; I1015-L1030 HydrophobicContact CB-CB 4.43Å; I1015-L1030 HydrophobicContact CD1-CD2 4.35Å; I1015-L1030 PolarHBondContact N-O 3.25Å; I1015-L1030 PolarHBondContact O-N 2.91Å; I1015-L1069 HydrophobicContact CD1-CD2 4.13Å; I1015-L1069 HydrophobicContact CG2-CD2 4.48Å
1016	R	84.1	Confident	68.6	Low	27 Å²	27	31.2 Å²	31.2	10%	0.102	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	131.5	169.1	-61.9	-173.2	171.7	137.2	-7.3	110.7	L989 E990 L1027 V1028 Q1029	L989-R1016 HydrophobicContact CB-CB 4.48Å; L989-R1016 PolarHBondContact N-O 3.49Å; E990-R1016 HydrophobicContact CB-CB 4.08Å; E990-R1016 HydrophobicContact CB-CG 4.39Å; E990-R1016 PolarHBondContact N-O 3.27Å; E990-R1016 PolarHBondContact O-N 2.97Å; E990-R1016 VanDerWaalsContact OE2-CD 3.3Å; E990-R1016 WeakPolarHBondContact OE2-CD 3.32Å; E990-R1016 IonicContact OE2-CZ 2.95Å; E990-R1016 IonicContact OE2-NE 3.95Å; E990-R1016 IonicContact OE2-NH1 2.63Å; E990-R1016 PolarHBondContact OE2-NH1 2.94Å; R1016-L1027 HydrophobicContact CB-CD1 4.45Å; R1016-V1028 WeakPolarHBondContact CA-O 3.47Å; R1016-Q1029 HydrophobicContact CG-CB 4.12Å; R1016-Q1029 HydrophobicContact CG-CG 3.99Å; R1016-Q1029 VanDerWaalsContact CZ-OE1 3.29Å
1017	F	85.1	Confident	70.2	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	158.4	-178	58.5	-82.3	0	0	0	111.4	I985 R987 I1015 I1019 V1028 L1069 F1156 L1225	I985-F1017 HydrophobicContact CD1-CD2 4.3Å; I985-F1017 HydrophobicContact CD1-CE2 4.24Å; I985-F1017 HydrophobicContact CG1-CD2 4.13Å; I985-F1017 HydrophobicContact CG1-CE2 4.22Å; I985-F1017 HydrophobicContact CG2-CB 4.21Å; I985-F1017 HydrophobicContact CG2-CD2 3.98Å; I985-F1017 HydrophobicContact CG2-CG 4.42Å; R987-F1017 CarbonylContact O-C 3.58Å; R987-F1017 WeakPolarHBondContact O-CA 3.29Å; R987-F1017 VanDerWaalsContact O-CB 3.31Å; R987-F1017 WeakPolarHBondContact O-CB 3.09Å; I1015-F1017 HydrophobicContact CG2-CD1 4.09Å; F1017-I1019 HydrophobicContact CD2-CG2 3.65Å; F1017-I1019 HydrophobicContact CE2-CG2 3.5Å; F1017-V1028 HydrophobicContact CD2-CB 4.24Å; F1017-V1028 HydrophobicContact CE1-CB 4.11Å; F1017-V1028 HydrophobicContact CE1-CG1 3.82Å; F1017-V1028 HydrophobicContact CE2-CB 3.84Å; F1017-V1028 HydrophobicContact CE2-CG1 3.99Å; F1017-V1028 HydrophobicContact CE2-CG2 4.37Å; F1017-V1028 HydrophobicContact CZ-CB 3.77Å; F1017-V1028 HydrophobicContact CZ-CG1 3.45Å; F1017-V1028 VanDerWaalsContact CZ-CG1 3.45Å; F1017-V1028 PolarHBondContact N-O 2.95Å; F1017-V1028 PolarHBondContact O-N 3.37Å; F1017-L1069 HydrophobicContact CD1-CD2 4.11Å; F1017-L1069 HydrophobicContact CE1-CD1 4.21Å; F1017-L1069 HydrophobicContact CE1-CD2 3.53Å; F1017-L1069 HydrophobicContact CE2-CD1 4.22Å; F1017-L1069 HydrophobicContact CZ-CD1 3.75Å; F1017-L1069 HydrophobicContact CZ-CD2 3.96Å; F1017-F1156 HydrophobicContact CE2-CD1 4.44Å; F1017-F1156 AromaticContact CE2-CE1 3.78Å; F1017-F1156 HydrophobicContact CE2-CE1 3.78Å; F1017-F1156 HydrophobicContact CE2-CZ 4.17Å; F1017-F1156 HydrophobicContact CZ-CE1 4.12Å; F1017-L1225 HydrophobicContact CE1-CD2 4.48Å; F1017-L1225 HydrophobicContact CZ-CD2 4.22Å
1018	V	79.9	Confident	71.7	Confident	11 Å²	11	22.7 Å²	22.7	7%	0.067	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	125.3	177.7	-177.5	0	0	0	0	109.1	T986 R987 L989 A1026 L1027	T986-V1018 PolarHBondContact N-O 3.35Å; T986-V1018 WeakPolarHBondContact OG1-CB 3.34Å; T986-V1018 PolarHBondContact OG1-O 3Å; R987-V1018 PolarHBondContact O-N 2.94Å; L989-V1018 HydrophobicContact CD1-CG2 3.77Å; L989-V1018 HydrophobicContact CD2-CG2 4.1Å; L989-V1018 HydrophobicContact CG-CG2 4.04Å; V1018-A1026 WeakPolarHBondContact CA-O 3.46Å; V1018-L1027 HydrophobicContact CG2-CD1 4.44Å
1019	I	78.6	Confident	73.2	Confident	0 Å²	0	20.7 Å²	20.7	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	151.6	172.3	65.5	170.5	0	0	0	110.7	W958 A983 T984 I985 F1017 S1025 A1026 V1028 F1156 L1158	W958-I1019 HydrophobicContact CH2-CD1 4.37Å; A983-I1019 HydrophobicContact CB-CB 3.96Å; A983-I1019 HydrophobicContact CB-CD1 4.09Å; A983-I1019 HydrophobicContact CB-CG1 4.34Å; T984-I1019 CarbonylContact O-C 3.55Å; T984-I1019 VanDerWaalsContact O-CA 3.24Å; T984-I1019 WeakPolarHBondContact O-CA 3.23Å; I985-I1019 HydrophobicContact CG1-CG2 4.44Å; F1017-I1019 HydrophobicContact CD2-CG2 3.65Å; F1017-I1019 HydrophobicContact CE2-CG2 3.5Å; I1019-S1025 CarbonylContact O-C 3.6Å; I1019-S1025 WeakPolarHBondContact O-CA 3.23Å; I1019-S1025 WeakPolarHBondContact O-CB 3.47Å; I1019-A1026 HydrophobicContact CD1-CB 4.38Å; I1019-A1026 HydrophobicContact CG1-CB 4Å; I1019-A1026 PolarHBondContact N-O 3.32Å; I1019-A1026 PolarHBondContact O-N 2.85Å; I1019-V1028 HydrophobicContact CD1-CG2 3.81Å; I1019-V1028 HydrophobicContact CG1-CG2 3.89Å; I1019-V1028 HydrophobicContact CG2-CG2 4.15Å; I1019-F1156 HydrophobicContact CB-CE2 4.28Å; I1019-F1156 HydrophobicContact CD1-CD2 3.99Å; I1019-F1156 HydrophobicContact CD1-CE2 4.4Å; I1019-F1156 HydrophobicContact CG2-CD2 4.23Å; I1019-F1156 HydrophobicContact CG2-CE1 4.35Å; I1019-F1156 HydrophobicContact CG2-CE2 3.66Å; I1019-F1156 HydrophobicContact CG2-CZ 3.73Å; I1019-L1158 HydrophobicContact CD1-CD1 3.76Å
1020	T	71.7	Confident	74.6	Confident	32 Å²	32	19.2 Å²	19.2	20%	0.196	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	142.2	168.3	-160.6	0	0	0	0	111	A983 T984 T986 G1022 G1024 S1025	A983-T1020 CarbonylContact C-O 3.56Å; A983-T1020 WeakPolarHBondContact CA-O 3.28Å; A983-T1020 WeakPolarHBondContact CB-O 3.3Å; T984-T1020 PolarHBondContact N-O 3Å; T984-T1020 PolarHBondContact O-N 3.48Å; T986-T1020 HydrophobicContact CG2-CG2 3.28Å; T1020-G1022 PolarHBondContact OG1-N 2.86Å; T1020-G1024 WeakPolarHBondContact CA-O 3.46Å; T1020-G1024 WeakPolarHBondContact CB-O 3.5Å; T1020-G1024 PolarHBondContact OG1-O 2.92Å; T1020-S1025 PolarHBondContact OG1-OG 3.19Å
1021	D	61.6	Low	75.2	Confident	71 Å²	71	17 Å²	17	38%	0.38	12%	0.119	S	C	.	.			trans	-101.8	-4.9	169.8	65.5	-24.1	0	0	0	112	A983 S1023 G1024	A983-D1021 HydrophobicContact CB-CB 4.43Å; D1021-S1023 PolarHBondContact OD1-N 3.38Å; D1021-S1023 PolarHBondContact OD1-OG 2.86Å; D1021-S1023 WeakPolarHBondContact OD2-CB 3.38Å; D1021-S1023 PolarHBondContact OD2-OG 2.91Å; D1021-G1024 PolarHBondContact OD1-N 2.83Å
1022	G	49.5	Very low	75.1	Confident	73 Å²	73	21.6 Å²	21.6	75%	0.753	14%	0.14	S	C	*	.	S	Bend	trans	92.8	-13.2	-171.2	0	0	0	0	0	114.6	T1020	T1020-G1022 PolarHBondContact OG1-N 2.86Å
1023	S	46.9	Very low	74.3	Confident	52 Å²	52	23.2 Å²	23.2	36%	0.364	15%	0.15	S	C	.	.	S	Bend	trans	-92.5	-38.3	171.5	82.2	0	0	0	0	111.8	W958 D1021	W958-S1023 PolarHBondContact NE1-OG 2.91Å; D1021-S1023 PolarHBondContact OD1-N 3.38Å; D1021-S1023 PolarHBondContact OD1-OG 2.86Å; D1021-S1023 WeakPolarHBondContact OD2-CB 3.38Å; D1021-S1023 PolarHBondContact OD2-OG 2.91Å
1024	G	56.2	Low	73.1	Confident	11 Å²	11	27.8 Å²	27.8	11%	0.113	17%	0.17	C	C	.	.			trans	-151.8	-178.9	178.3	0	0	0	0	0	112.3	T1020 D1021	T1020-G1024 WeakPolarHBondContact CA-O 3.46Å; T1020-G1024 WeakPolarHBondContact CB-O 3.5Å; T1020-G1024 PolarHBondContact OG1-O 2.92Å; D1021-G1024 PolarHBondContact OD1-N 2.83Å
1025	S	64.3	Low	71.6	Confident	34 Å²	34	33.2 Å²	33.2	24%	0.238	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	129.2	174.2	-47.3	0	0	0	0	111.6	I959 I1019 T1020 Y1220	I959-S1025 WeakPolarHBondContact CD1-O 3.45Å; I1019-S1025 CarbonylContact O-C 3.6Å; I1019-S1025 WeakPolarHBondContact O-CA 3.23Å; I1019-S1025 WeakPolarHBondContact O-CB 3.47Å; T1020-S1025 PolarHBondContact OG1-OG 3.19Å; S1025-Y1220 VanDerWaalsContact O-CD1 3.27Å; S1025-Y1220 WeakPolarHBondContact O-CD1 3.46Å
1026	A	73.3	Confident	69.2	Low	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	148.5	-178.2	0	0	0	0	0	111.8	W958 V1018 I1019 Y1223	W958-A1026 HydrophobicContact CH2-CB 3.44Å; W958-A1026 VanDerWaalsContact CH2-CB 3.44Å; W958-A1026 HydrophobicContact CZ2-CB 4.33Å; W958-A1026 HydrophobicContact CZ3-CB 3.83Å; V1018-A1026 WeakPolarHBondContact CA-O 3.46Å; I1019-A1026 HydrophobicContact CD1-CB 4.38Å; I1019-A1026 HydrophobicContact CG1-CB 4Å; I1019-A1026 PolarHBondContact N-O 3.32Å; I1019-A1026 PolarHBondContact O-N 2.85Å; A1026-Y1223 HydrophobicContact CB-CD2 3.89Å; A1026-Y1223 HydrophobicContact CB-CE2 3.94Å
1027	L	81.6	Confident	66.6	Low	24 Å²	24	44.2 Å²	44.2	13%	0.126	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	118.1	170.8	176.6	61.3	0	0	0	108.7	L989 R1016 V1018 K1221 L1222 Y1223	L989-L1027 HydrophobicContact CD1-CD1 3.55Å; R1016-L1027 HydrophobicContact CB-CD1 4.45Å; V1018-L1027 HydrophobicContact CG2-CD1 4.44Å; L1027-K1221 PolarHBondContact N-O 2.93Å; L1027-L1222 HydrophobicContact CD2-CD1 3.95Å; L1027-L1222 HydrophobicContact CG-CD1 3.79Å; L1027-L1222 WeakPolarHBondContact O-CA 3.32Å; L1027-Y1223 PolarHBondContact O-N 3.23Å
1028	V	84.1	Confident	64	Low	0 Å²	0	47.4 Å²	47.4	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	137.4	-179.4	-177.8	0	0	0	0	109.5	R1016 F1017 I1019 L1158 Y1223 L1225	R1016-V1028 WeakPolarHBondContact CA-O 3.47Å; F1017-V1028 HydrophobicContact CD2-CB 4.24Å; F1017-V1028 HydrophobicContact CE1-CB 4.11Å; F1017-V1028 HydrophobicContact CE1-CG1 3.82Å; F1017-V1028 HydrophobicContact CE2-CB 3.84Å; F1017-V1028 HydrophobicContact CE2-CG1 3.99Å; F1017-V1028 HydrophobicContact CE2-CG2 4.37Å; F1017-V1028 HydrophobicContact CZ-CB 3.77Å; F1017-V1028 HydrophobicContact CZ-CG1 3.45Å; F1017-V1028 VanDerWaalsContact CZ-CG1 3.45Å; F1017-V1028 PolarHBondContact N-O 2.95Å; F1017-V1028 PolarHBondContact O-N 3.37Å; I1019-V1028 HydrophobicContact CD1-CG2 3.81Å; I1019-V1028 HydrophobicContact CG1-CG2 3.89Å; I1019-V1028 HydrophobicContact CG2-CG2 4.15Å; V1028-L1158 HydrophobicContact CB-CD2 4.42Å; V1028-L1158 HydrophobicContact CG1-CD2 3.65Å; V1028-L1158 HydrophobicContact CG2-CD1 4.15Å; V1028-L1158 HydrophobicContact CG2-CD2 3.82Å; V1028-Y1223 WeakPolarHBondContact CA-O 3.47Å; V1028-L1225 HydrophobicContact CG1-CB 3.84Å; V1028-L1225 HydrophobicContact CG1-CD1 4.38Å
1029	Q	87.7	Confident	61.7	Low	1 Å²	1	53.3 Å²	53.3	1%	0.005	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	125.7	174.1	180	-177.2	-54	0	0	110.4	I1015 R1016 G1031 L1222 Y1223 T1224 L1225	I1015-Q1029 CarbonylContact O-C 3.6Å; I1015-Q1029 WeakPolarHBondContact O-CA 3.11Å; R1016-Q1029 HydrophobicContact CG-CB 4.12Å; R1016-Q1029 HydrophobicContact CG-CG 3.99Å; R1016-Q1029 VanDerWaalsContact CZ-OE1 3.29Å; Q1029-G1031 PolarHBondContact NE2-O 2.98Å; Q1029-L1222 HydrophobicContact CB-CD1 3.92Å; Q1029-Y1223 PolarHBondContact N-O 2.88Å; Q1029-T1224 CarbonylContact O-C 3.56Å; Q1029-T1224 WeakPolarHBondContact O-CA 3.36Å; Q1029-L1225 PolarHBondContact O-N 3Å
1030	L	86.1	Confident	59.5	Low	0 Å²	0	57.4 Å²	57.4	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	140.2	161.4	176.9	62.2	0	0	0	108.9	C1014 I1015 L1065 A1066 L1069 L1225	C1014-L1030 VanDerWaalsContact CA-O 3.32Å; C1014-L1030 WeakPolarHBondContact CA-O 3.32Å; C1014-L1030 PolarHBondContact SG-O 2.98Å; I1015-L1030 HydrophobicContact CB-CB 4.43Å; I1015-L1030 HydrophobicContact CD1-CD2 4.35Å; I1015-L1030 PolarHBondContact N-O 3.25Å; I1015-L1030 PolarHBondContact O-N 2.91Å; L1030-L1065 HydrophobicContact CD1-CB 3.8Å; L1030-L1065 HydrophobicContact CD1-CD1 4.1Å; L1030-L1065 HydrophobicContact CD2-CB 4.29Å; L1030-A1066 HydrophobicContact CD2-CB 3.78Å; L1030-L1069 HydrophobicContact CD2-CD2 4.42Å; L1030-L1225 HydrophobicContact CB-CB 4.29Å; L1030-L1225 HydrophobicContact CB-CD2 4.26Å; L1030-L1225 HydrophobicContact CD1-CB 4.4Å; L1030-L1225 HydrophobicContact CD1-CD2 4.3Å; L1030-L1225 HydrophobicContact CD2-CD2 4.47Å
1031	G	80.3	Confident	57.5	Low	5 Å²	5	61.4 Å²	61.4	5%	0.052	38%	0.383	C	S	.	.	S	Bend	trans	67.5	-163.2	178.1	0	0	0	0	0	114.8	I1013 Q1029	I1013-G1031 WeakPolarHBondContact O-CA 3.4Å; Q1029-G1031 PolarHBondContact NE2-O 2.98Å
1032	H	72.8	Confident	56.2	Low	104 Å²	104	63 Å²	63	48%	0.481	40%	0.399	S	S	.	.			trans	-125.7	135.6	178.9	-75.7	83.4	0	0	0	110.1	Y994 C1014 R1161	Y994-H1032 VanDerWaalsContact CE1-O 3.27Å; Y994-H1032 WeakPolarHBondContact CE1-O 3.44Å; Y994-H1032 PolarHBondContact OH-O 3.17Å; C1014-H1032 WeakPolarHBondContact CB-O 3.36Å; H1032-R1161 PolarHBondContact CE1-NH2 2.98Å; H1032-R1161 PolarHBondContact NE2-NH2 3.16Å
1033	P	62.8	Low	55.3	Low	38 Å²	38	63.7 Å²	63.7	25%	0.247	41%	0.407	C	S	.	.			trans	-66.9	140.5	177.4	29.9	-36.2	0	0	0	110.3
1034	F	59.2	Low	54.4	Low	100 Å²	100	66.5 Å²	66.5	44%	0.439	42%	0.422	S	S	.	.			trans	-78.8	125.2	175	-170.1	-104.3	0	0	0	109.8	Y994 M1036	Y994-F1034 HydrophobicContact CD1-CB 3.81Å; Y994-F1034 HydrophobicContact CD2-CB 4.07Å; Y994-F1034 AromaticContact CD2-CD2 3.59Å; Y994-F1034 HydrophobicContact CD2-CD2 3.59Å; Y994-F1034 HydrophobicContact CD2-CE2 4.38Å; Y994-F1034 HydrophobicContact CD2-CG 4.12Å; Y994-F1034 HydrophobicContact CE1-CB 4.37Å; Y994-F1034 HydrophobicContact CE2-CD2 4.21Å; Y994-F1034 HydrophobicContact CG-CB 3.66Å; Y994-F1034 AromaticContact CG-CD2 3.96Å; Y994-F1034 HydrophobicContact CG-CD2 3.96Å; Y994-F1034 HydrophobicContact CG-CG 4Å; F1034-M1036 HydrophobicContact CD1-CG 4.14Å; F1034-M1036 HydrophobicContact CE1-CG 3.68Å
1035	I	50.7	Low	53.1	Low	114 Å²	114	71.3 Å²	71.3	59%	0.585	45%	0.451	S	S	*	.			trans	-107.8	106.4	176.6	-55.7	175.6	0	0	0	107.1	P1037	I1035-P1037 VanDerWaalsContact O-CD 3.28Å; I1035-P1037 WeakPolarHBondContact O-CD 3Å
