A0A087X248_HUMAN Loading...

[histone H3]-trimethyl-L-lysine(27) demethylase

AlphaFold DB , UniProt , Accession A0A087X248, Species HUMAN (Homo sapiens, Human), Gene UTY, Length 1,264 aa.

						>A0A087X248_HUMAN|A0A087X248|UTY
MKSCAVSLTTAAVAFGDEAKKMAEGKASRESEEESVSLTVEEREALGGMDSRLFGFVRLHEDGARTKTLLGKNAAFLYGLGLVYFYYNAFHWAIKAFQDVLYVDPSFCRAKEIHLRLGLMFKVNTDYKSSLKRKYHSAKEAYEQLLQTENLPAQVKATVLQQLGWMHHNMDLVGDKATKESYAIQYLQKSLEADPNSGQSWYFLGRCYSSIGKVQDAFISYRQSIDKSEASADTWCSIGVLYQQQNQPMDALQAYICAVQLDHGHAAAWMDLGTLYESCNQPQDAIKCYLNAARSKRCSNTSTLAARIKFLQNGSDNWNGGQSLSHHPVQQVYSLCLTPQKLQHLEQLRANRDNLNPAQKHQLEQLESQFVLMQQMRHKEVAQVRTTGIHNGAITDSSLPTNSVSNRQPHGALTRVSSVSQPGVRPACVEKLLSSGAFSAGCIPCGTSKILGSTDTILLGSNCIAGSESNGNVPYLQQNTHTLPHNHTDLNSSTEEPWRKQLSNSAQGLHKSQSSCLSGPNEEQPLFSTGSAQYHQATSTGIKKANEHLTLPSNSVPQGDADSHLSCHTATSGGQQGIMFTKESKPSKNRSLVPETSRHTGDTSNGCADVKGLSNHVHQLIADAVSSPNHGDSPNLLIADNPQLSALLIGKANGNVGTGTCDKVNNIHPAVHTKTDHSVASSPSSAISTATPSPKSTEQRSINSVTSLNSPHSGLHTVNGEGLGKSQSSTKVDLPLASHRSTSQILPSMSVSICPSSTEVLKACRNPGKNGLSNSCILLDKCPPPRPPTSPYPPLPKDKLNPPTPSIYLENKRDAFFPPLHQFCTNPKNPVTVIRGLAGALKLDLGLFSTKTLVEANNEHMVEVRTQLLQPADENWDPTGTKKIWRCESNRSHTTIAKYAQYQASSFQESLREENEKRTQHKDHSDNESTSSENSGRRRKGPFKTIKFGTNIDLSDNKKWKLQLHELTKLPAFARVVSAGNLLTHVGHTILGMNTVQLYMKVPGSRTPGHQENNNFCSVNINIGPGDCEWFVVPEDYWGVLNDFCEKNNLNFLMSSWWPNLEDLYEANVPVYRFIQRPGDLVWINAGTVHWVQAVGWCNNIAWNVGPLTACQYKLAVERYEWNKLKSVKSPVPMVHLSWNMARNIKVSDPKLFEMIKYCLLKILKQYQTLREALVAAGKEVIWHGRTNDEPAHYCSICEVEVFNLLFVTNESNTQKTYIVHCHDCARKTSKSLENFVVLEQYKMEDLIQVYDQFTLALSLSSSS
					

Structure Viewer

Loading PAE data...