1036	M	37.5	Very low	51.6	Low	157 Å²	157	73.9 Å²	73.9	77%	0.773	47%	0.468	S	S	*	.	P	Polyproline II helix	trans	-67.1	121	166.1	-78.9	-163.1	95.7	0	0	109.1	F1034 S1038	F1034-M1036 HydrophobicContact CD1-CG 4.14Å; F1034-M1036 HydrophobicContact CE1-CG 3.68Å; M1036-S1038 PolarHBondContact O-N 2.68Å
1037	P	29.6	Very low	49.5	Very low	101 Å²	101	81.7 Å²	81.7	66%	0.656	50%	0.504	S	S	*	.	P	Polyproline II helix	trans	-67.4	126.5	166.3	28.3	-31.6	0	0	0	108.7	I1035 S1039	I1035-P1037 VanDerWaalsContact O-CD 3.28Å; I1035-P1037 WeakPolarHBondContact O-CD 3Å; P1037-S1039 PolarHBondContact O-N 3.47Å
1038	S	30.6	Very low	47.3	Very low	68 Å²	68	85.8 Å²	85.8	48%	0.476	53%	0.525	S	S	.	.	P	Polyproline II helix	trans	-56.1	135.8	172.2	51.8	0	0	0	0	110	M1036 S1040	M1036-S1038 PolarHBondContact O-N 2.68Å; S1038-S1040 VanDerWaalsContact C-N 3.27Å; S1038-S1040 PolarHBondContact O-N 3.49Å; S1038-S1040 PolarHBondContact O-OG 3.38Å
1039	S	31.3	Very low	44.8	Very low	135 Å²	135	91.1 Å²	91.1	94%	0.944	55%	0.553	S	S	*	*	S	Bend	trans	-66.8	74.2	-173.7	39.1	0	0	0	0	113.6	P1037	P1037-S1039 PolarHBondContact O-N 3.47Å
1040	S	31.7	Very low	42.1	Very low	85 Å²	85	95.6 Å²	95.6	59%	0.594	58%	0.584	S	S	*	*			trans	-130.2	90.6	174.8	57.6	0	0	0	0	110.9	S1038	S1038-S1040 VanDerWaalsContact C-N 3.27Å; S1038-S1040 PolarHBondContact O-N 3.49Å; S1038-S1040 PolarHBondContact O-OG 3.38Å
1041	S	31	Very low	39.4	Very low	117 Å²	117	99.2 Å²	99.2	82%	0.818	60%	0.604	S	S	*	*	S	Bend	trans	38.3	83.9	153.6	63.3	0	0	0	0	119
1042	S	34	Very low	37	Very low	104 Å²	104	106.5 Å²	106.5	73%	0.727	64%	0.642	S	S	*	*				179	140.6	126	42.8	0	0	0	0	109.7	V1044	S1042-V1044 PolarHBondContact O-N 2.87Å
1043	G	29.6	Very low	35.3	Very low	88 Å²	88	106 Å²	106	91%	0.907	64%	0.642	S	S	*	*			trans	-77.3	56.3	-170.9	0	0	0	0	0	114.8
1044	V	27.9	Very low	33.9	Very low	111 Å²	111	110.2 Å²	110.2	67%	0.673	67%	0.673	S	S	*	*			trans	-89.3	118	168.5	-173.8	0	0	0	0	108.1	S1042	S1042-V1044 PolarHBondContact O-N 2.87Å
1045	P	30.3	Very low	32.9	Very low	111 Å²	111	108.5 Å²	108.5	72%	0.721	67%	0.673	S	S	*	*			trans	-62.4	151.7	-179.9	-21.9	33.3	0	0	0	112.3	Q1047	P1045-Q1047 PolarHBondContact O-N 2.88Å
1046	C	32.3	Very low	32.6	Very low	89 Å²	89	108.3 Å²	108.3	60%	0.601	68%	0.682	S	S	*	*			trans	-55	98.4	-179.8	-58.5	0	0	0	0	112.4	I1048	C1046-I1048 PolarHBondContact O-N 2.78Å
1047	Q	28.8	Very low	33.2	Very low	164 Å²	164	103 Å²	103	77%	0.766	66%	0.659	S	S	*	*			trans	-80	109	160.7	-72.9	-175.9	-15.5	0	0	108.1	P1045 L1049	P1045-Q1047 PolarHBondContact O-N 2.88Å; Q1047-L1049 PolarHBondContact O-N 3.15Å
1048	I	34.7	Very low	34.5	Very low	109 Å²	109	100.1 Å²	100.1	56%	0.559	64%	0.641	S	S	*	*			trans	-48.3	125.9	152.4	-62.2	171.6	0	0	0	105.4	L996 C1046 S1050	L996-I1048 HydrophobicContact CD2-CD1 3.91Å; C1046-I1048 PolarHBondContact O-N 2.78Å; I1048-S1050 VanDerWaalsContact C-N 3.33Å; I1048-S1050 PolarHBondContact O-N 3.11Å
1049	L	32.8	Very low	35.9	Very low	112 Å²	112	99.5 Å²	99.5	59%	0.586	64%	0.635	S	S	*	*			trans	-61.1	96.7	-177.8	-90.6	90.7	0	0	0	109.8	Q1047 N1051 P1166	Q1047-L1049 PolarHBondContact O-N 3.15Å; L1049-N1051 PolarHBondContact O-N 3.46Å; L1049-P1166 HydrophobicContact CD2-CB 3.87Å; L1049-P1166 HydrophobicContact CD2-CG 4.48Å
1050	S	29.5	Very low	37.3	Very low	95 Å²	95	98.4 Å²	98.4	66%	0.664	62%	0.615	S	S	*	*			trans	-74	66.2	165.7	61.7	0	0	0	0	108.6	I1048 N1052	I1048-S1050 VanDerWaalsContact C-N 3.33Å; I1048-S1050 PolarHBondContact O-N 3.11Å; S1050-N1052 PolarHBondContact O-N 3.04Å
1051	N	29.3	Very low	39.1	Very low	77 Å²	77	98.3 Å²	98.3	41%	0.412	61%	0.608	S	S	.	*			trans	-63.2	128	159.4	-83.1	-1.7	0	0	0	106.6	L1049 D1053	L1049-N1051 PolarHBondContact O-N 3.46Å; N1051-D1053 PolarHBondContact O-N 3.24Å
1052	N	30.8	Very low	41.2	Very low	158 Å²	158	94.1 Å²	94.1	85%	0.845	58%	0.576	S	S	*	*			trans	-70.7	35.4	-173.5	-71.6	-25.8	0	0	0	114.2	S1050 S1054	S1050-N1052 PolarHBondContact O-N 3.04Å; N1052-S1054 PolarHBondContact O-N 2.94Å
1053	D	36	Very low	43.4	Very low	92 Å²	92	89.7 Å²	89.7	49%	0.492	55%	0.545	S	S	.	.			trans	-73.5	94.5	167.1	-65.2	-12.4	0	0	0	106.6	N1051 S1055 N1164	N1051-D1053 PolarHBondContact O-N 3.24Å; D1053-S1055 PolarHBondContact O-N 3.32Å; D1053-N1164 PolarHBondContact OD1-ND2 2.79Å
1054	S	34.6	Very low	45.8	Very low	128 Å²	128	89.3 Å²	89.3	90%	0.895	52%	0.519	S	S	*	.	S	Bend	trans	-70.8	34.8	-166.8	62.4	0	0	0	0	115.5	N1052	N1052-S1054 PolarHBondContact O-N 2.94Å
1055	S	37.9	Very low	48.4	Very low	64 Å²	64	84.6 Å²	84.6	45%	0.448	49%	0.49	S	S	.	.			trans	-136.3	44.7	173.7	70.4	0	0	0	0	109.8	D1053 T1057 K1159	D1053-S1055 PolarHBondContact O-N 3.32Å; S1055-T1057 PolarHBondContact O-N 3.22Å; S1055-K1159 PolarHBondContact OG-NZ 3.06Å
1056	S	44.5	Very low	51.1	Low	109 Å²	109	79.3 Å²	79.3	76%	0.762	46%	0.456	S	S	*	.			trans	-66.2	102.4	173.4	56.3	0	0	0	0	109.1	S1058	S1056-S1058 PolarHBondContact O-N 2.82Å
1057	T	49.5	Very low	53.6	Low	47 Å²	47	77.1 Å²	77.1	29%	0.288	44%	0.435	S	S	.	.			trans	-48.5	130.6	163	44	0	0	0	0	108.3	S1055 D1061 N1062	S1055-T1057 PolarHBondContact O-N 3.22Å; T1057-D1061 HydrophobicContact CG2-CB 4.46Å; T1057-N1062 PolarHBondContact O-ND2 3.18Å; T1057-N1062 PolarHBondContact OG1-ND2 3.21Å; T1057-N1062 VanDerWaalsContact OG1-ND2 3.11Å; T1057-N1062 PolarHBondContact OG1-OD1 3.47Å
1058	S	57.8	Low	56.2	Low	39 Å²	39	71.3 Å²	71.3	27%	0.273	41%	0.409	S	S	.	.			trans	-61	159.5	-178.8	68.4	0	0	0	0	110.4	S1056 E1060 D1061 N1062	S1056-S1058 PolarHBondContact O-N 2.82Å; S1058-E1060 PolarHBondContact O-N 3.1Å; S1058-D1061 VanDerWaalsContact CB-OD2 3.29Å; S1058-D1061 WeakPolarHBondContact CB-OD2 3.06Å; S1058-D1061 PolarHBondContact N-OD2 3.27Å; S1058-D1061 PolarHBondContact O-N 3.47Å; S1058-D1061 VanDerWaalsContact O-N 3.16Å; S1058-D1061 PolarHBondContact OG-N 2.91Å; S1058-D1061 PolarHBondContact OG-OD2 2.86Å; S1058-N1062 PolarHBondContact O-N 3.3Å; S1058-N1062 PolarHBondContact O-ND2 2.93Å
1059	P	59.5	Low	58.6	Low	56 Å²	56	66.1 Å²	66.1	36%	0.364	38%	0.382	S	S	.	.	H	α-helix	trans	-52.1	-37.2	172.2	-27.6	36.7	0	0	0	112.2	L996 N1062 L1063	L996-P1059 HydrophobicContact CD1-CB 3.77Å; L996-P1059 HydrophobicContact CD1-CG 4.12Å; P1059-N1062 PolarHBondContact O-N 2.84Å; P1059-L1063 WeakPolarHBondContact O-CG 3.47Å; P1059-L1063 PolarHBondContact O-N 2.99Å
1060	E	60.9	Low	61	Low	112 Å²	112	60.9 Å²	60.9	52%	0.523	36%	0.355	S	S	.	.	H	α-helix	trans	-65.2	-48.4	176.2	-67.8	166.3	-156.5	0	0	112.1	S1058 N1062 L1063 E1064	S1058-E1060 PolarHBondContact O-N 3.1Å; E1060-N1062 VanDerWaalsContact C-N 3.27Å; E1060-N1062 PolarHBondContact O-N 2.91Å; E1060-L1063 PolarHBondContact O-N 2.79Å; E1060-L1063 VanDerWaalsContact O-N 3.12Å; E1060-E1064 PolarHBondContact O-N 2.77Å
1061	D	69.6	Low	63.4	Low	82 Å²	82	58.3 Å²	58.3	44%	0.439	34%	0.344	S	S	.	.	H	α-helix	trans	-57.2	-41.9	174.8	-61.3	-46.4	0	0	0	111.2	T1057 S1058 L1063 E1064 L1065	T1057-D1061 HydrophobicContact CG2-CB 4.46Å; S1058-D1061 VanDerWaalsContact CB-OD2 3.29Å; S1058-D1061 WeakPolarHBondContact CB-OD2 3.06Å; S1058-D1061 PolarHBondContact N-OD2 3.27Å; S1058-D1061 PolarHBondContact O-N 3.47Å; S1058-D1061 VanDerWaalsContact O-N 3.16Å; S1058-D1061 PolarHBondContact OG-N 2.91Å; S1058-D1061 PolarHBondContact OG-OD2 2.86Å; D1061-L1063 VanDerWaalsContact C-N 3.35Å; D1061-L1063 PolarHBondContact O-N 2.92Å; D1061-E1064 PolarHBondContact O-N 3.37Å; D1061-L1065 WeakPolarHBondContact O-CB 3.27Å; D1061-L1065 WeakPolarHBondContact O-CD1 3.32Å; D1061-L1065 WeakPolarHBondContact O-CG 3.31Å; D1061-L1065 PolarHBondContact O-N 2.87Å
1062	N	75.6	Confident	65.6	Low	29 Å²	29	56 Å²	56	16%	0.155	33%	0.331	C	S	.	.	H	α-helix	trans	-66.9	-35.2	179.2	-69.9	-63.8	0	0	0	112.4	T1057 S1058 P1059 E1060 A1066	T1057-N1062 PolarHBondContact O-ND2 3.18Å; T1057-N1062 PolarHBondContact OG1-ND2 3.21Å; T1057-N1062 VanDerWaalsContact OG1-ND2 3.11Å; T1057-N1062 PolarHBondContact OG1-OD1 3.47Å; S1058-N1062 PolarHBondContact O-N 3.3Å; S1058-N1062 PolarHBondContact O-ND2 2.93Å; P1059-N1062 PolarHBondContact O-N 2.84Å; E1060-N1062 VanDerWaalsContact C-N 3.27Å; E1060-N1062 PolarHBondContact O-N 2.91Å; N1062-A1066 WeakPolarHBondContact O-CB 3.33Å; N1062-A1066 PolarHBondContact O-N 3.25Å
1063	L	79.7	Confident	67.8	Low	12 Å²	12	52.6 Å²	52.6	6%	0.063	31%	0.313	C	S	.	.	H	α-helix	trans	-69.6	-39.1	173.3	-71.6	172.5	0	0	0	111.6	F1008 L1011 I1013 P1059 E1060 D1061 A1066 R1067 W1077	F1008-L1063 HydrophobicContact CB-CD1 4.5Å; L1011-L1063 HydrophobicContact CB-CD1 4.41Å; L1011-L1063 HydrophobicContact CB-CD2 4.17Å; I1013-L1063 HydrophobicContact CD1-CD2 3.61Å; I1013-L1063 HydrophobicContact CG1-CD2 3.88Å; P1059-L1063 WeakPolarHBondContact O-CG 3.47Å; P1059-L1063 PolarHBondContact O-N 2.99Å; E1060-L1063 PolarHBondContact O-N 2.79Å; E1060-L1063 VanDerWaalsContact O-N 3.12Å; D1061-L1063 VanDerWaalsContact C-N 3.35Å; D1061-L1063 PolarHBondContact O-N 2.92Å; L1063-A1066 WeakPolarHBondContact O-CB 3.14Å; L1063-A1066 PolarHBondContact O-N 3.22Å; L1063-R1067 PolarHBondContact O-N 2.99Å; L1063-W1077 HydrophobicContact CB-CZ2 4.4Å; L1063-W1077 HydrophobicContact CD2-CZ2 4.23Å; L1063-W1077 WeakPolarHBondContact O-CZ2 3.5Å; L1063-W1077 PolarHBondContact O-NE1 2.77Å
1064	E	79.4	Confident	69.7	Low	79 Å²	79	51.2 Å²	51.2	37%	0.369	31%	0.309	S	S	.	.	H	α-helix	trans	-72.5	-37.5	178.7	-172	63.3	179.5	0	0	112.1	E1060 D1061 A1066 R1067 L1068	E1060-E1064 PolarHBondContact O-N 2.77Å; D1061-E1064 PolarHBondContact O-N 3.37Å; E1064-A1066 VanDerWaalsContact C-N 3.33Å; E1064-A1066 PolarHBondContact O-N 2.93Å; E1064-R1067 VanDerWaalsContact O-CB 3.32Å; E1064-R1067 WeakPolarHBondContact O-CB 3.28Å; E1064-R1067 PolarHBondContact O-N 2.85Å; E1064-R1067 IonicContact OE1-CZ 2.77Å; E1064-R1067 IonicContact OE1-NE 2.77Å; E1064-R1067 PolarHBondContact OE1-NE 3.25Å; E1064-R1067 IonicContact OE1-NH2 3.42Å; E1064-R1067 PolarHBondContact OE1-NH2 3.3Å; E1064-R1067 WeakPolarHBondContact OE2-CD 3.16Å; E1064-R1067 IonicContact OE2-CZ 2.91Å; E1064-R1067 IonicContact OE2-NE 2.93Å; E1064-R1067 PolarHBondContact OE2-NE 3.39Å; E1064-R1067 IonicContact OE2-NH2 3.5Å; E1064-L1068 WeakPolarHBondContact O-CG 3.31Å; E1064-L1068 PolarHBondContact O-N 2.89Å
1065	L	83.9	Confident	71.3	Confident	12 Å²	12	51.2 Å²	51.2	6%	0.063	30%	0.299	C	S	.	.	H	α-helix	trans	-61.5	-39.8	168.5	-72.4	167.3	0	0	0	112	L1030 D1061 R1067 L1068 L1069 I1226	L1030-L1065 HydrophobicContact CD1-CB 3.8Å; L1030-L1065 HydrophobicContact CD1-CD1 4.1Å; L1030-L1065 HydrophobicContact CD2-CB 4.29Å; D1061-L1065 WeakPolarHBondContact O-CB 3.27Å; D1061-L1065 WeakPolarHBondContact O-CD1 3.32Å; D1061-L1065 WeakPolarHBondContact O-CG 3.31Å; D1061-L1065 PolarHBondContact O-N 2.87Å; L1065-R1067 VanDerWaalsContact C-N 3.34Å; L1065-L1068 PolarHBondContact O-N 2.82Å; L1065-L1069 VanDerWaalsContact O-CB 3.26Å; L1065-L1069 WeakPolarHBondContact O-CB 3.35Å; L1065-L1069 PolarHBondContact O-N 2.94Å; L1065-I1226 WeakPolarHBondContact CD1-O 3.39Å; L1065-I1226 WeakPolarHBondContact CD2-O 3.29Å
1066	A	86	Confident	72.9	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-64.3	-40.3	174.2	0	0	0	0	0	111.4	I1013 L1030 N1062 L1063 E1064 L1070 W1077	I1013-A1066 HydrophobicContact CD1-CB 4.04Å; I1013-A1066 HydrophobicContact CG2-CB 4.21Å; L1030-A1066 HydrophobicContact CD2-CB 3.78Å; N1062-A1066 WeakPolarHBondContact O-CB 3.33Å; N1062-A1066 PolarHBondContact O-N 3.25Å; L1063-A1066 WeakPolarHBondContact O-CB 3.14Å; L1063-A1066 PolarHBondContact O-N 3.22Å; E1064-A1066 VanDerWaalsContact C-N 3.33Å; E1064-A1066 PolarHBondContact O-N 2.93Å; A1066-L1070 VanDerWaalsContact O-CB 3.31Å; A1066-L1070 WeakPolarHBondContact O-CB 3.44Å; A1066-L1070 WeakPolarHBondContact O-CD1 3.44Å; A1066-L1070 VanDerWaalsContact O-CG 3.24Å; A1066-L1070 WeakPolarHBondContact O-CG 3.43Å; A1066-L1070 PolarHBondContact O-N 2.85Å; A1066-W1077 HydrophobicContact CB-CH2 3.83Å; A1066-W1077 HydrophobicContact CB-CZ2 4.01Å
1067	R	85.4	Confident	74.6	Confident	43 Å²	43	47.8 Å²	47.8	16%	0.162	27%	0.265	C	S	.	.	H	α-helix	trans	-58.5	-51	174.5	-174.5	-172.9	71.9	68.8	-1.8	111.9	L1063 E1064 L1065 L1070 G1071 L1072 W1077	L1063-R1067 PolarHBondContact O-N 2.99Å; E1064-R1067 VanDerWaalsContact O-CB 3.32Å; E1064-R1067 WeakPolarHBondContact O-CB 3.28Å; E1064-R1067 PolarHBondContact O-N 2.85Å; E1064-R1067 IonicContact OE1-CZ 2.77Å; E1064-R1067 IonicContact OE1-NE 2.77Å; E1064-R1067 PolarHBondContact OE1-NE 3.25Å; E1064-R1067 IonicContact OE1-NH2 3.42Å; E1064-R1067 PolarHBondContact OE1-NH2 3.3Å; E1064-R1067 WeakPolarHBondContact OE2-CD 3.16Å; E1064-R1067 IonicContact OE2-CZ 2.91Å; E1064-R1067 IonicContact OE2-NE 2.93Å; E1064-R1067 PolarHBondContact OE2-NE 3.39Å; E1064-R1067 IonicContact OE2-NH2 3.5Å; L1065-R1067 VanDerWaalsContact C-N 3.34Å; R1067-L1070 CarbonylContact O-C 3.59Å; R1067-L1070 PolarHBondContact O-N 2.99Å; R1067-G1071 PolarHBondContact O-N 3.06Å; R1067-L1072 WeakPolarHBondContact CD-O 3.34Å; R1067-L1072 HydrophobicContact CG-CB 4.39Å; R1067-L1072 WeakPolarHBondContact CG-O 3.37Å; R1067-L1072 PolarHBondContact NH1-O 2.9Å; R1067-L1072 PolarHBondContact O-N 2.89Å; R1067-L1072 VanDerWaalsContact O-N 3.11Å; R1067-W1077 HydrophobicContact CB-CD2 3.78Å; R1067-W1077 HydrophobicContact CB-CE3 4.39Å; R1067-W1077 HydrophobicContact CB-CG 3.84Å; R1067-W1077 HydrophobicContact CB-CZ2 4.32Å; R1067-W1077 HydrophobicContact CG-CB 3.76Å; R1067-W1077 HydrophobicContact CG-CD2 3.92Å; R1067-W1077 HydrophobicContact CG-CE3 4.5Å; R1067-W1077 HydrophobicContact CG-CG 3.56Å
1068	L	83.4	Confident	75.8	Confident	43 Å²	43	50.2 Å²	50.2	23%	0.225	27%	0.272	C	S	.	.	H	α-helix	trans	-63.9	-45.3	-179.6	-70.7	170.6	0	0	0	111.4	E1064 L1065 L1070 G1071 R1152 V1228	E1064-L1068 WeakPolarHBondContact O-CG 3.31Å; E1064-L1068 PolarHBondContact O-N 2.89Å; L1065-L1068 PolarHBondContact O-N 2.82Å; L1068-L1070 VanDerWaalsContact C-N 3.34Å; L1068-L1070 PolarHBondContact O-N 3.43Å; L1068-G1071 PolarHBondContact O-N 2.78Å; L1068-R1152 PolarHBondContact O-NH2 2.85Å; L1068-V1228 HydrophobicContact CB-CG1 3.76Å
1069	L	85.5	Confident	76.5	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-59.8	-43.6	176.4	-171.1	70.5	0	0	0	111.6	I985 I1015 F1017 L1030 L1065 G1071 F1150 R1152 F1156 L1225 V1228	I985-L1069 HydrophobicContact CD1-CD1 3.66Å; I985-L1069 HydrophobicContact CD1-CG 4.47Å; I1015-L1069 HydrophobicContact CD1-CD2 4.13Å; I1015-L1069 HydrophobicContact CG2-CD2 4.48Å; F1017-L1069 HydrophobicContact CD1-CD2 4.11Å; F1017-L1069 HydrophobicContact CE1-CD1 4.21Å; F1017-L1069 HydrophobicContact CE1-CD2 3.53Å; F1017-L1069 HydrophobicContact CE2-CD1 4.22Å; F1017-L1069 HydrophobicContact CZ-CD1 3.75Å; F1017-L1069 HydrophobicContact CZ-CD2 3.96Å; L1030-L1069 HydrophobicContact CD2-CD2 4.42Å; L1065-L1069 VanDerWaalsContact O-CB 3.26Å; L1065-L1069 WeakPolarHBondContact O-CB 3.35Å; L1065-L1069 PolarHBondContact O-N 2.94Å; L1069-G1071 PolarHBondContact O-N 3.44Å; L1069-F1150 HydrophobicContact CD2-CE2 4.45Å; L1069-F1150 HydrophobicContact CG-CE2 4.15Å; L1069-R1152 PolarHBondContact O-NH2 3.4Å; L1069-F1156 HydrophobicContact CD1-CE1 4.04Å; L1069-L1225 HydrophobicContact CD1-CD2 4.32Å; L1069-L1225 HydrophobicContact CD2-CD2 4.35Å; L1069-V1228 HydrophobicContact CB-CG1 4.2Å; L1069-V1228 HydrophobicContact CD1-CG2 4.24Å
1070	L	82.7	Confident	77.3	Confident	1 Å²	1	56.9 Å²	56.9	1%	0.005	29%	0.286	C	S	.	.	H	α-helix	trans	-72.8	-12.9	174.6	-67.5	167.4	0	0	0	112.8	A1066 R1067 L1068 L1072 W1077 W1084 Y1144 L1145 F1150	A1066-L1070 VanDerWaalsContact O-CB 3.31Å; A1066-L1070 WeakPolarHBondContact O-CB 3.44Å; A1066-L1070 WeakPolarHBondContact O-CD1 3.44Å; A1066-L1070 VanDerWaalsContact O-CG 3.24Å; A1066-L1070 WeakPolarHBondContact O-CG 3.43Å; A1066-L1070 PolarHBondContact O-N 2.85Å; R1067-L1070 CarbonylContact O-C 3.59Å; R1067-L1070 PolarHBondContact O-N 2.99Å; L1068-L1070 VanDerWaalsContact C-N 3.34Å; L1068-L1070 PolarHBondContact O-N 3.43Å; L1070-L1072 VanDerWaalsContact C-N 3.28Å; L1070-L1072 HydrophobicContact CB-CD1 3.91Å; L1070-L1072 HydrophobicContact CB-CG 3.92Å; L1070-L1072 HydrophobicContact CD1-CD1 4.2Å; L1070-L1072 PolarHBondContact O-N 3.44Å; L1070-W1077 HydrophobicContact CD1-CH2 4.06Å; L1070-W1077 HydrophobicContact CD1-CZ3 3.57Å; L1070-W1084 HydrophobicContact CD1-CH2 4.45Å; L1070-Y1144 HydrophobicContact CD2-CE1 4.17Å; L1070-Y1144 PolarHBondContact O-OH 2.67Å; L1070-L1145 HydrophobicContact CD2-CD2 3.95Å; L1070-F1150 HydrophobicContact CD2-CD2 3.96Å; L1070-F1150 HydrophobicContact CD2-CE2 3.91Å
1071	G	79.4	Confident	78.2	Confident	42 Å²	42	51.6 Å²	51.6	43%	0.433	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.3	30.2	-178.4	0	0	0	0	0	113.6	R1067 L1068 L1069	R1067-G1071 PolarHBondContact O-N 3.06Å; L1068-G1071 PolarHBondContact O-N 2.78Å; L1069-G1071 PolarHBondContact O-N 3.44Å
1072	L	76.2	Confident	78.4	Confident	29 Å²	29	49.9 Å²	49.9	15%	0.152	26%	0.255	C	S	.	.			trans	-93.3	136.4	-179.5	-63.7	173.9	0	0	0	110.1	R1067 L1070 I1076 W1077 L1080	R1067-L1072 WeakPolarHBondContact CD-O 3.34Å; R1067-L1072 HydrophobicContact CG-CB 4.39Å; R1067-L1072 WeakPolarHBondContact CG-O 3.37Å; R1067-L1072 PolarHBondContact NH1-O 2.9Å; R1067-L1072 PolarHBondContact O-N 2.89Å; R1067-L1072 VanDerWaalsContact O-N 3.11Å; L1070-L1072 VanDerWaalsContact C-N 3.28Å; L1070-L1072 HydrophobicContact CB-CD1 3.91Å; L1070-L1072 HydrophobicContact CB-CG 3.92Å; L1070-L1072 HydrophobicContact CD1-CD1 4.2Å; L1070-L1072 PolarHBondContact O-N 3.44Å; L1072-I1076 HydrophobicContact CD2-CG2 4.18Å; L1072-W1077 HydrophobicContact CB-CB 4.5Å; L1072-W1077 HydrophobicContact CD1-CE3 3.77Å; L1072-W1077 HydrophobicContact CD1-CZ3 4.12Å; L1072-L1080 HydrophobicContact CD1-CD2 3.66Å
1073	N	76.8	Confident	78.2	Confident	85 Å²	85	53.7 Å²	53.7	46%	0.455	27%	0.273	S	S	.	.			trans	-69.3	156.1	171.5	72.4	38.2	0	0	0	110.8	L1075 I1076 W1077	N1073-L1075 VanDerWaalsContact C-N 3.26Å; N1073-L1075 PolarHBondContact O-N 2.82Å; N1073-L1075 PolarHBondContact OD1-N 3.12Å; N1073-I1076 PolarHBondContact O-N 2.86Å; N1073-I1076 WeakPolarHBondContact OD1-CB 3.23Å; N1073-I1076 VanDerWaalsContact OD1-CG1 3.31Å; N1073-I1076 WeakPolarHBondContact OD1-CG1 3.18Å; N1073-I1076 PolarHBondContact OD1-N 2.81Å; N1073-W1077 WeakPolarHBondContact O-CB 3.39Å; N1073-W1077 PolarHBondContact O-N 2.98Å
1074	C	74.8	Confident	78.2	Confident	63 Å²	63	53.3 Å²	53.3	43%	0.426	27%	0.27	S	S	.	.	H	α-helix	trans	-55.4	-36.8	-175.3	-178.6	0	0	0	0	113.5	K1078	C1074-K1078 WeakPolarHBondContact O-CG 3.44Å; C1074-K1078 PolarHBondContact O-N 2.9Å
1075	L	68.7	Low	78	Confident	128 Å²	128	51.7 Å²	51.7	67%	0.67	26%	0.262	S	S	*	.	H	α-helix	trans	-69.7	-41.7	179.9	-72.8	171.4	0	0	0	113.4	N1073 R1079	N1073-L1075 VanDerWaalsContact C-N 3.26Å; N1073-L1075 PolarHBondContact O-N 2.82Å; N1073-L1075 PolarHBondContact OD1-N 3.12Å; L1075-R1079 WeakPolarHBondContact O-CG 3.4Å; L1075-R1079 PolarHBondContact O-N 3.23Å
1076	I	71.5	Confident	77.5	Confident	87 Å²	87	59.7 Å²	59.7	45%	0.446	29%	0.291	S	S	.	.	H	α-helix	trans	-70.5	-41	176	-67.2	170.1	0	0	0	109.5	L1072 N1073 R1079 L1080	L1072-I1076 HydrophobicContact CD2-CG2 4.18Å; N1073-I1076 PolarHBondContact O-N 2.86Å; N1073-I1076 WeakPolarHBondContact OD1-CB 3.23Å; N1073-I1076 VanDerWaalsContact OD1-CG1 3.31Å; N1073-I1076 WeakPolarHBondContact OD1-CG1 3.18Å; N1073-I1076 PolarHBondContact OD1-N 2.81Å; I1076-R1079 PolarHBondContact O-N 2.78Å; I1076-L1080 WeakPolarHBondContact O-CB 3.06Å; I1076-L1080 PolarHBondContact O-N 2.95Å
1077	W	80.2	Confident	76.8	Confident	15 Å²	15	60.5 Å²	60.5	6%	0.057	30%	0.296	C	S	.	.	H	α-helix	trans	-56.9	-53.7	176.9	-176.5	-122.3	0	0	0	112.6	I1013 L1063 A1066 R1067 L1070 L1072 N1073 R1079 L1080 C1081 W1084	I1013-W1077 HydrophobicContact CD1-CH2 3.54Å; I1013-W1077 HydrophobicContact CD1-CZ2 3.91Å; L1063-W1077 HydrophobicContact CB-CZ2 4.4Å; L1063-W1077 HydrophobicContact CD2-CZ2 4.23Å; L1063-W1077 WeakPolarHBondContact O-CZ2 3.5Å; L1063-W1077 PolarHBondContact O-NE1 2.77Å; A1066-W1077 HydrophobicContact CB-CH2 3.83Å; A1066-W1077 HydrophobicContact CB-CZ2 4.01Å; R1067-W1077 HydrophobicContact CB-CD2 3.78Å; R1067-W1077 HydrophobicContact CB-CE3 4.39Å; R1067-W1077 HydrophobicContact CB-CG 3.84Å; R1067-W1077 HydrophobicContact CB-CZ2 4.32Å; R1067-W1077 HydrophobicContact CG-CB 3.76Å; R1067-W1077 HydrophobicContact CG-CD2 3.92Å; R1067-W1077 HydrophobicContact CG-CE3 4.5Å; R1067-W1077 HydrophobicContact CG-CG 3.56Å; L1070-W1077 HydrophobicContact CD1-CH2 4.06Å; L1070-W1077 HydrophobicContact CD1-CZ3 3.57Å; L1072-W1077 HydrophobicContact CB-CB 4.5Å; L1072-W1077 HydrophobicContact CD1-CE3 3.77Å; L1072-W1077 HydrophobicContact CD1-CZ3 4.12Å; N1073-W1077 WeakPolarHBondContact O-CB 3.39Å; N1073-W1077 PolarHBondContact O-N 2.98Å; W1077-R1079 VanDerWaalsContact C-N 3.28Å; W1077-R1079 PolarHBondContact O-N 3.19Å; W1077-L1080 HydrophobicContact CE3-CD2 4.42Å; W1077-L1080 HydrophobicContact CZ3-CD2 4.44Å; W1077-L1080 PolarHBondContact O-N 2.93Å; W1077-L1080 VanDerWaalsContact O-N 3.07Å; W1077-C1081 PolarHBondContact O-N 2.73Å; W1077-C1081 PolarHBondContact O-SG 3.01Å; W1077-W1084 AromaticContact CH2-CZ3 3.83Å; W1077-W1084 HydrophobicContact CH2-CZ3 3.83Å; W1077-W1084 HydrophobicContact CZ3-CH2 4.03Å; W1077-W1084 AromaticContact CZ3-CZ3 3.61Å; W1077-W1084 HydrophobicContact CZ3-CZ3 3.61Å
1078	K	75.5	Confident	76.2	Confident	98 Å²	98	59.9 Å²	59.9	43%	0.426	30%	0.295	S	S	.	.	H	α-helix	trans	-56.1	-41.7	177.4	-74.1	-171.9	176.2	-163.5	0	112	F1008 C1074 C1082	F1008-K1078 HydrophobicContact CE1-CB 4.24Å; F1008-K1078 HydrophobicContact CE1-CG 4.39Å; F1008-K1078 WeakPolarHBondContact CE1-O 3.37Å; F1008-K1078 HydrophobicContact CE2-CB 4.44Å; F1008-K1078 HydrophobicContact CE2-CD 4.04Å; F1008-K1078 HydrophobicContact CE2-CG 4Å; F1008-K1078 HydrophobicContact CZ-CB 3.73Å; F1008-K1078 HydrophobicContact CZ-CD 4.19Å; F1008-K1078 HydrophobicContact CZ-CG 3.76Å; C1074-K1078 WeakPolarHBondContact O-CG 3.44Å; C1074-K1078 PolarHBondContact O-N 2.9Å; K1078-C1082 PolarHBondContact O-N 2.76Å; K1078-C1082 PolarHBondContact O-SG 3.28Å
1079	R	71.4	Confident	75.6	Confident	195 Å²	195	61.6 Å²	61.6	74%	0.736	31%	0.305	S	S	*	.	H	α-helix	trans	-64.1	-42.8	175.7	-72.5	176.8	176.2	-165.8	-2.2	112.9	L1075 I1076 W1077 C1082 Q1083	L1075-R1079 WeakPolarHBondContact O-CG 3.4Å; L1075-R1079 PolarHBondContact O-N 3.23Å; I1076-R1079 PolarHBondContact O-N 2.78Å; W1077-R1079 VanDerWaalsContact C-N 3.28Å; W1077-R1079 PolarHBondContact O-N 3.19Å; R1079-C1082 PolarHBondContact O-N 3.28Å; R1079-Q1083 PolarHBondContact O-N 2.93Å; R1079-Q1083 VanDerWaalsContact O-N 3.08Å
1080	L	77.6	Confident	74.8	Confident	39 Å²	39	66 Å²	66	20%	0.204	33%	0.325	C	S	.	.	H	α-helix	trans	-66.4	-44.9	-179.8	-172.1	63	0	0	0	111.1	L1072 I1076 W1077 C1082 Q1083 W1084	L1072-L1080 HydrophobicContact CD1-CD2 3.66Å; I1076-L1080 WeakPolarHBondContact O-CB 3.06Å; I1076-L1080 PolarHBondContact O-N 2.95Å; W1077-L1080 HydrophobicContact CE3-CD2 4.42Å; W1077-L1080 HydrophobicContact CZ3-CD2 4.44Å; W1077-L1080 PolarHBondContact O-N 2.93Å; W1077-L1080 VanDerWaalsContact O-N 3.07Å; L1080-C1082 PolarHBondContact O-N 3.02Å; L1080-Q1083 PolarHBondContact O-N 3.36Å; L1080-Q1083 VanDerWaalsContact O-N 3.13Å; L1080-W1084 HydrophobicContact CD1-CD2 4.33Å; L1080-W1084 HydrophobicContact CD1-CZ2 3.88Å; L1080-W1084 HydrophobicContact CD2-CE3 4.49Å; L1080-W1084 HydrophobicContact CD2-CH2 3.42Å; L1080-W1084 VanDerWaalsContact CD2-CH2 3.42Å; L1080-W1084 HydrophobicContact CD2-CZ2 3.49Å; L1080-W1084 VanDerWaalsContact CD2-CZ2 3.49Å; L1080-W1084 HydrophobicContact CD2-CZ3 3.95Å; L1080-W1084 HydrophobicContact CG-CD2 3.88Å; L1080-W1084 HydrophobicContact CG-CE3 4.02Å; L1080-W1084 HydrophobicContact CG-CH2 3.78Å; L1080-W1084 HydrophobicContact CG-CZ2 3.57Å; L1080-W1084 HydrophobicContact CG-CZ3 3.98Å; L1080-W1084 PolarHBondContact O-N 3.34Å
1081	C	78.9	Confident	74	Confident	1 Å²	1	69.3 Å²	69.3	1%	0.007	36%	0.359	C	S	.	.	H	α-helix	trans	-61.1	-41	173.9	-67.3	0	0	0	0	112.4	F1008 L1011 W1077 Q1083 W1084 K1085	F1008-C1081 HydrophobicContact CD1-CB 3.68Å; F1008-C1081 HydrophobicContact CE1-CB 3.81Å; L1011-C1081 HydrophobicContact CD1-CB 3.94Å; W1077-C1081 PolarHBondContact O-N 2.73Å; W1077-C1081 PolarHBondContact O-SG 3.01Å; C1081-Q1083 VanDerWaalsContact C-N 3.32Å; C1081-Q1083 PolarHBondContact O-N 2.96Å; C1081-W1084 PolarHBondContact O-N 3.41Å; C1081-K1085 WeakPolarHBondContact O-CB 3.32Å; C1081-K1085 PolarHBondContact O-N 3.06Å
1082	C	73	Confident	73.3	Confident	46 Å²	46	68.2 Å²	68.2	31%	0.311	34%	0.344	S	S	.	.	H	α-helix	trans	-61.9	-37.3	173.2	-71.7	0	0	0	0	112.8	F1008 K1078 R1079 L1080 R1086	F1008-C1082 VanDerWaalsContact CE1-SG 3.53Å; K1078-C1082 PolarHBondContact O-N 2.76Å; K1078-C1082 PolarHBondContact O-SG 3.28Å; R1079-C1082 PolarHBondContact O-N 3.28Å; L1080-C1082 PolarHBondContact O-N 3.02Å; C1082-R1086 VanDerWaalsContact O-CG 3.32Å; C1082-R1086 WeakPolarHBondContact O-CG 3.5Å; C1082-R1086 PolarHBondContact O-N 3.34Å
1083	Q	73.2	Confident	73	Confident	110 Å²	110	71.4 Å²	71.4	51%	0.514	36%	0.361	S	S	.	.	H	α-helix	trans	-68.1	-47.6	174	-73.3	-174.2	-15.7	0	0	111.2	R1079 L1080 C1081 K1085 R1086 L1087	R1079-Q1083 PolarHBondContact O-N 2.93Å; R1079-Q1083 VanDerWaalsContact O-N 3.08Å; L1080-Q1083 PolarHBondContact O-N 3.36Å; L1080-Q1083 VanDerWaalsContact O-N 3.13Å; C1081-Q1083 VanDerWaalsContact C-N 3.32Å; C1081-Q1083 PolarHBondContact O-N 2.96Å; Q1083-K1085 PolarHBondContact O-N 3.15Å; Q1083-R1086 PolarHBondContact O-N 3.34Å; Q1083-L1087 WeakPolarHBondContact O-CG 3.48Å; Q1083-L1087 PolarHBondContact O-N 2.87Å
1084	W	79.2	Confident	72.6	Confident	4 Å²	4	67.6 Å²	67.6	2%	0.015	34%	0.341	C	S	.	.	H	α-helix	trans	-61.8	-39.6	178.2	-67.1	-25.4	0	0	0	113.2	F991 I993 I1013 L1070 W1077 L1080 C1081 L1087 L1088 L1094 L1141	F991-W1084 AromaticContact CZ-CH2 3.96Å; F991-W1084 HydrophobicContact CZ-CH2 3.96Å; F991-W1084 HydrophobicContact CZ-CZ2 4.31Å; I993-W1084 HydrophobicContact CD1-CB 4.22Å; I993-W1084 HydrophobicContact CD1-CD2 3.23Å; I993-W1084 HydrophobicContact CD1-CE3 3.35Å; I993-W1084 HydrophobicContact CD1-CG 3.68Å; I993-W1084 HydrophobicContact CD1-CH2 3.89Å; I993-W1084 HydrophobicContact CD1-CZ2 3.82Å; I993-W1084 HydrophobicContact CD1-CZ3 3.68Å; I1013-W1084 HydrophobicContact CD1-CZ3 4.2Å; L1070-W1084 HydrophobicContact CD1-CH2 4.45Å; W1077-W1084 AromaticContact CH2-CZ3 3.83Å; W1077-W1084 HydrophobicContact CH2-CZ3 3.83Å; W1077-W1084 HydrophobicContact CZ3-CH2 4.03Å; W1077-W1084 AromaticContact CZ3-CZ3 3.61Å; W1077-W1084 HydrophobicContact CZ3-CZ3 3.61Å; L1080-W1084 HydrophobicContact CD1-CD2 4.33Å; L1080-W1084 HydrophobicContact CD1-CZ2 3.88Å; L1080-W1084 HydrophobicContact CD2-CE3 4.49Å; L1080-W1084 HydrophobicContact CD2-CH2 3.42Å; L1080-W1084 VanDerWaalsContact CD2-CH2 3.42Å; L1080-W1084 HydrophobicContact CD2-CZ2 3.49Å; L1080-W1084 VanDerWaalsContact CD2-CZ2 3.49Å; L1080-W1084 HydrophobicContact CD2-CZ3 3.95Å; L1080-W1084 HydrophobicContact CG-CD2 3.88Å; L1080-W1084 HydrophobicContact CG-CE3 4.02Å; L1080-W1084 HydrophobicContact CG-CH2 3.78Å; L1080-W1084 HydrophobicContact CG-CZ2 3.57Å; L1080-W1084 HydrophobicContact CG-CZ3 3.98Å; L1080-W1084 PolarHBondContact O-N 3.34Å; C1081-W1084 PolarHBondContact O-N 3.41Å; W1084-L1087 PolarHBondContact O-N 3.49Å; W1084-L1088 WeakPolarHBondContact O-CB 3.42Å; W1084-L1088 WeakPolarHBondContact O-CG 3.44Å; W1084-L1088 PolarHBondContact O-N 3.41Å; W1084-L1094 HydrophobicContact CB-CD1 3.99Å; W1084-L1094 HydrophobicContact CG-CD1 3.99Å; W1084-L1141 HydrophobicContact CZ2-CD1 4.01Å
1085	K	75.9	Confident	72.3	Confident	45 Å²	45	66.1 Å²	66.1	20%	0.196	33%	0.331	C	S	.	.	H	α-helix	trans	-56.7	-52	171.8	-177.3	174.5	179.1	176	0	111.3	D1007 L1011 C1081 Q1083 L1087 L1088 D1089	D1007-K1085 PolarHBondContact O-NZ 2.91Å; D1007-K1085 IonicContact OD1-NZ 2.72Å; D1007-K1085 PolarHBondContact OD1-NZ 2.84Å; L1011-K1085 HydrophobicContact CD1-CB 4.29Å; L1011-K1085 HydrophobicContact CD2-CB 4.32Å; C1081-K1085 WeakPolarHBondContact O-CB 3.32Å; C1081-K1085 PolarHBondContact O-N 3.06Å; Q1083-K1085 PolarHBondContact O-N 3.15Å; K1085-L1087 VanDerWaalsContact C-N 3.26Å; K1085-L1087 PolarHBondContact O-N 2.86Å; K1085-L1088 PolarHBondContact O-N 3.27Å; K1085-L1088 VanDerWaalsContact O-N 3.16Å; K1085-D1089 WeakPolarHBondContact CG-OD2 3.47Å; K1085-D1089 WeakPolarHBondContact O-CB 3.42Å; K1085-D1089 VanDerWaalsContact O-CG 3.26Å; K1085-D1089 PolarHBondContact O-N 3Å
1086	R	72.5	Confident	72.1	Confident	180 Å²	180	61.3 Å²	61.3	68%	0.679	31%	0.305	S	S	*	.	H	α-helix	trans	-58.6	-36	177.5	-72.6	173.4	179.7	-166.7	-1.4	113.1	C1082 Q1083 Q1090	C1082-R1086 VanDerWaalsContact O-CG 3.32Å; C1082-R1086 WeakPolarHBondContact O-CG 3.5Å; C1082-R1086 PolarHBondContact O-N 3.34Å; Q1083-R1086 PolarHBondContact O-N 3.34Å; R1086-Q1090 VanDerWaalsContact O-CG 3.24Å; R1086-Q1090 WeakPolarHBondContact O-CG 3.5Å; R1086-Q1090 PolarHBondContact O-N 3.12Å
1087	L	70.4	Confident	71.4	Confident	17 Å²	17	61 Å²	61	9%	0.089	30%	0.304	C	S	.	.	H	α-helix	trans	-71	-45	175.6	-65.9	-179.7	0	0	0	111.7	Q1083 W1084 K1085 D1089 Q1090 G1091 V1092 L1094 L1134 I1137	Q1083-L1087 WeakPolarHBondContact O-CG 3.48Å; Q1083-L1087 PolarHBondContact O-N 2.87Å; W1084-L1087 PolarHBondContact O-N 3.49Å; K1085-L1087 VanDerWaalsContact C-N 3.26Å; K1085-L1087 PolarHBondContact O-N 2.86Å; L1087-D1089 VanDerWaalsContact C-N 3.31Å; L1087-D1089 PolarHBondContact O-N 3.42Å; L1087-Q1090 CarbonylContact O-C 3.57Å; L1087-Q1090 WeakPolarHBondContact O-CA 3.41Å; L1087-Q1090 WeakPolarHBondContact O-CB 3.48Å; L1087-Q1090 PolarHBondContact O-N 3.07Å; L1087-G1091 PolarHBondContact O-N 3.39Å; L1087-V1092 HydrophobicContact CB-CB 4.03Å; L1087-V1092 HydrophobicContact CB-CG1 4.4Å; L1087-V1092 HydrophobicContact CB-CG2 4.21Å; L1087-V1092 HydrophobicContact CD2-CG2 4.43Å; L1087-V1092 WeakPolarHBondContact O-CB 3.45Å; L1087-V1092 WeakPolarHBondContact O-CG2 3.33Å; L1087-V1092 PolarHBondContact O-N 3.33Å; L1087-L1094 HydrophobicContact CB-CD1 4.15Å; L1087-L1094 HydrophobicContact CD1-CD1 4.28Å; L1087-L1094 HydrophobicContact CD1-CD2 4.19Å; L1087-L1134 HydrophobicContact CD1-CD2 4.02Å; L1087-L1134 HydrophobicContact CD2-CD2 3.36Å; L1087-L1134 HydrophobicContact CG-CD2 4.3Å; L1087-I1137 HydrophobicContact CD1-CD1 3.93Å
1088	L	73.6	Confident	70	Confident	30 Å²	30	62.2 Å²	62.2	16%	0.157	31%	0.31	C	S	.	.	H	α-helix	trans	-63.5	-37.2	176.4	-73.8	162.2	0	0	0	112.1	I993 L1011 W1084 K1085 Q1090 G1091 V1092 L1094	I993-L1088 HydrophobicContact CB-CD1 4.32Å; I993-L1088 HydrophobicContact CG2-CD1 3.64Å; L1011-L1088 HydrophobicContact CD2-CD1 3.56Å; W1084-L1088 WeakPolarHBondContact O-CB 3.42Å; W1084-L1088 WeakPolarHBondContact O-CG 3.44Å; W1084-L1088 PolarHBondContact O-N 3.41Å; K1085-L1088 PolarHBondContact O-N 3.27Å; K1085-L1088 VanDerWaalsContact O-N 3.16Å; L1088-Q1090 PolarHBondContact O-N 2.75Å; L1088-G1091 WeakPolarHBondContact O-CA 3.3Å; L1088-G1091 PolarHBondContact O-N 3.12Å; L1088-V1092 WeakPolarHBondContact CD2-O 3.44Å; L1088-L1094 HydrophobicContact CG-CD1 4.4Å
1089	D	71.4	Confident	68.5	Low	79 Å²	79	62.9 Å²	62.9	42%	0.422	31%	0.311	S	S	.	.	H	α-helix	trans	-68.2	-21.6	173.7	-67.9	-26.9	0	0	0	112.6	R995 K1085 L1087 G1091	R995-D1089 IonicContact CZ-OD1 3.9Å; R995-D1089 IonicContact NH1-OD1 2.6Å; R995-D1089 PolarHBondContact NH1-OD1 2.99Å; K1085-D1089 WeakPolarHBondContact CG-OD2 3.47Å; K1085-D1089 WeakPolarHBondContact O-CB 3.42Å; K1085-D1089 VanDerWaalsContact O-CG 3.26Å; K1085-D1089 PolarHBondContact O-N 3Å; L1087-D1089 VanDerWaalsContact C-N 3.31Å; L1087-D1089 PolarHBondContact O-N 3.42Å; D1089-G1091 VanDerWaalsContact C-N 3.27Å
1090	Q	68.2	Low	66.7	Low	93 Å²	93	61.9 Å²	61.9	44%	0.435	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	6.6	167.8	-70.9	168	-0.3	0	0	113.1	R1086 L1087 L1088 V1092	R1086-Q1090 VanDerWaalsContact O-CG 3.24Å; R1086-Q1090 WeakPolarHBondContact O-CG 3.5Å; R1086-Q1090 PolarHBondContact O-N 3.12Å; L1087-Q1090 CarbonylContact O-C 3.57Å; L1087-Q1090 WeakPolarHBondContact O-CA 3.41Å; L1087-Q1090 WeakPolarHBondContact O-CB 3.48Å; L1087-Q1090 PolarHBondContact O-N 3.07Å; L1088-Q1090 PolarHBondContact O-N 2.75Å; Q1090-V1092 VanDerWaalsContact C-N 3.34Å; Q1090-V1092 HydrophobicContact CB-CG2 4.17Å
1091	G	65.7	Low	64.5	Low	69 Å²	69	65.6 Å²	65.6	71%	0.711	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.8	17	-178.6	0	0	0	0	0	114.5	L1087 L1088 D1089 D1093	L1087-G1091 PolarHBondContact O-N 3.39Å; L1088-G1091 WeakPolarHBondContact O-CA 3.3Å; L1088-G1091 PolarHBondContact O-N 3.12Å; D1089-G1091 VanDerWaalsContact C-N 3.27Å; G1091-D1093 PolarHBondContact O-N 3.42Å
1092	V	65.6	Low	62.1	Low	19 Å²	19	70.9 Å²	70.9	12%	0.115	37%	0.371	C	S	.	.			trans	-78.3	116.1	-178.8	178.9	0	0	0	0	110.7	L1087 L1088 Q1090 L1094 L1134	L1087-V1092 HydrophobicContact CB-CB 4.03Å; L1087-V1092 HydrophobicContact CB-CG1 4.4Å; L1087-V1092 HydrophobicContact CB-CG2 4.21Å; L1087-V1092 HydrophobicContact CD2-CG2 4.43Å; L1087-V1092 WeakPolarHBondContact O-CB 3.45Å; L1087-V1092 WeakPolarHBondContact O-CG2 3.33Å; L1087-V1092 PolarHBondContact O-N 3.33Å; L1088-V1092 WeakPolarHBondContact CD2-O 3.44Å; Q1090-V1092 VanDerWaalsContact C-N 3.34Å; Q1090-V1092 HydrophobicContact CB-CG2 4.17Å; V1092-L1094 HydrophobicContact CG1-CD2 3.83Å; V1092-L1094 HydrophobicContact CG1-CG 4.13Å; V1092-L1094 PolarHBondContact O-N 2.89Å; V1092-L1134 HydrophobicContact CB-CD1 4.13Å; V1092-L1134 HydrophobicContact CG1-CD1 3.67Å; V1092-L1134 HydrophobicContact CG2-CD1 3.3Å
1093	D	69.9	Low	60	Low	96 Å²	96	75.6 Å²	75.6	51%	0.513	39%	0.393	S	S	.	.			trans	-68.7	116.2	165.5	177.3	20.9	0	0	0	110.8	G1091 S1095 K1138	G1091-D1093 PolarHBondContact O-N 3.42Å; D1093-S1095 VanDerWaalsContact CG-OG 3.26Å; D1093-S1095 WeakPolarHBondContact OD1-CB 3.39Å; D1093-S1095 PolarHBondContact OD1-N 2.87Å; D1093-S1095 PolarHBondContact OD1-OG 3.04Å; D1093-S1095 PolarHBondContact OD2-OG 3.09Å; D1093-K1138 WeakPolarHBondContact O-CE 3.32Å; D1093-K1138 PolarHBondContact O-NZ 3.13Å
1094	L	67.6	Low	57.7	Low	5 Å²	5	75.8 Å²	75.8	3%	0.026	40%	0.397	C	S	.	.			trans	-100.5	19.3	175.3	-67.6	177.3	0	0	0	113	I993 W1084 L1087 L1088 V1092 F1096	I993-L1094 HydrophobicContact CB-CB 4.4Å; I993-L1094 HydrophobicContact CD1-CD1 4.3Å; W1084-L1094 HydrophobicContact CB-CD1 3.99Å; W1084-L1094 HydrophobicContact CG-CD1 3.99Å; L1087-L1094 HydrophobicContact CB-CD1 4.15Å; L1087-L1094 HydrophobicContact CD1-CD1 4.28Å; L1087-L1094 HydrophobicContact CD1-CD2 4.19Å; L1088-L1094 HydrophobicContact CG-CD1 4.4Å; V1092-L1094 HydrophobicContact CG1-CD2 3.83Å; V1092-L1094 HydrophobicContact CG1-CG 4.13Å; V1092-L1094 PolarHBondContact O-N 2.89Å; L1094-F1096 VanDerWaalsContact O-CD2 3.27Å; L1094-F1096 WeakPolarHBondContact O-CD2 3.29Å; L1094-F1096 WeakPolarHBondContact O-CE2 3.32Å
1095	S	67.9	Low	55.3	Low	33 Å²	33	81.4 Å²	81.4	23%	0.231	44%	0.437	C	S	.	.			trans	-74.9	151	174.2	78.9	0	0	0	0	113.5	F991 D1093 K1138	F991-S1095 CarbonylContact O-C 3.57Å; F991-S1095 WeakPolarHBondContact O-CA 3.44Å; D1093-S1095 VanDerWaalsContact CG-OG 3.26Å; D1093-S1095 WeakPolarHBondContact OD1-CB 3.39Å; D1093-S1095 PolarHBondContact OD1-N 2.87Å; D1093-S1095 PolarHBondContact OD1-OG 3.04Å; D1093-S1095 PolarHBondContact OD2-OG 3.09Å; S1095-K1138 PolarHBondContact O-NZ 2.93Å
1096	F	64.7	Low	53	Low	26 Å²	26	85.3 Å²	85.3	11%	0.114	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	118	172.8	-55	-99.9	0	0	0	109.1	E990 F991 L1094 F1098 K1138 L1141	E990-F1096 WeakPolarHBondContact CA-O 3.16Å; F991-F1096 HydrophobicContact CB-CD2 4.36Å; F991-F1096 AromaticContact CD1-CD2 3.91Å; F991-F1096 HydrophobicContact CD1-CD2 3.91Å; F991-F1096 HydrophobicContact CD1-CE2 4.2Å; F991-F1096 PolarHBondContact N-O 2.89Å; F991-F1096 PolarHBondContact O-N 2.89Å; L1094-F1096 VanDerWaalsContact O-CD2 3.27Å; L1094-F1096 WeakPolarHBondContact O-CD2 3.29Å; L1094-F1096 WeakPolarHBondContact O-CE2 3.32Å; F1096-F1098 HydrophobicContact CB-CD2 4.38Å; F1096-F1098 HydrophobicContact CB-CE2 3.98Å; F1096-K1138 HydrophobicContact CE1-CB 3.73Å; F1096-K1138 HydrophobicContact CE1-CD 3.9Å; F1096-K1138 HydrophobicContact CE1-CG 3.95Å; F1096-K1138 VanDerWaalsContact CE1-O 3.32Å; F1096-K1138 WeakPolarHBondContact CE1-O 3.38Å; F1096-K1138 HydrophobicContact CZ-CB 3.79Å; F1096-K1138 HydrophobicContact CZ-CD 3.9Å; F1096-K1138 HydrophobicContact CZ-CG 3.67Å; F1096-L1141 HydrophobicContact CD2-CD2 4.31Å; F1096-L1141 HydrophobicContact CE2-CD2 3.58Å; F1096-L1141 HydrophobicContact CZ-CB 4.42Å; F1096-L1141 HydrophobicContact CZ-CD2 4.02Å
1097	N	56.9	Low	50.7	Low	80 Å²	80	83 Å²	83	43%	0.428	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	119.4	156.1	-89.5	-57.7	0	0	0	108.1	E990 Y1099	E990-N1097 WeakPolarHBondContact CG-OD1 3.5Å; N1097-Y1099 PolarHBondContact O-N 3.34Å; N1097-Y1099 VanDerWaalsContact O-N 3.16Å
1098	F	50.1	Low	48.5	Very low	41 Å²	41	87.1 Å²	87.1	18%	0.18	50%	0.502	C	S	.	.	S	Bend	trans	-75.7	3.1	177	-69.3	-98.7	0	0	0	112.6	L989 F1096 K1142 L1145 N1146	L989-F1098 WeakPolarHBondContact O-CD2 3.33Å; L989-F1098 PolarHBondContact O-N 3.06Å; L989-F1098 VanDerWaalsContact O-N 3.1Å; F1096-F1098 HydrophobicContact CB-CD2 4.38Å; F1096-F1098 HydrophobicContact CB-CE2 3.98Å; F1098-K1142 HydrophobicContact CD1-CG 4.47Å; F1098-K1142 HydrophobicContact CE1-CD 4.49Å; F1098-K1142 HydrophobicContact CE1-CG 3.57Å; F1098-K1142 HydrophobicContact CZ-CG 4.15Å; F1098-L1145 HydrophobicContact CE2-CD1 4.3Å; F1098-L1145 HydrophobicContact CZ-CB 4.23Å; F1098-L1145 HydrophobicContact CZ-CD1 4.09Å; F1098-N1146 WeakPolarHBondContact CE1-ND2 3.5Å
1099	Y	45.7	Very low	46.1	Very low	112 Å²	112	94.4 Å²	94.4	44%	0.439	54%	0.535	S	S	.	.			trans	-131.1	69.7	178.4	-69.3	-98.5	0	0	0	109.6	L989 N1097 V1101	L989-Y1099 HydrophobicContact CD2-CE2 3.67Å; N1097-Y1099 PolarHBondContact O-N 3.34Å; N1097-Y1099 VanDerWaalsContact O-N 3.16Å; Y1099-V1101 PolarHBondContact O-N 3.3Å
1100	E	33	Very low	43.7	Very low	174 Å²	174	96 Å²	96	81%	0.813	55%	0.551	S	S	*	*			trans	-64	118.5	156.7	-78.4	-175.3	143.7	0	0	108	T1102	E1100-T1102 PolarHBondContact O-N 2.89Å
1101	V	31.5	Very low	41.4	Very low	117 Å²	117	99.4 Å²	99.4	71%	0.709	57%	0.572	S	S	*	*			trans	-71.5	98.1	167	178.6	0	0	0	0	106	Y1099 N1103	Y1099-V1101 PolarHBondContact O-N 3.3Å; V1101-N1103 VanDerWaalsContact C-N 3.31Å; V1101-N1103 PolarHBondContact O-N 2.81Å
1102	T	28.9	Very low	39.4	Very low	113 Å²	113	102 Å²	102	69%	0.693	57%	0.574	S	S	*	*			trans	-60.2	102	160.1	48.6	0	0	0	0	106.4	E1100 D1104	E1100-T1102 PolarHBondContact O-N 2.89Å; T1102-D1104 PolarHBondContact O-N 3.09Å
1103	N	27.3	Very low	37.4	Very low	144 Å²	144	107.8 Å²	107.8	77%	0.77	60%	0.604	S	S	*	*			trans	-60.5	101.6	173.6	-80.8	-19.1	0	0	0	107.6	V1101 S1105	V1101-N1103 VanDerWaalsContact C-N 3.31Å; V1101-N1103 PolarHBondContact O-N 2.81Å; N1103-S1105 PolarHBondContact O-N 2.88Å
1104	D	26.2	Very low	35	Very low	114 Å²	114	107.8 Å²	107.8	61%	0.61	61%	0.612	S	S	*	*			trans	-58.7	110.8	174.9	-82.4	-36.9	0	0	0	108.4	T1102 T1106	T1102-D1104 PolarHBondContact O-N 3.09Å; D1104-T1106 PolarHBondContact O-N 3.16Å
1105	S	27.7	Very low	32.9	Very low	122 Å²	122	117 Å²	117	85%	0.853	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.4	52.8	-175.6	45.1	0	0	0	0	112	N1103	N1103-S1105 PolarHBondContact O-N 2.88Å
1106	T	27.6	Very low	30.7	Very low	127 Å²	127	120.8 Å²	120.8	78%	0.779	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.2	14.7	178.1	58.9	0	0	0	0	113.9	D1104	D1104-T1106 PolarHBondContact O-N 3.16Å
1107	T	25.4	Very low	28.7	Very low	131 Å²	131	123.5 Å²	123.5	80%	0.804	70%	0.7	S	S	*	*			trans	-96.7	96.3	155	48.8	0	0	0	0	108.8
1108	S	23.4	Very low	27	Very low	105 Å²	105	124.4 Å²	124.4	73%	0.734	71%	0.713	S	S	*	*			trans	-58.2	162.3	162.7	49.9	0	0	0	0	110.9
1109	E	23.7	Very low	25.8	Very low	183 Å²	183	128.3 Å²	128.3	86%	0.855	75%	0.746	S	S	*	*			trans	80.6	61.1	177.9	-50.5	-172	171.1	0	0	116.4
1110	C	20.9	Very low	24.8	Very low	113 Å²	113	127.4 Å²	127.4	76%	0.764	76%	0.761	S	S	*	*			trans	-136.3	71.5	144.8	-124.6	0	0	0	0	110.5	T1112	C1110-T1112 PolarHBondContact O-N 2.89Å
1111	N	20.8	Very low	24.3	Very low	164 Å²	164	124.2 Å²	124.2	88%	0.877	76%	0.758	S	S	*	*			trans	-71.4	77.5	170	-83	-21	0	0	0	110.2
1112	T	23.4	Very low	23.9	Very low	123 Å²	123	128.2 Å²	128.2	76%	0.755	77%	0.766	S	S	*	*			trans	-108.4	77.4	165.6	51.8	0	0	0	0	110.5	C1110	C1110-T1112 PolarHBondContact O-N 2.89Å
1113	L	21.9	Very low	23.7	Very low	141 Å²	141	128.3 Å²	128.3	74%	0.738	77%	0.771	S	S	*	*			trans	0.3	115.1	149.2	-70.9	154.2	0	0	0	116.4	F1115	L1113-F1115 PolarHBondContact O-N 3.29Å
1114	S	21.1	Very low	23.6	Very low	96 Å²	96	125.6 Å²	125.6	67%	0.671	76%	0.764	S	S	*	*			trans	32.6	80.6	134.1	60.9	0	0	0	0	117.9	S1116	S1114-S1116 VanDerWaalsContact C-N 3.26Å; S1114-S1116 PolarHBondContact O-N 3.11Å
1115	F	22.9	Very low	23.6	Very low	197 Å²	197	129 Å²	129	86%	0.864	78%	0.776	S	S	*	*			trans	-86.3	69.4	156.5	-91.9	-84.8	0	0	0	111.3	L1113 S1117	L1113-F1115 PolarHBondContact O-N 3.29Å; F1115-S1117 PolarHBondContact O-N 3.28Å
1116	S	22	Very low	23.6	Very low	114 Å²	114	130 Å²	130	80%	0.797	78%	0.777	S	S	*	*			trans	-78	88.9	156	53.5	0	0	0	0	108.7	S1114	S1114-S1116 VanDerWaalsContact C-N 3.26Å; S1114-S1116 PolarHBondContact O-N 3.11Å
1117	S	22.5	Very low	23.4	Very low	82 Å²	82	129.4 Å²	129.4	57%	0.573	77%	0.773	S	S	*	*			trans	-129.7	86	175.1	59.6	0	0	0	0	111.6	F1115	F1115-S1117 PolarHBondContact O-N 3.28Å
1118	S	21.9	Very low	23.5	Very low	100 Å²	100	127.8 Å²	127.8	70%	0.699	77%	0.767	S	S	*	*			trans	38.5	97.9	142.5	58.4	0	0	0	0	118.5	A1120	S1118-A1120 PolarHBondContact O-N 3.08Å; S1118-A1120 VanDerWaalsContact O-N 3.12Å
1119	S	24.3	Very low	23.9	Very low	123 Å²	123	129.9 Å²	129.9	86%	0.86	77%	0.77	S	S	*	*				21.9	82.2	123.1	59.6	0	0	0	0	117.1
1120	A	24.8	Very low	24.4	Very low	92 Å²	92	125 Å²	125	76%	0.76	75%	0.75	S	S	*	*			trans	-94.8	113	154.2	0	0	0	0	0	107.8	S1118 F1122	S1118-A1120 PolarHBondContact O-N 3.08Å; S1118-A1120 VanDerWaalsContact O-N 3.12Å; A1120-F1122 PolarHBondContact O-N 2.96Å
1121	S	22.5	Very low	25.1	Very low	108 Å²	108	129.5 Å²	129.5	76%	0.755	76%	0.756	S	S	*	*			trans	-69.2	99.2	-173.6	50.5	0	0	0	0	112.5	S1123	S1121-S1123 VanDerWaalsContact C-N 3.25Å; S1121-S1123 PolarHBondContact O-N 3.06Å
1122	F	22.6	Very low	26.3	Very low	201 Å²	201	127.1 Å²	127.1	88%	0.882	74%	0.736	S	S	*	*			trans	-80.6	81.1	152.1	-97.4	-84.5	0	0	0	109	A1120 S1124	A1120-F1122 PolarHBondContact O-N 2.96Å; F1122-S1124 PolarHBondContact O-N 2.84Å; F1122-S1124 VanDerWaalsContact O-N 3.16Å
1123	S	24.2	Very low	27.3	Very low	114 Å²	114	126.9 Å²	126.9	80%	0.797	73%	0.73	S	S	*	*			trans	-78.5	84.7	168.1	55	0	0	0	0	109.9	S1121	S1121-S1123 VanDerWaalsContact C-N 3.25Å; S1121-S1123 PolarHBondContact O-N 3.06Å
1124	S	26	Very low	28.6	Very low	87 Å²	87	121.9 Å²	121.9	61%	0.608	70%	0.704	S	S	*	*			trans	-144.2	119.8	156.2	61.1	0	0	0	0	108.2	F1122 V1126	F1122-S1124 PolarHBondContact O-N 2.84Å; F1122-S1124 VanDerWaalsContact O-N 3.16Å; S1124-V1126 PolarHBondContact O-N 2.87Å
1125	E	25.1	Very low	30.1	Very low	187 Å²	187	123.1 Å²	123.1	87%	0.874	70%	0.701	S	S	*	*			trans	-59.4	104	-171.4	-65.3	153.4	125	0	0	112.2
1126	V	27.9	Very low	31.6	Very low	143 Å²	143	118 Å²	118	87%	0.867	69%	0.688	S	S	*	*			trans	-127.2	47.8	157	-164.1	0	0	0	0	108.8	S1124	S1124-V1126 PolarHBondContact O-N 2.87Å
1127	T	24.1	Very low	33.3	Very low	114 Å²	114	115.5 Å²	115.5	70%	0.699	67%	0.665	S	S	*	*			trans	-82.8	138.7	164.7	34	0	0	0	0	110.1
1128	S	28.2	Very low	35.2	Very low	96 Å²	96	114.5 Å²	114.5	67%	0.671	65%	0.651	S	S	*	*	S	Bend	trans	54.2	92.3	164.1	58.9	0	0	0	0	117.7
1129	N	31.3	Very low	37.1	Very low	150 Å²	150	114.8 Å²	114.8	80%	0.802	64%	0.644	S	S	*	*				163.6	156.1	104.2	-78.2	-24.6	0	0	0	110.6
1130	N	34.9	Very low	39.1	Very low	81 Å²	81	111.9 Å²	111.9	43%	0.433	63%	0.627	S	S	.	*			trans	72.1	63.7	-175.3	-52.4	-23.4	0	0	0	115.9	Y1132	N1130-Y1132 HydrophobicContact CB-CD2 4.29Å; N1130-Y1132 HydrophobicContact CB-CE1 4.38Å; N1130-Y1132 HydrophobicContact CB-CE2 3.89Å; N1130-Y1132 WeakPolarHBondContact O-CD2 3.44Å; N1130-Y1132 PolarHBondContact O-N 3.12Å
1131	K	34.9	Very low	41.2	Very low	206 Å²	206	108.5 Å²	108.5	90%	0.896	60%	0.596	S	S	*	*			trans	-63.7	93.6	145.9	-89.7	-175.3	174.7	178.2	0	107.7	N1133	K1131-N1133 PolarHBondContact O-N 2.85Å
1132	Y	44.9	Very low	43.5	Very low	114 Å²	114	108.5 Å²	108.5	45%	0.447	58%	0.582	S	S	.	*			trans	-58.5	119.2	179.4	-68.4	-86.3	0	0	0	110.5	N1130 L1134	N1130-Y1132 HydrophobicContact CB-CD2 4.29Å; N1130-Y1132 HydrophobicContact CB-CE1 4.38Å; N1130-Y1132 HydrophobicContact CB-CE2 3.89Å; N1130-Y1132 WeakPolarHBondContact O-CD2 3.44Å; N1130-Y1132 PolarHBondContact O-N 3.12Å; Y1132-L1134 WeakPolarHBondContact O-CD1 3.45Å; Y1132-L1134 WeakPolarHBondContact O-CG 3.49Å; Y1132-L1134 PolarHBondContact O-N 3.28Å
1133	N	45.6	Very low	45.6	Very low	119 Å²	119	103.3 Å²	103.3	64%	0.636	57%	0.567	S	S	*	*			trans	-72.3	73.6	-179.8	-82.7	-25.6	0	0	0	111.3	K1131 I1135 P1136	K1131-N1133 PolarHBondContact O-N 2.85Å; N1133-I1135 VanDerWaalsContact C-N 3.28Å; N1133-I1135 PolarHBondContact O-N 3.32Å; N1133-P1136 WeakPolarHBondContact O-CD 3.41Å
1134	L	49.6	Very low	47.9	Very low	36 Å²	36	100.8 Å²	100.8	19%	0.188	54%	0.541	C	S	.	.			trans	-86.9	2.8	-170.5	-69.2	152.9	0	0	0	114.3	L1087 V1092 Y1132 P1136 I1137 K1138	L1087-L1134 HydrophobicContact CD1-CD2 4.02Å; L1087-L1134 HydrophobicContact CD2-CD2 3.36Å; L1087-L1134 HydrophobicContact CG-CD2 4.3Å; V1092-L1134 HydrophobicContact CB-CD1 4.13Å; V1092-L1134 HydrophobicContact CG1-CD1 3.67Å; V1092-L1134 HydrophobicContact CG2-CD1 3.3Å; Y1132-L1134 WeakPolarHBondContact O-CD1 3.45Å; Y1132-L1134 WeakPolarHBondContact O-CG 3.49Å; Y1132-L1134 PolarHBondContact O-N 3.28Å; L1134-P1136 VanDerWaalsContact C-N 3.32Å; L1134-I1137 HydrophobicContact CD2-CD1 4.49Å; L1134-I1137 PolarHBondContact O-N 3.38Å; L1134-K1138 PolarHBondContact O-N 2.83Å; L1134-K1138 VanDerWaalsContact O-N 3.15Å
1135	I	52	Low	50.2	Low	121 Å²	121	96.6 Å²	96.6	62%	0.621	51%	0.512	S	S	*	.	H	α-helix	trans	-50.4	-42.6	174.6	-57.6	172	0	0	0	112.1	N1133 I1137 K1138 L1139	N1133-I1135 VanDerWaalsContact C-N 3.28Å; N1133-I1135 PolarHBondContact O-N 3.32Å; I1135-I1137 PolarHBondContact O-N 3.3Å; I1135-K1138 PolarHBondContact O-N 3.46Å; I1135-L1139 VanDerWaalsContact O-CB 3.24Å; I1135-L1139 WeakPolarHBondContact O-CB 3.39Å; I1135-L1139 PolarHBondContact O-N 2.78Å
1136	P	53.8	Low	52.6	Low	90 Å²	90	91 Å²	91	58%	0.584	49%	0.488	S	S	*	.	H	α-helix	trans	-63.9	-43.2	-177.5	-23	35.2	0	0	0	113.6	N1133 L1134 L1139 A1140	N1133-P1136 WeakPolarHBondContact O-CD 3.41Å; L1134-P1136 VanDerWaalsContact C-N 3.32Å; P1136-L1139 PolarHBondContact O-N 3.35Å; P1136-A1140 VanDerWaalsContact O-CB 3.22Å; P1136-A1140 WeakPolarHBondContact O-CB 3.48Å; P1136-A1140 PolarHBondContact O-N 3.4Å
1137	I	58.6	Low	54.4	Low	62 Å²	62	85.4 Å²	85.4	32%	0.318	45%	0.454	S	S	.	.	H	α-helix	trans	-67.1	-43.1	177.7	-63.1	175.7	0	0	0	109.6	L1087 L1134 I1135 L1139 A1140 L1141	L1087-I1137 HydrophobicContact CD1-CD1 3.93Å; L1134-I1137 HydrophobicContact CD2-CD1 4.49Å; L1134-I1137 PolarHBondContact O-N 3.38Å; I1135-I1137 PolarHBondContact O-N 3.3Å; I1137-L1139 VanDerWaalsContact C-N 3.34Å; I1137-L1139 PolarHBondContact O-N 2.92Å; I1137-A1140 PolarHBondContact O-N 2.83Å; I1137-L1141 WeakPolarHBondContact O-CB 3.14Å; I1137-L1141 PolarHBondContact O-N 3.07Å
1138	K	61.6	Low	56.2	Low	61 Å²	61	85.2 Å²	85.2	27%	0.265	46%	0.456	S	S	.	.	H	α-helix	trans	-60.8	-43.4	176.3	-76.9	-146.3	175.5	-161.6	0	112.3	D1093 S1095 F1096 L1134 I1135 K1142	D1093-K1138 WeakPolarHBondContact O-CE 3.32Å; D1093-K1138 PolarHBondContact O-NZ 3.13Å; S1095-K1138 PolarHBondContact O-NZ 2.93Å; F1096-K1138 HydrophobicContact CE1-CB 3.73Å; F1096-K1138 HydrophobicContact CE1-CD 3.9Å; F1096-K1138 HydrophobicContact CE1-CG 3.95Å; F1096-K1138 VanDerWaalsContact CE1-O 3.32Å; F1096-K1138 WeakPolarHBondContact CE1-O 3.38Å; F1096-K1138 HydrophobicContact CZ-CB 3.79Å; F1096-K1138 HydrophobicContact CZ-CD 3.9Å; F1096-K1138 HydrophobicContact CZ-CG 3.67Å; L1134-K1138 PolarHBondContact O-N 2.83Å; L1134-K1138 VanDerWaalsContact O-N 3.15Å; I1135-K1138 PolarHBondContact O-N 3.46Å; K1138-K1142 VanDerWaalsContact O-CB 3.31Å; K1138-K1142 WeakPolarHBondContact O-CB 2.96Å; K1138-K1142 PolarHBondContact O-N 3.38Å
1139	L	63.3	Low	58.1	Low	106 Å²	106	84.6 Å²	84.6	56%	0.555	45%	0.447	S	S	*	.	H	α-helix	trans	-70.6	-42.2	-179.8	-159.7	114.2	0	0	0	111.8	I1135 P1136 I1137 L1141 K1142 T1143	I1135-L1139 VanDerWaalsContact O-CB 3.24Å; I1135-L1139 WeakPolarHBondContact O-CB 3.39Å; I1135-L1139 PolarHBondContact O-N 2.78Å; P1136-L1139 PolarHBondContact O-N 3.35Å; I1137-L1139 VanDerWaalsContact C-N 3.34Å; I1137-L1139 PolarHBondContact O-N 2.92Å; L1139-L1141 PolarHBondContact O-N 2.86Å; L1139-K1142 WeakPolarHBondContact O-CB 3.49Å; L1139-K1142 PolarHBondContact O-N 3.09Å; L1139-T1143 PolarHBondContact O-N 3.32Å; L1139-T1143 PolarHBondContact O-OG1 3.28Å; L1139-T1143 VanDerWaalsContact O-OG1 3.06Å
1140	A	64.4	Low	60.1	Low	61 Å²	61	77.4 Å²	77.4	50%	0.504	41%	0.409	S	S	.	.	H	α-helix	trans	-60.7	-44.4	176.3	0	0	0	0	0	111.9	P1136 I1137 T1143 Y1144	P1136-A1140 VanDerWaalsContact O-CB 3.22Å; P1136-A1140 WeakPolarHBondContact O-CB 3.48Å; P1136-A1140 PolarHBondContact O-N 3.4Å; I1137-A1140 PolarHBondContact O-N 2.83Å; A1140-T1143 PolarHBondContact O-N 3.21Å; A1140-Y1144 WeakPolarHBondContact O-CB 3.26Å; A1140-Y1144 PolarHBondContact O-N 3.06Å
1141	L	69	Low	62.1	Low	21 Å²	21	75.7 Å²	75.7	11%	0.11	40%	0.4	C	S	.	.	H	α-helix	trans	-65.5	-42.1	175.4	-166.4	74.4	0	0	0	111.7	F991 W1084 F1096 I1137 L1139 T1143 Y1144 L1145	F991-L1141 HydrophobicContact CD1-CD2 3.71Å; F991-L1141 HydrophobicContact CE1-CD2 3.42Å; F991-L1141 VanDerWaalsContact CE1-CD2 3.42Å; F991-L1141 HydrophobicContact CG-CD2 4.46Å; F991-L1141 HydrophobicContact CZ-CD2 3.98Å; W1084-L1141 HydrophobicContact CZ2-CD1 4.01Å; F1096-L1141 HydrophobicContact CD2-CD2 4.31Å; F1096-L1141 HydrophobicContact CE2-CD2 3.58Å; F1096-L1141 HydrophobicContact CZ-CB 4.42Å; F1096-L1141 HydrophobicContact CZ-CD2 4.02Å; I1137-L1141 WeakPolarHBondContact O-CB 3.14Å; I1137-L1141 PolarHBondContact O-N 3.07Å; L1139-L1141 PolarHBondContact O-N 2.86Å; L1141-T1143 VanDerWaalsContact C-N 3.31Å; L1141-T1143 PolarHBondContact O-N 2.9Å; L1141-Y1144 PolarHBondContact O-N 3.02Å; L1141-L1145 HydrophobicContact CD2-CD1 4.35Å; L1141-L1145 HydrophobicContact CG-CD1 4.05Å; L1141-L1145 HydrophobicContact CG-CG 4.4Å; L1141-L1145 WeakPolarHBondContact O-CG 3.2Å; L1141-L1145 PolarHBondContact O-N 3.35Å
1142	K	70.8	Confident	64.1	Low	109 Å²	109	68.6 Å²	68.6	47%	0.474	37%	0.367	S	S	.	.	H	α-helix	trans	-58.6	-42.3	175.3	-166.2	-176	-177.1	174.2	0	111.7	F1098 K1138 L1139 N1146	F1098-K1142 HydrophobicContact CD1-CG 4.47Å; F1098-K1142 HydrophobicContact CE1-CD 4.49Å; F1098-K1142 HydrophobicContact CE1-CG 3.57Å; F1098-K1142 HydrophobicContact CZ-CG 4.15Å; K1138-K1142 VanDerWaalsContact O-CB 3.31Å; K1138-K1142 WeakPolarHBondContact O-CB 2.96Å; K1138-K1142 PolarHBondContact O-N 3.38Å; L1139-K1142 WeakPolarHBondContact O-CB 3.49Å; L1139-K1142 PolarHBondContact O-N 3.09Å; K1142-N1146 PolarHBondContact O-ND2 2.91Å
1143	T	67.6	Low	65.7	Low	91 Å²	91	67.3 Å²	67.3	56%	0.558	37%	0.368	S	S	*	.	H	α-helix	trans	-66.5	-43.7	175.1	-60.2	0	0	0	0	111.2	L1139 A1140 L1141 N1146 S1147	L1139-T1143 PolarHBondContact O-N 3.32Å; L1139-T1143 PolarHBondContact O-OG1 3.28Å; L1139-T1143 VanDerWaalsContact O-OG1 3.06Å; A1140-T1143 PolarHBondContact O-N 3.21Å; L1141-T1143 VanDerWaalsContact C-N 3.31Å; L1141-T1143 PolarHBondContact O-N 2.9Å; T1143-N1146 CarbonylContact O-C 3.45Å; T1143-N1146 PolarHBondContact O-N 2.79Å; T1143-S1147 PolarHBondContact O-N 3.5Å; T1143-S1147 VanDerWaalsContact O-N 3.14Å
1144	Y	71.8	Confident	67.2	Low	61 Å²	61	61.8 Å²	61.8	24%	0.239	34%	0.339	C	S	.	.	H	α-helix	trans	-61.6	-45.8	179	-173.7	-98.1	0	0	0	113	L1070 A1140 L1141 N1146 S1147 T1149 F1150	L1070-Y1144 HydrophobicContact CD2-CE1 4.17Å; L1070-Y1144 PolarHBondContact O-OH 2.67Å; A1140-Y1144 WeakPolarHBondContact O-CB 3.26Å; A1140-Y1144 PolarHBondContact O-N 3.06Å; L1141-Y1144 PolarHBondContact O-N 3.02Å; Y1144-N1146 PolarHBondContact O-N 3.07Å; Y1144-N1146 VanDerWaalsContact O-N 3.15Å; Y1144-S1147 VanDerWaalsContact O-CB 3.29Å; Y1144-S1147 WeakPolarHBondContact O-CB 3.32Å; Y1144-S1147 PolarHBondContact O-N 3.23Å; Y1144-S1147 PolarHBondContact O-OG 3.39Å; Y1144-T1149 HydrophobicContact CE2-CG2 4.11Å; Y1144-F1150 HydrophobicContact CE1-CB 4.27Å; Y1144-F1150 WeakPolarHBondContact O-CB 3.15Å
1145	L	75.9	Confident	68.6	Low	0 Å²	0	65.4 Å²	65.4	0%	0	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-10.2	178.5	-68.5	171.7	0	0	0	114.1	C988 F991 L1070 F1098 L1141 F1150	C988-L1145 HydrophobicContact CB-CB 4.2Å; F991-L1145 HydrophobicContact CB-CD1 3.87Å; F991-L1145 HydrophobicContact CD2-CD1 3.94Å; F991-L1145 HydrophobicContact CD2-CD2 4.34Å; F991-L1145 HydrophobicContact CG-CD1 3.89Å; L1070-L1145 HydrophobicContact CD2-CD2 3.95Å; F1098-L1145 HydrophobicContact CE2-CD1 4.3Å; F1098-L1145 HydrophobicContact CZ-CB 4.23Å; F1098-L1145 HydrophobicContact CZ-CD1 4.09Å; L1141-L1145 HydrophobicContact CD2-CD1 4.35Å; L1141-L1145 HydrophobicContact CG-CD1 4.05Å; L1141-L1145 HydrophobicContact CG-CG 4.4Å; L1141-L1145 WeakPolarHBondContact O-CG 3.2Å; L1141-L1145 PolarHBondContact O-N 3.35Å; L1145-F1150 HydrophobicContact CD2-CD1 4.2Å; L1145-F1150 HydrophobicContact CD2-CD2 4.06Å; L1145-F1150 HydrophobicContact CD2-CE1 4.13Å; L1145-F1150 HydrophobicContact CD2-CE2 3.97Å; L1145-F1150 HydrophobicContact CD2-CG 4.18Å; L1145-F1150 HydrophobicContact CD2-CZ 4.02Å; L1145-F1150 WeakPolarHBondContact O-CD1 3.17Å
1146	N	73.6	Confident	70.1	Confident	70 Å²	70	59.7 Å²	59.7	37%	0.374	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109	3.9	171.1	-69.2	-78	0	0	0	112.8	F1098 K1142 T1143 Y1144	F1098-N1146 WeakPolarHBondContact CE1-ND2 3.5Å; K1142-N1146 PolarHBondContact O-ND2 2.91Å; T1143-N1146 CarbonylContact O-C 3.45Å; T1143-N1146 PolarHBondContact O-N 2.79Å; Y1144-N1146 PolarHBondContact O-N 3.07Å; Y1144-N1146 VanDerWaalsContact O-N 3.15Å
1147	S	66.6	Low	71.5	Confident	24 Å²	24	57.1 Å²	57.1	17%	0.168	30%	0.303	C	S	.	.	S	Bend	trans	-82.3	152.9	179.7	74.7	0	0	0	0	111.8	T1143 Y1144 T1149 F1150 L1151	T1143-S1147 PolarHBondContact O-N 3.5Å; T1143-S1147 VanDerWaalsContact O-N 3.14Å; Y1144-S1147 VanDerWaalsContact O-CB 3.29Å; Y1144-S1147 WeakPolarHBondContact O-CB 3.32Å; Y1144-S1147 PolarHBondContact O-N 3.23Å; Y1144-S1147 PolarHBondContact O-OG 3.39Å; S1147-T1149 PolarHBondContact O-N 3.33Å; S1147-T1149 VanDerWaalsContact O-N 3.1Å; S1147-T1149 PolarHBondContact OG-N 3Å; S1147-F1150 PolarHBondContact O-N 3.28Å; S1147-L1151 WeakPolarHBondContact O-CB 3.37Å; S1147-L1151 WeakPolarHBondContact O-CG 3.44Å; S1147-L1151 PolarHBondContact O-N 3.08Å
1148	P	62.1	Low	72.7	Confident	111 Å²	111	54.1 Å²	54.1	72%	0.721	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-24.8	171.8	-25.6	35.2	0	0	0	113.8	F1150 L1151	P1148-F1150 VanDerWaalsContact C-N 3.33Å; P1148-F1150 PolarHBondContact O-N 2.99Å; P1148-L1151 CarbonylContact O-C 3.48Å; P1148-L1151 PolarHBondContact O-N 3.02Å
1149	T	68.2	Low	73.5	Confident	82 Å²	82	53.3 Å²	53.3	50%	0.503	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-37	176.8	-45.6	0	0	0	0	112.1	Y1144 S1147 R1152	Y1144-T1149 HydrophobicContact CE2-CG2 4.11Å; S1147-T1149 PolarHBondContact O-N 3.33Å; S1147-T1149 VanDerWaalsContact O-N 3.1Å; S1147-T1149 PolarHBondContact OG-N 3Å; T1149-R1152 WeakPolarHBondContact O-CD 3.01Å; T1149-R1152 PolarHBondContact O-NH1 3.38Å
1150	F	73.6	Confident	73.9	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-39.4	172.6	-178.5	-101.8	0	0	0	111.7	I985 C988 L1069 L1070 Y1144 L1145 S1147 P1148 R1152	I985-F1150 HydrophobicContact CD1-CZ 4.39Å; I985-F1150 HydrophobicContact CG2-CD1 4.32Å; I985-F1150 HydrophobicContact CG2-CE1 3.82Å; I985-F1150 HydrophobicContact CG2-CZ 4.43Å; C988-F1150 HydrophobicContact CB-CE1 3.89Å; L1069-F1150 HydrophobicContact CD2-CE2 4.45Å; L1069-F1150 HydrophobicContact CG-CE2 4.15Å; L1070-F1150 HydrophobicContact CD2-CD2 3.96Å; L1070-F1150 HydrophobicContact CD2-CE2 3.91Å; Y1144-F1150 HydrophobicContact CE1-CB 4.27Å; Y1144-F1150 WeakPolarHBondContact O-CB 3.15Å; L1145-F1150 HydrophobicContact CD2-CD1 4.2Å; L1145-F1150 HydrophobicContact CD2-CD2 4.06Å; L1145-F1150 HydrophobicContact CD2-CE1 4.13Å; L1145-F1150 HydrophobicContact CD2-CE2 3.97Å; L1145-F1150 HydrophobicContact CD2-CG 4.18Å; L1145-F1150 HydrophobicContact CD2-CZ 4.02Å; L1145-F1150 WeakPolarHBondContact O-CD1 3.17Å; S1147-F1150 PolarHBondContact O-N 3.28Å; P1148-F1150 VanDerWaalsContact C-N 3.33Å; P1148-F1150 PolarHBondContact O-N 2.99Å; F1150-R1152 PolarHBondContact O-N 2.95Å
1151	L	76.7	Confident	73.8	Confident	45 Å²	45	53 Å²	53	24%	0.236	26%	0.263	C	S	.	.	S	Bend	trans	-81	55.9	-178.8	-57.3	-178.2	0	0	0	112.2	I985 S1147 P1148	I985-L1151 HydrophobicContact CG2-CD2 3.89Å; I985-L1151 CarbonylContact O-C 3.55Å; I985-L1151 VanDerWaalsContact O-CA 3.28Å; I985-L1151 WeakPolarHBondContact O-CA 3.38Å; I985-L1151 WeakPolarHBondContact O-CB 3.48Å; I985-L1151 WeakPolarHBondContact O-CD2 3.41Å; S1147-L1151 WeakPolarHBondContact O-CB 3.37Å; S1147-L1151 WeakPolarHBondContact O-CG 3.44Å; S1147-L1151 PolarHBondContact O-N 3.08Å; P1148-L1151 CarbonylContact O-C 3.48Å; P1148-L1151 PolarHBondContact O-N 3.02Å
1152	R	77.7	Confident	73	Confident	57 Å²	57	56.7 Å²	56.7	22%	0.215	29%	0.287	C	S	.	.			trans	-111	173	-174.3	67.1	177.4	-175	-102.4	-2.7	113.1	I985 L1068 L1069 T1149 F1150	I985-R1152 PolarHBondContact N-O 3.28Å; L1068-R1152 PolarHBondContact O-NH2 2.85Å; L1069-R1152 PolarHBondContact O-NH2 3.4Å; T1149-R1152 WeakPolarHBondContact O-CD 3.01Å; T1149-R1152 PolarHBondContact O-NH1 3.38Å; F1150-R1152 PolarHBondContact O-N 2.95Å
1153	N	76.7	Confident	71.8	Confident	87 Å²	87	58.1 Å²	58.1	47%	0.465	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	132.7	171.5	-74.6	-8.6	0	0	0	111	A983 T984	A983-N1153 WeakPolarHBondContact O-CA 3.19Å; T984-N1153 WeakPolarHBondContact CA-OD1 3.07Å; T984-N1153 VanDerWaalsContact CB-OD1 3.23Å; T984-N1153 WeakPolarHBondContact CB-OD1 3.09Å; T984-N1153 WeakPolarHBondContact CG2-OD1 3.3Å; T984-N1153 PolarHBondContact OG1-OD1 2.73Å
1154	C	78.1	Confident	70.1	Confident	3 Å²	3	58.2 Å²	58.2	2%	0.02	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	163.8	171.3	-60.3	0	0	0	0	110.3	A983 F1156 V1228	A983-C1154 PolarHBondContact N-O 3.06Å; A983-C1154 PolarHBondContact O-N 2.8Å; C1154-F1156 HydrophobicContact CB-CE1 3.93Å; C1154-F1156 HydrophobicContact CB-CE2 3.99Å; C1154-F1156 HydrophobicContact CB-CZ 3.62Å; C1154-V1228 HydrophobicContact CB-CG2 3.64Å
1155	R	79.6	Confident	68.2	Low	112 Å²	112	59.5 Å²	59.5	42%	0.423	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	127.6	161.9	-77.2	176.3	173.8	177.3	-3.8	108.2	Q982 V1228 T1229	Q982-R1155 HydrophobicContact CB-CG 4.06Å; Q982-R1155 HydrophobicContact CG-CG 4.12Å; R1155-V1228 WeakPolarHBondContact O-CA 3.43Å; R1155-T1229 PolarHBondContact N-O 2.84Å; R1155-T1229 PolarHBondContact O-N 3.12Å
1156	F	82.5	Confident	66	Low	1 Å²	1	62.5 Å²	62.5	0%	0.004	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	131.9	-179.1	-55.4	-80.5	0	0	0	110.2	N980 V981 A983 I985 F1017 I1019 L1069 C1154 L1158 L1225 N1227 V1228	N980-F1156 CarbonylContact C-O 3.49Å; N980-F1156 WeakPolarHBondContact CA-O 3.23Å; V981-F1156 PolarHBondContact N-O 2.89Å; V981-F1156 PolarHBondContact O-N 2.78Å; A983-F1156 HydrophobicContact CB-CD2 4.16Å; A983-F1156 HydrophobicContact CB-CE2 3.99Å; A983-F1156 WeakPolarHBondContact O-CE2 3.48Å; I985-F1156 HydrophobicContact CD1-CE1 4.34Å; I985-F1156 HydrophobicContact CD1-CZ 4.07Å; I985-F1156 HydrophobicContact CG1-CE1 4.31Å; I985-F1156 HydrophobicContact CG1-CZ 3.61Å; F1017-F1156 HydrophobicContact CE2-CD1 4.44Å; F1017-F1156 AromaticContact CE2-CE1 3.78Å; F1017-F1156 HydrophobicContact CE2-CE1 3.78Å; F1017-F1156 HydrophobicContact CE2-CZ 4.17Å; F1017-F1156 HydrophobicContact CZ-CE1 4.12Å; I1019-F1156 HydrophobicContact CB-CE2 4.28Å; I1019-F1156 HydrophobicContact CD1-CD2 3.99Å; I1019-F1156 HydrophobicContact CD1-CE2 4.4Å; I1019-F1156 HydrophobicContact CG2-CD2 4.23Å; I1019-F1156 HydrophobicContact CG2-CE1 4.35Å; I1019-F1156 HydrophobicContact CG2-CE2 3.66Å; I1019-F1156 HydrophobicContact CG2-CZ 3.73Å; L1069-F1156 HydrophobicContact CD1-CE1 4.04Å; C1154-F1156 HydrophobicContact CB-CE1 3.93Å; C1154-F1156 HydrophobicContact CB-CE2 3.99Å; C1154-F1156 HydrophobicContact CB-CZ 3.62Å; F1156-L1158 HydrophobicContact CB-CD1 4.3Å; F1156-L1158 HydrophobicContact CB-CD2 3.86Å; F1156-L1158 HydrophobicContact CB-CG 3.87Å; F1156-L1225 HydrophobicContact CB-CD1 4.34Å; F1156-L1225 HydrophobicContact CD1-CD1 3.79Å; F1156-N1227 WeakPolarHBondContact CA-O 3.41Å; F1156-V1228 HydrophobicContact CD1-CB 4.31Å; F1156-V1228 HydrophobicContact CD1-CG2 3.86Å; F1156-V1228 HydrophobicContact CE1-CG2 3.79Å
1157	T	82.2	Confident	63.6	Low	35 Å²	35	70.9 Å²	70.9	22%	0.215	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	122.7	160.6	-53.1	0	0	0	0	107.7	I979 N980 I1226 N1227	I979-T1157 CarbonylContact O-C 3.58Å; I979-T1157 WeakPolarHBondContact O-CA 3.29Å; N980-T1157 WeakPolarHBondContact OD1-CB 3.4Å; N980-T1157 WeakPolarHBondContact OD1-CG2 3.43Å; N980-T1157 PolarHBondContact OD1-OG1 3.25Å; T1157-I1226 HydrophobicContact CG2-CB 4.17Å; T1157-I1226 HydrophobicContact CG2-CD1 4.22Å; T1157-I1226 WeakPolarHBondContact O-CB 3.48Å; T1157-I1226 PolarHBondContact O-N 3.37Å; T1157-N1227 PolarHBondContact N-O 2.93Å; T1157-N1227 PolarHBondContact O-N 2.77Å
1158	L	83.9	Confident	61.8	Low	0 Å²	0	75 Å²	75	0%	0	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	133.9	-168.2	-60.5	176.2	0	0	0	111.4	H978 I979 V981 I1019 V1028 F1156 Y1223 T1224 L1225	H978-L1158 WeakPolarHBondContact CA-O 3.44Å; I979-L1158 HydrophobicContact CD1-CB 4.43Å; I979-L1158 HydrophobicContact CD1-CD1 4.41Å; I979-L1158 HydrophobicContact CG1-CB 3.81Å; I979-L1158 HydrophobicContact CG1-CD1 4.46Å; I979-L1158 PolarHBondContact N-O 2.78Å; I979-L1158 PolarHBondContact O-N 2.81Å; V981-L1158 HydrophobicContact CG2-CD1 4.25Å; I1019-L1158 HydrophobicContact CD1-CD1 3.76Å; V1028-L1158 HydrophobicContact CB-CD2 4.42Å; V1028-L1158 HydrophobicContact CG1-CD2 3.65Å; V1028-L1158 HydrophobicContact CG2-CD1 4.15Å; V1028-L1158 HydrophobicContact CG2-CD2 3.82Å; F1156-L1158 HydrophobicContact CB-CD1 4.3Å; F1156-L1158 HydrophobicContact CB-CD2 3.86Å; F1156-L1158 HydrophobicContact CB-CG 3.87Å; L1158-Y1223 HydrophobicContact CB-CD1 4.1Å; L1158-Y1223 HydrophobicContact CB-CG 4.38Å; L1158-Y1223 HydrophobicContact CD1-CG 4.48Å; L1158-T1224 CarbonylContact C-O 3.54Å; L1158-T1224 WeakPolarHBondContact CA-O 3.32Å; L1158-L1225 HydrophobicContact CD2-CD1 3.93Å
1159	K	79.7	Confident	60.1	Low	43 Å²	43	77.9 Å²	77.9	19%	0.187	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	129.5	169.9	-143.7	175.6	179.7	167.4	0	109.9	E977 S1055 R1161 Y1223 T1224 I1226	E977-K1159 VanDerWaalsContact O-CA 3.3Å; E977-K1159 WeakPolarHBondContact O-CA 3.22Å; E977-K1159 WeakPolarHBondContact O-CG 3.08Å; E977-K1159 WeakPolarHBondContact OE2-CE 3.04Å; E977-K1159 IonicContact OE2-NZ 2.6Å; E977-K1159 PolarHBondContact OE2-NZ 3.12Å; S1055-K1159 PolarHBondContact OG-NZ 3.06Å; K1159-R1161 PolarHBondContact O-N 2.99Å; K1159-Y1223 CarbonylContact O-C 3.5Å; K1159-Y1223 VanDerWaalsContact O-CA 3.28Å; K1159-Y1223 WeakPolarHBondContact O-CA 3.19Å; K1159-T1224 PolarHBondContact N-O 3.5Å; K1159-T1224 PolarHBondContact O-N 3.01Å; K1159-I1226 HydrophobicContact CB-CD1 3.59Å; K1159-I1226 HydrophobicContact CB-CG1 3.91Å; K1159-I1226 HydrophobicContact CG-CD1 4.07Å
1160	Y	70.7	Confident	58.1	Low	84 Å²	84	86.2 Å²	86.2	33%	0.329	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	129.3	170.2	-179.4	-117.9	0	0	0	110.4	E977 T1162 K1221 Y1223	E977-Y1160 PolarHBondContact O-N 3.19Å; Y1160-T1162 HydrophobicContact CD1-CG2 3.78Å; Y1160-T1162 HydrophobicContact CE1-CG2 3.84Å; Y1160-T1162 PolarHBondContact O-N 3.14Å; Y1160-K1221 HydrophobicContact CE2-CB 4.19Å; Y1160-K1221 HydrophobicContact CE2-CD 3.95Å; Y1160-K1221 HydrophobicContact CE2-CG 4.12Å; Y1160-Y1223 HydrophobicContact CD2-CD1 4.19Å; Y1160-Y1223 AromaticContact CD2-CE1 3.75Å; Y1160-Y1223 HydrophobicContact CD2-CE1 3.75Å; Y1160-Y1223 AromaticContact CD2-CZ 3.97Å; Y1160-Y1223 HydrophobicContact CG-CE1 4.25Å
1161	R	63.5	Low	55.9	Low	76 Å²	76	90.9 Å²	90.9	29%	0.287	44%	0.437	S	S	.	.			trans	-84.1	96.8	172.7	-74.6	-167.6	174.9	-140.2	-8.5	110.2	H1032 K1159 L1222 T1224	H1032-R1161 PolarHBondContact CE1-NH2 2.98Å; H1032-R1161 PolarHBondContact NE2-NH2 3.16Å; K1159-R1161 PolarHBondContact O-N 2.99Å; R1161-L1222 PolarHBondContact N-O 2.81Å; R1161-T1224 VanDerWaalsContact CG-OG1 3.29Å; R1161-T1224 WeakPolarHBondContact CG-OG1 3.45Å; R1161-T1224 PolarHBondContact NE-OG1 3.02Å
1162	T	52.2	Low	53.6	Low	100 Å²	100	95.3 Å²	95.3	61%	0.613	47%	0.465	S	S	*	.			trans	-65.1	149.8	163.8	49	0	0	0	0	110.3	Y1160 N1164	Y1160-T1162 HydrophobicContact CD1-CG2 3.78Å; Y1160-T1162 HydrophobicContact CE1-CG2 3.84Å; Y1160-T1162 PolarHBondContact O-N 3.14Å; T1162-N1164 PolarHBondContact O-N 2.93Å
1163	K	44.1	Very low	51.3	Low	138 Å²	138	97.4 Å²	97.4	60%	0.6	49%	0.485	S	S	*	.			trans	-71.2	85.2	-169	-72.3	-177.9	176.7	178.8	0	113.6	T1165 D1184	K1163-T1165 VanDerWaalsContact C-N 3.31Å; K1163-T1165 PolarHBondContact O-N 3.12Å; K1163-D1184 IonicContact NZ-OD2 3.25Å; K1163-D1184 PolarHBondContact NZ-OD2 3.12Å
1164	N	33.1	Very low	49.1	Very low	94 Å²	94	100 Å²	100	50%	0.503	50%	0.504	S	S	.	.			trans	-90.2	69.1	151.1	-80.7	-23.5	0	0	0	109.3	D1053 T1162 P1166	D1053-N1164 PolarHBondContact OD1-ND2 2.79Å; T1162-N1164 PolarHBondContact O-N 2.93Å; N1164-P1166 VanDerWaalsContact O-CD 3.29Å; N1164-P1166 WeakPolarHBondContact O-CD 3.36Å
1165	T	31.8	Very low	47	Very low	87 Å²	87	104.6 Å²	104.6	53%	0.534	54%	0.536	S	S	.	.			trans	-59.2	116.1	166.4	37.5	0	0	0	0	108.4	K1163 R1167	K1163-T1165 VanDerWaalsContact C-N 3.31Å; K1163-T1165 PolarHBondContact O-N 3.12Å; T1165-R1167 PolarHBondContact O-N 2.93Å
1166	P	28.9	Very low	44.7	Very low	64 Å²	64	103.4 Å²	103.4	42%	0.416	54%	0.541	S	S	.	.			trans	-61.8	134.6	174.8	26.5	-32.4	0	0	0	108.2	L1049 N1164 C1168	L1049-P1166 HydrophobicContact CD2-CB 3.87Å; L1049-P1166 HydrophobicContact CD2-CG 4.48Å; N1164-P1166 VanDerWaalsContact O-CD 3.29Å; N1164-P1166 WeakPolarHBondContact O-CD 3.36Å; P1166-C1168 PolarHBondContact O-N 2.95Å
1167	R	24.1	Very low	42.2	Very low	246 Å²	246	106.1 Å²	106.1	93%	0.928	56%	0.561	S	S	*	*			trans	-68.7	74.8	169.5	-82.8	-178.2	169.4	170.9	-3	108.9	T1165 H1169	T1165-R1167 PolarHBondContact O-N 2.93Å; R1167-H1169 PolarHBondContact O-N 2.68Å; R1167-H1169 VanDerWaalsContact O-N 3.08Å
1168	C	28.3	Very low	39.8	Very low	109 Å²	109	108 Å²	108	74%	0.736	58%	0.575	S	S	*	*			trans	-60.1	114.9	167.8	-68.1	0	0	0	0	107.7	P1166	P1166-C1168 PolarHBondContact O-N 2.95Å
1169	H	26.9	Very low	37.6	Very low	173 Å²	173	111.7 Å²	111.7	80%	0.801	59%	0.594	S	S	*	*			trans	-53.8	142.6	170.6	-88	-100.6	0	0	0	109.5	R1167 S1171	R1167-H1169 PolarHBondContact O-N 2.68Å; R1167-H1169 VanDerWaalsContact O-N 3.08Å; H1169-S1171 PolarHBondContact O-N 3.16Å
1170	R	26.1	Very low	35.4	Very low	257 Å²	257	112.7 Å²	112.7	97%	0.97	61%	0.607	S	S	*	*	S	Bend	trans	-70.4	71.6	-168.1	-170.5	-173.8	-172.9	180	2.5	111.8
1171	S	26.7	Very low	33.7	Very low	98 Å²	98	114 Å²	114	69%	0.685	62%	0.62	S	S	*	*			trans	-132.9	104	-177.1	-57.5	0	0	0	0	110.3	H1169 T1173	H1169-S1171 PolarHBondContact O-N 3.16Å; S1171-T1173 PolarHBondContact O-N 3.31Å
1172	T	28.2	Very low	32.3	Very low	137 Å²	137	111.9 Å²	111.9	84%	0.84	62%	0.616	S	S	*	*			trans	-18.4	107.8	168	48.8	0	0	0	0	118.4
1173	T	30.7	Very low	31.7	Very low	102 Å²	102	108.8 Å²	108.8	63%	0.626	60%	0.601	S	S	*	*				-165.9	118.9	125.1	39.8	0	0	0	0	109.8	S1171	S1171-T1173 PolarHBondContact O-N 3.31Å
1174	T	30	Very low	31.4	Very low	141 Å²	141	107 Å²	107	87%	0.865	60%	0.598	S	S	*	*			trans	-94.1	101.9	179.3	44	0	0	0	0	111.6
1175	S	32.9	Very low	31.5	Very low	99 Å²	99	108.8 Å²	108.8	69%	0.692	60%	0.603	S	S	*	*	S	Bend	trans	-152.4	-25.4	166	55.1	0	0	0	0	116.1
1176	T	32.3	Very low	31.6	Very low	87 Å²	87	113.1 Å²	113.1	53%	0.534	61%	0.61	S	S	.	*	S	Bend	trans	-124.8	-15.6	-177.8	53.1	0	0	0	0	116.1	S1178	T1176-S1178 PolarHBondContact O-N 2.84Å
1177	S	29	Very low	32.2	Very low	59 Å²	59	114.9 Å²	114.9	41%	0.413	61%	0.608	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82	-6.2	-178	55.8	0	0	0	0	115.2	L1179 S1180 N1181	S1177-L1179 VanDerWaalsContact C-N 3.34Å; S1177-L1179 PolarHBondContact O-N 2.82Å; S1177-S1180 PolarHBondContact O-N 2.7Å; S1177-S1180 PolarHBondContact O-OG 3.31Å; S1177-S1180 VanDerWaalsContact O-OG 3.13Å; S1177-N1181 PolarHBondContact O-N 3.22Å
1178	S	33.5	Very low	32.7	Very low	74 Å²	74	108.7 Å²	108.7	52%	0.517	59%	0.593	S	S	.	*	H	α-helix	trans	-67.3	-31.5	-179.5	57.6	0	0	0	0	113	T1176 S1182	T1176-S1178 PolarHBondContact O-N 2.84Å; S1178-S1182 WeakPolarHBondContact O-CB 3.43Å; S1178-S1182 PolarHBondContact O-N 2.73Å
1179	L	36.2	Very low	33.2	Very low	77 Å²	77	108.5 Å²	108.5	40%	0.403	58%	0.58	S	S	.	*	H	α-helix	trans	-72.3	-35	178.3	-92.9	80.3	0	0	0	113.3	S1177	S1177-L1179 VanDerWaalsContact C-N 3.34Å; S1177-L1179 PolarHBondContact O-N 2.82Å
1180	S	35.3	Very low	33.8	Very low	65 Å²	65	104.6 Å²	104.6	46%	0.455	56%	0.562	S	S	.	*	H	α-helix	trans	-78.1	-36.7	-178.3	59	0	0	0	0	113	S1177	S1177-S1180 PolarHBondContact O-N 2.7Å; S1177-S1180 PolarHBondContact O-OG 3.31Å; S1177-S1180 VanDerWaalsContact O-OG 3.13Å
1181	N	34	Very low	34.4	Very low	112 Å²	112	95.4 Å²	95.4	60%	0.599	53%	0.531	S	S	*	.	H	α-helix	trans	-88.7	-18.2	-171.4	-69.2	7.1	0	0	0	113.7	S1177	S1177-N1181 PolarHBondContact O-N 3.22Å
1182	S	35	Very low	35.1	Very low	30 Å²	30	94.4 Å²	94.4	21%	0.21	52%	0.518	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	17.2	-175.9	103.3	0	0	0	0	114.8	S1178 D1184 H1185 R1187	S1178-S1182 WeakPolarHBondContact O-CB 3.43Å; S1178-S1182 PolarHBondContact O-N 2.73Å; S1182-D1184 PolarHBondContact O-N 2.89Å; S1182-H1185 PolarHBondContact O-N 3.31Å; S1182-H1185 VanDerWaalsContact O-N 3.12Å; S1182-R1187 PolarHBondContact OG-NE 3.35Å; S1182-R1187 PolarHBondContact OG-NH2 3.37Å
1183	A	39	Very low	35.5	Very low	35 Å²	35	90 Å²	90	29%	0.289	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-17.2	-168.7	0	0	0	0	0	115.4	P1219	A1183-P1219 WeakPolarHBondContact O-CB 3.48Å
1184	D	37.9	Very low	36	Very low	101 Å²	101	95 Å²	95	54%	0.54	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.3	10.9	-178.4	-53.2	-40.2	0	0	0	114.1	K1163 S1182	K1163-D1184 IonicContact NZ-OD2 3.25Å; K1163-D1184 PolarHBondContact NZ-OD2 3.12Å; S1182-D1184 PolarHBondContact O-N 2.89Å
1185	H	35.1	Very low	36.5	Very low	132 Å²	132	92.5 Å²	92.5	61%	0.611	48%	0.483	S	S	*	.	S	Bend	trans	-116.8	125.9	-175.9	-65	-26.5	0	0	0	113	S1182 R1187	S1182-H1185 PolarHBondContact O-N 3.31Å; S1182-H1185 VanDerWaalsContact O-N 3.12Å; H1185-R1187 PolarHBondContact O-N 2.9Å
1186	W	34.2	Very low	36.9	Very low	177 Å²	177	92 Å²	92	67%	0.67	48%	0.48	S	S	*	.	P	Polyproline II helix	trans	-58.9	127.2	167.8	-65.8	80.3	0	0	0	109.6	V1216 P1218	W1186-V1216 HydrophobicContact CB-CG1 4.18Å; W1186-V1216 HydrophobicContact CE3-CG1 3.79Å; W1186-P1218 HydrophobicContact CE3-CB 4.28Å; W1186-P1218 HydrophobicContact CH2-CB 4.36Å; W1186-P1218 HydrophobicContact CZ3-CB 3.96Å
1187	R	41.3	Very low	37.1	Very low	101 Å²	101	94.3 Å²	94.3	38%	0.381	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	119.3	-174.8	-62.5	178.3	176.5	160.6	-0.1	110.3	S1182 H1185 V1216 L1217	S1182-R1187 PolarHBondContact OG-NE 3.35Å; S1182-R1187 PolarHBondContact OG-NH2 3.37Å; H1185-R1187 PolarHBondContact O-N 2.9Å; R1187-V1216 CarbonylContact O-C 3.49Å; R1187-V1216 WeakPolarHBondContact O-CA 3.28Å; R1187-L1217 HydrophobicContact CB-CB 4.33Å; R1187-L1217 PolarHBondContact N-O 3.06Å; R1187-L1217 PolarHBondContact O-N 3.22Å
1188	L	33.5	Very low	37.4	Very low	117 Å²	117	98.7 Å²	98.7	61%	0.613	51%	0.508	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.6	117.2	173.4	-159.8	81.7	0	0	0	109.6	Y1214 F1215 V1216	L1188-Y1214 HydrophobicContact CD2-CD1 3.51Å; L1188-Y1214 HydrophobicContact CD2-CE1 4.13Å; L1188-Y1214 HydrophobicContact CD2-CG 4.12Å; L1188-Y1214 HydrophobicContact CG-CD1 3.88Å; L1188-Y1214 HydrophobicContact CG-CG 4.35Å; L1188-F1215 CarbonylContact C-O 3.56Å; L1188-V1216 HydrophobicContact CD1-CG2 3.94Å
1189	K	39.3	Very low	37.5	Very low	105 Å²	105	101 Å²	101	46%	0.457	52%	0.524	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	110.7	176.4	179.7	178.3	179.9	177.3	0	110.9	I1191 Y1214 F1215	K1189-I1191 HydrophobicContact CD-CG1 4.44Å; K1189-I1191 HydrophobicContact CG-CG1 4.33Å; K1189-Y1214 CarbonylContact O-C 3.56Å; K1189-Y1214 WeakPolarHBondContact O-CA 3.01Å; K1189-F1215 HydrophobicContact CB-CB 4.48Å; K1189-F1215 PolarHBondContact N-O 2.97Å; K1189-F1215 PolarHBondContact O-N 2.92Å
1190	Q	40.3	Very low	37.8	Very low	91 Å²	91	104.1 Å²	104.1	43%	0.425	54%	0.54	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	137.4	168.2	-165	169.3	-26.6	0	0	110.7	N1192 S1212 V1213 Y1214	Q1190-N1192 PolarHBondContact NE2-OD1 2.77Å; Q1190-S1212 PolarHBondContact NE2-OG 3.36Å; Q1190-V1213 CarbonylContact C-O 3.42Å; Q1190-Y1214 HydrophobicContact CB-CD1 3.69Å; Q1190-Y1214 HydrophobicContact CB-CE1 3.48Å; Q1190-Y1214 VanDerWaalsContact CB-CE1 3.48Å; Q1190-Y1214 VanDerWaalsContact CD-CZ 3.44Å; Q1190-Y1214 HydrophobicContact CG-CD1 3.99Å; Q1190-Y1214 HydrophobicContact CG-CE1 3.49Å; Q1190-Y1214 VanDerWaalsContact CG-CE1 3.49Å; Q1190-Y1214 HydrophobicContact CG-CE2 4.32Å; Q1190-Y1214 VanDerWaalsContact OE1-CZ 3.27Å; Q1190-Y1214 PolarHBondContact OE1-OH 2.97Å
1191	I	38.6	Very low	37.9	Very low	63 Å²	63	111.3 Å²	111.3	32%	0.323	56%	0.559	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-128.8	111.3	168.7	-59.1	-169.8	0	0	0	106.9	K1189 L1193 S1212 V1213 F1215	K1189-I1191 HydrophobicContact CD-CG1 4.44Å; K1189-I1191 HydrophobicContact CG-CG1 4.33Å; I1191-L1193 PolarHBondContact O-N 3.24Å; I1191-S1212 CarbonylContact O-C 3.58Å; I1191-S1212 WeakPolarHBondContact O-CA 3.22Å; I1191-V1213 PolarHBondContact N-O 3.43Å; I1191-V1213 PolarHBondContact O-N 3.18Å; I1191-F1215 HydrophobicContact CB-CE2 4.45Å; I1191-F1215 HydrophobicContact CD1-CD2 3.68Å; I1191-F1215 HydrophobicContact CD1-CE2 3.62Å; I1191-F1215 HydrophobicContact CG1-CD2 4Å; I1191-F1215 HydrophobicContact CG1-CE2 4.15Å
1192	N	40.9	Very low	37.9	Very low	77 Å²	77	110.6 Å²	110.6	41%	0.412	56%	0.563	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-75.3	117.2	177.8	-63.9	-25.2	0	0	0	109.2	Q1190 S1212	Q1190-N1192 PolarHBondContact NE2-OD1 2.77Å; N1192-S1212 WeakPolarHBondContact OD1-CB 3.48Å
1193	L	37.4	Very low	38.1	Very low	45 Å²	45	118.6 Å²	118.6	24%	0.236	60%	0.596	C	S	.	*			trans	-86.7	114	177.9	-60	163.9	0	0	0	107.4	K103 I1191 D1195 Q1211 V1213	K103-L1193 HydrophobicContact CB-CD1 4.39Å; K103-L1193 HydrophobicContact CD-CB 4.29Å; K103-L1193 HydrophobicContact CD-CD1 3.7Å; I1191-L1193 PolarHBondContact O-N 3.24Å; L1193-D1195 PolarHBondContact O-N 2.75Å; L1193-Q1211 VanDerWaalsContact CB-O 3.31Å; L1193-Q1211 WeakPolarHBondContact CB-O 3.18Å; L1193-Q1211 PolarHBondContact N-O 2.93Å; L1193-V1213 HydrophobicContact CD1-CB 4.15Å; L1193-V1213 HydrophobicContact CD1-CG2 3.49Å; L1193-V1213 VanDerWaalsContact CD1-CG2 3.49Å
1194	K	40.3	Very low	38.1	Very low	206 Å²	206	123.2 Å²	123.2	90%	0.896	62%	0.616	S	S	*	*	P	Polyproline II helix	trans	-70.9	117.1	166.3	-69.7	-176.9	177.2	-179.3	0	107.3	S1196	K1194-S1196 PolarHBondContact O-N 3.03Å; K1194-S1196 VanDerWaalsContact O-N 3.16Å
1195	D	41.2	Very low	37.9	Very low	89 Å²	89	126 Å²	126	48%	0.476	63%	0.631	S	S	.	*	P	Polyproline II helix	trans	-62.4	116.4	168.9	-76.7	-34.1	0	0	0	108.3	K103 L1193	K103-D1195 WeakPolarHBondContact CE-OD1 3.5Å; K103-D1195 IonicContact NZ-OD1 3.83Å; K103-D1195 PolarHBondContact NZ-OD1 2.94Å; K103-D1195 IonicContact NZ-OD2 2.91Å; L1193-D1195 PolarHBondContact O-N 2.75Å
1196	S	39.8	Very low	37.9	Very low	88 Å²	88	128.2 Å²	128.2	62%	0.615	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-69.1	149.9	160.8	64.8	0	0	0	0	108.3	K1194	K1194-S1196 PolarHBondContact O-N 3.03Å; K1194-S1196 VanDerWaalsContact O-N 3.16Å
1197	D	36.8	Very low	38.1	Very low	136 Å²	136	127.5 Å²	127.5	73%	0.727	65%	0.65	S	S	*	*	S	Bend	trans	67.2	89	162.6	-39.4	-50.5	0	0	0	115.7
1198	N	36.4	Very low	37.9	Very low	152 Å²	152	126 Å²	126	81%	0.813	67%	0.665	S	S	*	*			trans	-178.2	9.1	132.5	-92.1	-28.4	0	0	0	115.6	L1200	N1198-L1200 PolarHBondContact O-N 3.31Å
1199	S	35.3	Very low	38	Very low	121 Å²	121	128 Å²	128	85%	0.846	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	68.6	174.7	65.4	0	0	0	0	113.3
1200	L	42.5	Very low	38	Very low	144 Å²	144	130.7 Å²	130.7	75%	0.754	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-148.7	-20	157.5	-144.3	74.5	0	0	0	115.5	N1198	N1198-L1200 PolarHBondContact O-N 3.31Å
1201	Y	38	Very low	37.9	Very low	216 Å²	216	130.4 Å²	130.4	85%	0.847	68%	0.684	S	S	*	*	S	Bend	trans	-138.7	63.7	179.8	-74.1	-74.7	0	0	0	114.1
1202	S	32.6	Very low	37.9	Very low	97 Å²	97	129.1 Å²	129.1	68%	0.678	68%	0.681	S	S	*	*			trans	-151.4	97.2	143.6	60.2	0	0	0	0	109.4	D1204	S1202-D1204 PolarHBondContact O-N 2.82Å
1203	H	39.8	Very low	37.6	Very low	197 Å²	197	128.4 Å²	128.4	91%	0.912	68%	0.68	S	S	*	*			trans	-71.1	81.4	153.7	-86.5	-67	0	0	0	107.6
1204	D	38	Very low	37.5	Very low	132 Å²	132	131.9 Å²	131.9	71%	0.706	69%	0.69	S	S	*	*	S	Bend	trans	-165.3	144.2	152.8	-97.4	-34.4	0	0	0	111	S1202 H1206	S1202-D1204 PolarHBondContact O-N 2.82Å; D1204-H1206 PolarHBondContact O-N 3.05Å
1205	N	35.3	Very low	37.2	Very low	159 Å²	159	127.3 Å²	127.3	85%	0.85	67%	0.67	S	S	*	*			trans	-78.7	68.7	-161.7	-72.2	-45.1	0	0	0	114.4
1206	H	33.9	Very low	36.7	Very low	179 Å²	179	127.1 Å²	127.1	83%	0.829	67%	0.673	S	S	*	*			trans	-99.7	110.9	163.7	-74.2	-61.2	0	0	0	111	D1204 G1208	D1204-H1206 PolarHBondContact O-N 3.05Å; H1206-G1208 PolarHBondContact O-N 2.87Å
1207	L	38.1	Very low	36.7	Very low	163 Å²	163	126.3 Å²	126.3	85%	0.853	66%	0.661	S	S	*	*			trans	-52.6	113.4	175.4	-83.8	74.4	0	0	0	109.8	Q1209	L1207-Q1209 PolarHBondContact O-N 3.41Å; L1207-Q1209 VanDerWaalsContact O-N 3.08Å
1208	G	37.4	Very low	36.9	Very low	68 Å²	68	122.4 Å²	122.4	70%	0.701	64%	0.643	S	S	*	*			trans	-58.9	113.8	172.2	0	0	0	0	0	110	H1206 Q1210	H1206-G1208 PolarHBondContact O-N 2.87Å; G1208-Q1210 PolarHBondContact O-N 3.24Å
1209	Q	37.2	Very low	37.5	Very low	159 Å²	159	116.9 Å²	116.9	74%	0.743	62%	0.615	S	S	*	*			trans	-66.4	102.4	178	-72.5	-178.2	-18.1	0	0	109.4	L1207 Q1211	L1207-Q1209 PolarHBondContact O-N 3.41Å; L1207-Q1209 VanDerWaalsContact O-N 3.08Å; Q1209-Q1211 PolarHBondContact O-N 3.4Å
1210	Q	38.9	Very low	38.6	Very low	163 Å²	163	114.5 Å²	114.5	76%	0.762	59%	0.588	S	S	*	*			trans	-61.7	99.1	173.3	-67.6	-177.7	-2.8	0	0	109.7	G1208 S1212	G1208-Q1210 PolarHBondContact O-N 3.24Å; Q1210-S1212 PolarHBondContact O-N 2.91Å
1211	Q	37.6	Very low	39.7	Very low	84 Å²	84	109.6 Å²	109.6	39%	0.393	56%	0.561	S	S	.	*			trans	-75.1	127.6	178.8	-68.3	-174.4	-2.8	0	0	110.2	L1193 Q1209	L1193-Q1211 VanDerWaalsContact CB-O 3.31Å; L1193-Q1211 WeakPolarHBondContact CB-O 3.18Å; L1193-Q1211 PolarHBondContact N-O 2.93Å; Q1209-Q1211 PolarHBondContact O-N 3.4Å
1212	S	38.9	Very low	41.5	Very low	36 Å²	36	101.1 Å²	101.1	25%	0.252	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	136.3	178.3	63.4	0	0	0	0	110.7	Q1190 I1191 N1192 Q1210	Q1190-S1212 PolarHBondContact NE2-OG 3.36Å; I1191-S1212 CarbonylContact O-C 3.58Å; I1191-S1212 WeakPolarHBondContact O-CA 3.22Å; N1192-S1212 WeakPolarHBondContact OD1-CB 3.48Å; Q1210-S1212 PolarHBondContact O-N 2.91Å
1213	V	33.5	Very low	43.8	Very low	63 Å²	63	96.6 Å²	96.6	38%	0.382	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	130.8	177.6	165.2	0	0	0	0	109.5	Q1190 I1191 L1193 F1215	Q1190-V1213 CarbonylContact C-O 3.42Å; I1191-V1213 PolarHBondContact N-O 3.43Å; I1191-V1213 PolarHBondContact O-N 3.18Å; L1193-V1213 HydrophobicContact CD1-CB 4.15Å; L1193-V1213 HydrophobicContact CD1-CG2 3.49Å; L1193-V1213 VanDerWaalsContact CD1-CG2 3.49Å; V1213-F1215 HydrophobicContact CB-CE2 4.42Å; V1213-F1215 HydrophobicContact CG1-CD2 4.05Å; V1213-F1215 HydrophobicContact CG1-CE2 3.57Å; V1213-F1215 HydrophobicContact CG1-CZ 4.07Å
1214	Y	35.6	Very low	45.9	Very low	117 Å²	117	88.6 Å²	88.6	46%	0.459	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	120.6	179.7	-64.1	-92.9	0	0	0	110.6	L1188 K1189 Q1190	L1188-Y1214 HydrophobicContact CD2-CD1 3.51Å; L1188-Y1214 HydrophobicContact CD2-CE1 4.13Å; L1188-Y1214 HydrophobicContact CD2-CG 4.12Å; L1188-Y1214 HydrophobicContact CG-CD1 3.88Å; L1188-Y1214 HydrophobicContact CG-CG 4.35Å; K1189-Y1214 CarbonylContact O-C 3.56Å; K1189-Y1214 WeakPolarHBondContact O-CA 3.01Å; Q1190-Y1214 HydrophobicContact CB-CD1 3.69Å; Q1190-Y1214 HydrophobicContact CB-CE1 3.48Å; Q1190-Y1214 VanDerWaalsContact CB-CE1 3.48Å; Q1190-Y1214 VanDerWaalsContact CD-CZ 3.44Å; Q1190-Y1214 HydrophobicContact CG-CD1 3.99Å; Q1190-Y1214 HydrophobicContact CG-CE1 3.49Å; Q1190-Y1214 VanDerWaalsContact CG-CE1 3.49Å; Q1190-Y1214 HydrophobicContact CG-CE2 4.32Å; Q1190-Y1214 VanDerWaalsContact OE1-CZ 3.27Å; Q1190-Y1214 PolarHBondContact OE1-OH 2.97Å
1215	F	33.5	Very low	48.2	Very low	110 Å²	110	82.4 Å²	82.4	48%	0.482	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	125.7	173.8	-72.3	-94.9	0	0	0	110.1	L1188 K1189 I1191 V1213	L1188-F1215 CarbonylContact C-O 3.56Å; K1189-F1215 HydrophobicContact CB-CB 4.48Å; K1189-F1215 PolarHBondContact N-O 2.97Å; K1189-F1215 PolarHBondContact O-N 2.92Å; I1191-F1215 HydrophobicContact CB-CE2 4.45Å; I1191-F1215 HydrophobicContact CD1-CD2 3.68Å; I1191-F1215 HydrophobicContact CD1-CE2 3.62Å; I1191-F1215 HydrophobicContact CG1-CD2 4Å; I1191-F1215 HydrophobicContact CG1-CE2 4.15Å; V1213-F1215 HydrophobicContact CB-CE2 4.42Å; V1213-F1215 HydrophobicContact CG1-CD2 4.05Å; V1213-F1215 HydrophobicContact CG1-CE2 3.57Å; V1213-F1215 HydrophobicContact CG1-CZ 4.07Å
1216	V	32	Very low	50.5	Low	86 Å²	86	76.9 Å²	76.9	52%	0.521	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	118.2	171.4	-153.8	0	0	0	0	109.1	W1186 R1187 L1188	W1186-V1216 HydrophobicContact CB-CG1 4.18Å; W1186-V1216 HydrophobicContact CE3-CG1 3.79Å; R1187-V1216 CarbonylContact O-C 3.49Å; R1187-V1216 WeakPolarHBondContact O-CA 3.28Å; L1188-V1216 HydrophobicContact CD1-CG2 3.94Å
1217	L	39.3	Very low	52.9	Low	71 Å²	71	71.7 Å²	71.7	37%	0.372	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	129.2	171.2	-65.4	170.1	0	0	0	109.5	R1187	R1187-L1217 HydrophobicContact CB-CB 4.33Å; R1187-L1217 PolarHBondContact N-O 3.06Å; R1187-L1217 PolarHBondContact O-N 3.22Å
1218	P	40.9	Very low	55.1	Low	53 Å²	53	64 Å²	64	34%	0.344	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-69.5	155.2	178.6	29.8	-34.9	0	0	0	111.6	W1186 Y1220	W1186-P1218 HydrophobicContact CE3-CB 4.28Å; W1186-P1218 HydrophobicContact CH2-CB 4.36Å; W1186-P1218 HydrophobicContact CZ3-CB 3.96Å; P1218-Y1220 HydrophobicContact CG-CE1 3.93Å; P1218-Y1220 PolarHBondContact O-N 2.94Å
1219	P	48.5	Very low	56.9	Low	36 Å²	36	63.4 Å²	63.4	23%	0.234	32%	0.321	C	S	.	.			trans	-66.3	100.7	172.6	25.7	-32.1	0	0	0	111.1	A1183 K1221	A1183-P1219 WeakPolarHBondContact O-CB 3.48Å; P1219-K1221 PolarHBondContact O-N 3.29Å
1220	Y	60.1	Low	58	Low	72 Å²	72	56.9 Å²	56.9	28%	0.282	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-73.4	119	174.2	-61.3	-61.6	0	0	0	111	S1025 P1218	S1025-Y1220 VanDerWaalsContact O-CD1 3.27Å; S1025-Y1220 WeakPolarHBondContact O-CD1 3.46Å; P1218-Y1220 HydrophobicContact CG-CE1 3.93Å; P1218-Y1220 PolarHBondContact O-N 2.94Å
1221	K	65.1	Low	58.6	Low	40 Å²	40	55.1 Å²	55.1	17%	0.174	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-59.4	135.4	166.5	-79.3	179.7	176.6	166.7	0	110.1	I959 L1027 Y1160 P1219 Y1223	I959-K1221 HydrophobicContact CG2-CB 4.23Å; I959-K1221 HydrophobicContact CG2-CD 3.91Å; I959-K1221 HydrophobicContact CG2-CG 3.89Å; I959-K1221 WeakPolarHBondContact O-CE 3.34Å; I959-K1221 PolarHBondContact O-NZ 3.21Å; L1027-K1221 PolarHBondContact N-O 2.93Å; Y1160-K1221 HydrophobicContact CE2-CB 4.19Å; Y1160-K1221 HydrophobicContact CE2-CD 3.95Å; Y1160-K1221 HydrophobicContact CE2-CG 4.12Å; P1219-K1221 PolarHBondContact O-N 3.29Å; K1221-Y1223 HydrophobicContact CB-CD2 4.42Å; K1221-Y1223 HydrophobicContact CB-CE2 3.72Å
1222	L	75	Confident	58.8	Low	39 Å²	39	56.5 Å²	56.5	20%	0.204	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	126.1	178.9	-179.1	65.4	0	0	0	111	L1027 Q1029 R1161	L1027-L1222 HydrophobicContact CD2-CD1 3.95Å; L1027-L1222 HydrophobicContact CG-CD1 3.79Å; L1027-L1222 WeakPolarHBondContact O-CA 3.32Å; Q1029-L1222 HydrophobicContact CB-CD1 3.92Å; R1161-L1222 PolarHBondContact N-O 2.81Å
1223	Y	81	Confident	58.8	Low	1 Å²	1	58.3 Å²	58.3	0%	0.004	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	146.4	174.7	-66	-95.4	0	0	0	111	W958 I979 A1026 L1027 V1028 Q1029 L1158 K1159 Y1160 K1221	W958-Y1223 HydrophobicContact CZ3-CE2 4.15Å; I979-Y1223 HydrophobicContact CD1-CD1 4.09Å; I979-Y1223 HydrophobicContact CD1-CE1 3.55Å; I979-Y1223 HydrophobicContact CG1-CE1 4.34Å; A1026-Y1223 HydrophobicContact CB-CD2 3.89Å; A1026-Y1223 HydrophobicContact CB-CE2 3.94Å; L1027-Y1223 PolarHBondContact O-N 3.23Å; V1028-Y1223 WeakPolarHBondContact CA-O 3.47Å; Q1029-Y1223 PolarHBondContact N-O 2.88Å; L1158-Y1223 HydrophobicContact CB-CD1 4.1Å; L1158-Y1223 HydrophobicContact CB-CG 4.38Å; L1158-Y1223 HydrophobicContact CD1-CG 4.48Å; K1159-Y1223 CarbonylContact O-C 3.5Å; K1159-Y1223 VanDerWaalsContact O-CA 3.28Å; K1159-Y1223 WeakPolarHBondContact O-CA 3.19Å; Y1160-Y1223 HydrophobicContact CD2-CD1 4.19Å; Y1160-Y1223 AromaticContact CD2-CE1 3.75Å; Y1160-Y1223 HydrophobicContact CD2-CE1 3.75Å; Y1160-Y1223 AromaticContact CD2-CZ 3.97Å; Y1160-Y1223 HydrophobicContact CG-CE1 4.25Å; K1221-Y1223 HydrophobicContact CB-CD2 4.42Å; K1221-Y1223 HydrophobicContact CB-CE2 3.72Å
1224	T	84.4	Confident	58.7	Low	29 Å²	29	63.6 Å²	63.6	18%	0.178	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	133.3	167.5	-48.4	0	0	0	0	109	Q1029 L1158 K1159 R1161	Q1029-T1224 CarbonylContact O-C 3.56Å; Q1029-T1224 WeakPolarHBondContact O-CA 3.36Å; L1158-T1224 CarbonylContact C-O 3.54Å; L1158-T1224 WeakPolarHBondContact CA-O 3.32Å; K1159-T1224 PolarHBondContact N-O 3.5Å; K1159-T1224 PolarHBondContact O-N 3.01Å; R1161-T1224 VanDerWaalsContact CG-OG1 3.29Å; R1161-T1224 WeakPolarHBondContact CG-OG1 3.45Å; R1161-T1224 PolarHBondContact NE-OG1 3.02Å
1225	L	86.4	Confident	58.4	Low	2 Å²	2	66.2 Å²	66.2	1%	0.01	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	127.1	168.9	-175	62.7	0	0	0	110	F1017 V1028 Q1029 L1030 L1069 F1156 L1158 N1227 V1228	F1017-L1225 HydrophobicContact CE1-CD2 4.48Å; F1017-L1225 HydrophobicContact CZ-CD2 4.22Å; V1028-L1225 HydrophobicContact CG1-CB 3.84Å; V1028-L1225 HydrophobicContact CG1-CD1 4.38Å; Q1029-L1225 PolarHBondContact O-N 3Å; L1030-L1225 HydrophobicContact CB-CB 4.29Å; L1030-L1225 HydrophobicContact CB-CD2 4.26Å; L1030-L1225 HydrophobicContact CD1-CB 4.4Å; L1030-L1225 HydrophobicContact CD1-CD2 4.3Å; L1030-L1225 HydrophobicContact CD2-CD2 4.47Å; L1069-L1225 HydrophobicContact CD1-CD2 4.32Å; L1069-L1225 HydrophobicContact CD2-CD2 4.35Å; F1156-L1225 HydrophobicContact CB-CD1 4.34Å; F1156-L1225 HydrophobicContact CD1-CD1 3.79Å; L1158-L1225 HydrophobicContact CD2-CD1 3.93Å; L1225-N1227 VanDerWaalsContact CD1-O 3.29Å; L1225-N1227 WeakPolarHBondContact CD1-O 3.49Å; L1225-V1228 HydrophobicContact CD1-CB 4.37Å; L1225-V1228 HydrophobicContact CD2-CB 4.47Å; L1225-V1228 HydrophobicContact CD2-CG1 4.43Å
1226	I	84.1	Confident	58.2	Low	44 Å²	44	67.2 Å²	67.2	23%	0.226	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	-44.9	176.3	-44.8	-178.7	0	0	0	110.7	H978 L1065 T1157 K1159	H978-I1226 HydrophobicContact CB-CD1 4.42Å; H978-I1226 WeakPolarHBondContact CD2-CD1 3.3Å; L1065-I1226 WeakPolarHBondContact CD1-O 3.39Å; L1065-I1226 WeakPolarHBondContact CD2-O 3.29Å; T1157-I1226 HydrophobicContact CG2-CB 4.17Å; T1157-I1226 HydrophobicContact CG2-CD1 4.22Å; T1157-I1226 WeakPolarHBondContact O-CB 3.48Å; T1157-I1226 PolarHBondContact O-N 3.37Å; K1159-I1226 HydrophobicContact CB-CD1 3.59Å; K1159-I1226 HydrophobicContact CB-CG1 3.91Å; K1159-I1226 HydrophobicContact CG-CD1 4.07Å
1227	N	84.3	Confident	58.2	Low	69 Å²	69	72.5 Å²	72.5	37%	0.369	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	151.9	177	-161.4	3.6	0	0	0	110.8	F1156 T1157 L1225	F1156-N1227 WeakPolarHBondContact CA-O 3.41Å; T1157-N1227 PolarHBondContact N-O 2.93Å; T1157-N1227 PolarHBondContact O-N 2.77Å; L1225-N1227 VanDerWaalsContact CD1-O 3.29Å; L1225-N1227 WeakPolarHBondContact CD1-O 3.49Å
1228	V	84	Confident	57.6	Low	3 Å²	3	79.2 Å²	79.2	2%	0.018	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	122.8	171	63.3	0	0	0	0	109.6	L1068 L1069 C1154 R1155 F1156 L1225	L1068-V1228 HydrophobicContact CB-CG1 3.76Å; L1069-V1228 HydrophobicContact CB-CG1 4.2Å; L1069-V1228 HydrophobicContact CD1-CG2 4.24Å; C1154-V1228 HydrophobicContact CB-CG2 3.64Å; R1155-V1228 WeakPolarHBondContact O-CA 3.43Å; F1156-V1228 HydrophobicContact CD1-CB 4.31Å; F1156-V1228 HydrophobicContact CD1-CG2 3.86Å; F1156-V1228 HydrophobicContact CE1-CG2 3.79Å; L1225-V1228 HydrophobicContact CD1-CB 4.37Å; L1225-V1228 HydrophobicContact CD2-CB 4.47Å; L1225-V1228 HydrophobicContact CD2-CG1 4.43Å
1229	T	75.2	Confident	58.4	Low	54 Å²	54	80.6 Å²	80.6	33%	0.331	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	134.3	170.6	50.5	0	0	0	0	109.3	R1155	R1155-T1229 PolarHBondContact N-O 2.84Å; R1155-T1229 PolarHBondContact O-N 3.12Å
1230	S	60.2	Low	59	Low	22 Å²	22	82.9 Å²	82.9	15%	0.154	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	157.3	170.1	85.9	0	0	0	0	109.4	D1232 D1233	S1230-D1232 PolarHBondContact O-N 3.35Å; S1230-D1232 PolarHBondContact OG-N 2.96Å; S1230-D1233 WeakPolarHBondContact CB-OD2 3.29Å; S1230-D1233 PolarHBondContact N-OD2 3.42Å; S1230-D1233 PolarHBondContact OG-N 2.87Å; S1230-D1233 PolarHBondContact OG-OD2 3.18Å
1231	H	50.7	Low	58.9	Low	126 Å²	126	83.5 Å²	83.5	58%	0.583	41%	0.412	S	S	*	.	S	Bend	trans	-64	-21.1	178.2	-170.6	-79.9	0	0	0	112.5
1232	D	42.9	Very low	58.5	Low	114 Å²	114	86.1 Å²	86.1	61%	0.61	43%	0.427	S	S	*	.	S	Bend	trans	-100.7	-15	-169.7	-56.4	-33.4	0	0	0	113.6	S1230 Y1234 F1235	S1230-D1232 PolarHBondContact O-N 3.35Å; S1230-D1232 PolarHBondContact OG-N 2.96Å; D1232-Y1234 PolarHBondContact O-N 2.96Å; D1232-Y1234 VanDerWaalsContact O-N 3.16Å; D1232-F1235 PolarHBondContact O-N 2.76Å; D1232-F1235 VanDerWaalsContact O-N 3.15Å
1233	D	38	Very low	57.5	Low	73 Å²	73	89 Å²	89	39%	0.39	44%	0.44	S	S	.	.	G	3₁₀ helix	trans	-65.6	-20.6	-174.6	-70.4	-50.7	0	0	0	113.7	S1230 F1235 N1236	S1230-D1233 WeakPolarHBondContact CB-OD2 3.29Å; S1230-D1233 PolarHBondContact N-OD2 3.42Å; S1230-D1233 PolarHBondContact OG-N 2.87Å; S1230-D1233 PolarHBondContact OG-OD2 3.18Å; D1233-F1235 PolarHBondContact O-N 2.73Å; D1233-N1236 PolarHBondContact O-N 2.92Å; D1233-N1236 VanDerWaalsContact O-N 3.16Å
1234	Y	31.2	Very low	55.9	Low	175 Å²	175	94.9 Å²	94.9	69%	0.686	47%	0.47	S	S	*	.	G	3₁₀ helix	trans	-60.7	-11.7	173.1	-90.2	-78.4	0	0	0	114.3	D1232	D1232-Y1234 PolarHBondContact O-N 2.96Å; D1232-Y1234 VanDerWaalsContact O-N 3.16Å
1235	F	30.3	Very low	53.9	Low	171 Å²	171	99.6 Å²	99.6	75%	0.75	49%	0.49	S	S	*	.	G	3₁₀ helix	trans	-83.9	-8	175.8	-91.5	-81.1	0	0	0	115.2	D1232 D1233	D1232-F1235 PolarHBondContact O-N 2.76Å; D1232-F1235 VanDerWaalsContact O-N 3.15Å; D1233-F1235 PolarHBondContact O-N 2.73Å
1236	N	29.6	Very low	51.4	Low	132 Å²	132	107.1 Å²	107.1	71%	0.706	53%	0.527	S	S	*	.	S	Bend	trans	-109.7	-3.9	-172.3	-72.1	-39.3	0	0	0	115.7	D1233	D1233-N1236 PolarHBondContact O-N 2.92Å; D1233-N1236 VanDerWaalsContact O-N 3.16Å
1237	E	31.7	Very low	48.7	Very low	196 Å²	196	112.3 Å²	112.3	92%	0.916	55%	0.552	S	S	*	*			trans	-104.8	19.6	170.6	-71.8	-165.5	143.9	0	0	113
1238	L	26.2	Very low	45.4	Very low	213 Å²	213	116.3 Å²	116.3	100%	1.115	57%	0.569	S	S	*	*			trans	-117.6	0	170.6	-89.8	162.3	0	0	0	110.4

Retrieved 1,238 of 1,238 residues in 166.2 ms (Link to these results)

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