(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	44.2	Very low	33.4	Very low	240 Å²	240	114.7 Å²	114.7	100%	1.182	68%	0.676	S	S	*	*				0	108	0	-67.5	166.5	171.3	0	0	109.1
2	K	29.1	Very low	33.5	Very low	205 Å²	205	111.5 Å²	111.5	89%	0.891	67%	0.672	S	S	*	*			trans	-170.5	-24.9	160.5	-114.4	173.4	-177	-177.7	0	114.5
3	S	27.9	Very low	33.5	Very low	103 Å²	103	111.2 Å²	111.2	72%	0.72	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.1	-26	177.7	48.1	0	0	0	0	115.1	A5	S3-A5 PolarHBondContact O-N 3.41Å; S3-A5 VanDerWaalsContact O-N 3.14Å
4	C	33.7	Very low	33.5	Very low	91 Å²	91	108.2 Å²	108.2	62%	0.615	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.8	-4.7	-173.3	-50.6	0	0	0	0	115	V6	C4-V6 VanDerWaalsContact C-N 3.28Å; C4-V6 PolarHBondContact O-N 3.37Å
5	A	33.1	Very low	33.7	Very low	71 Å²	71	112.1 Å²	112.1	59%	0.587	67%	0.668	S	S	*	*	H	α-helix	trans	-68.7	-23.6	-178.3	0	0	0	0	0	113.7	S3	S3-A5 PolarHBondContact O-N 3.41Å; S3-A5 VanDerWaalsContact O-N 3.14Å
6	V	31.9	Very low	33.5	Very low	104 Å²	104	107.4 Å²	107.4	63%	0.63	65%	0.65	S	S	*	*	H	α-helix	trans	-86.3	-22.3	-174.2	-173.8	0	0	0	0	112.8	C4 T9 T10	C4-V6 VanDerWaalsContact C-N 3.28Å; C4-V6 PolarHBondContact O-N 3.37Å; V6-T9 PolarHBondContact O-OG1 3.34Å; V6-T10 PolarHBondContact O-OG1 2.93Å
7	S	36.6	Very low	33.5	Very low	83 Å²	83	107.6 Å²	107.6	58%	0.58	65%	0.647	S	S	*	*	H	α-helix	trans	-80.8	-21.7	178.7	-59.6	0	0	0	0	113.9	T10 A11	S7-T10 WeakPolarHBondContact CA-OG1 3.38Å; S7-T10 PolarHBondContact O-OG1 3.08Å; S7-A11 WeakPolarHBondContact O-CB 3.23Å; S7-A11 PolarHBondContact O-N 3.43Å
8	L	33.8	Very low	33.6	Very low	135 Å²	135	110.1 Å²	110.1	71%	0.707	65%	0.65	S	S	*	*	H	α-helix	trans	-78.4	-35.9	-179.3	-86.3	157.8	0	0	0	112.7	A12	L8-A12 PolarHBondContact O-N 3.47Å
9	T	31.6	Very low	33.6	Very low	91 Å²	91	107.6 Å²	107.6	56%	0.558	64%	0.643	S	S	*	*	H	α-helix	trans	-70.9	-38.9	173.6	42.9	0	0	0	0	112.2	V6 A12 V13	V6-T9 PolarHBondContact O-OG1 3.34Å; T9-A12 PolarHBondContact O-N 2.94Å; T9-V13 WeakPolarHBondContact O-CG2 3.24Å; T9-V13 PolarHBondContact O-N 3.47Å
10	T	32.3	Very low	33.6	Very low	89 Å²	89	109.6 Å²	109.6	55%	0.546	64%	0.643	S	S	.	*	H	α-helix	trans	-68.9	-36.6	177.4	38.3	0	0	0	0	112.8	V6 S7 V13 A14	V6-T10 PolarHBondContact O-OG1 2.93Å; S7-T10 WeakPolarHBondContact CA-OG1 3.38Å; S7-T10 PolarHBondContact O-OG1 3.08Å; T10-V13 PolarHBondContact O-N 2.52Å; T10-A14 PolarHBondContact O-N 2.92Å
11	A	33.7	Very low	33.6	Very low	50 Å²	50	113.3 Å²	113.3	41%	0.413	65%	0.652	S	S	.	*	H	α-helix	trans	-63.6	-39.3	171.6	0	0	0	0	0	112.8	S7 V13 A14	S7-A11 WeakPolarHBondContact O-CB 3.23Å; S7-A11 PolarHBondContact O-N 3.43Å; A11-V13 VanDerWaalsContact C-N 3.35Å; A11-V13 PolarHBondContact O-N 2.97Å; A11-A14 PolarHBondContact O-N 3.23Å
12	A	33.7	Very low	33.1	Very low	76 Å²	76	110.6 Å²	110.6	63%	0.628	64%	0.638	S	S	*	*	H	α-helix	trans	-66.4	-33.2	178.6	0	0	0	0	0	113.3	L8 T9	L8-A12 PolarHBondContact O-N 3.47Å; T9-A12 PolarHBondContact O-N 2.94Å
13	V	34.5	Very low	33.2	Very low	107 Å²	107	104.6 Å²	104.6	65%	0.648	63%	0.627	S	S	*	*	H	α-helix	trans	-74.5	-41.6	176.5	174.5	0	0	0	0	111.5	T9 T10 A11 F15 G16	T9-V13 WeakPolarHBondContact O-CG2 3.24Å; T9-V13 PolarHBondContact O-N 3.47Å; T10-V13 PolarHBondContact O-N 2.52Å; A11-V13 VanDerWaalsContact C-N 3.35Å; A11-V13 PolarHBondContact O-N 2.97Å; V13-F15 VanDerWaalsContact C-N 3.32Å; V13-F15 PolarHBondContact O-N 3.4Å; V13-G16 PolarHBondContact O-N 3.48Å
14	A	33.2	Very low	33.3	Very low	70 Å²	70	108.3 Å²	108.3	58%	0.579	63%	0.633	S	S	*	*	H	α-helix	trans	-62.7	-32.8	-175.6	0	0	0	0	0	114.2	T10 A11 G16	T10-A14 PolarHBondContact O-N 2.92Å; A11-A14 PolarHBondContact O-N 3.23Å; A14-G16 VanDerWaalsContact C-N 3.3Å; A14-G16 PolarHBondContact O-N 3.02Å
15	F	35.7	Very low	32.9	Very low	166 Å²	166	107.7 Å²	107.7	73%	0.728	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	-7.9	175.5	-81.9	-76.8	0	0	0	114.2	V13	V13-F15 VanDerWaalsContact C-N 3.32Å; V13-F15 PolarHBondContact O-N 3.4Å
16	G	31.8	Very low	32.8	Very low	38 Å²	38	114.1 Å²	114.1	39%	0.392	66%	0.656	S	S	.	*	H	α-helix	trans	-69.9	-41.1	177.9	0	0	0	0	0	113.7	V13 A14 K20	V13-G16 PolarHBondContact O-N 3.48Å; A14-G16 VanDerWaalsContact C-N 3.3Å; A14-G16 PolarHBondContact O-N 3.02Å; G16-K20 PolarHBondContact O-N 3.48Å; G16-K20 VanDerWaalsContact O-N 3.15Å
17	D	32	Very low	32.6	Very low	110 Å²	110	113.9 Å²	113.9	59%	0.588	67%	0.665	S	S	*	*	H	α-helix	trans	-80.6	-25.3	-169.4	-83.3	-25.3	0	0	0	114.9	K21	D17-K21 PolarHBondContact O-N 3.45Å
18	E	35.9	Very low	32.2	Very low	152 Å²	152	114.9 Å²	114.9	71%	0.71	67%	0.672	S	S	*	*	H	α-helix	trans	-75.5	-39.3	171.5	-69.9	-146.3	129.7	0	0	111.9	K20 K21	E18-K20 PolarHBondContact O-N 2.9Å; E18-K21 PolarHBondContact O-N 2.85Å; E18-K21 VanDerWaalsContact O-N 3.13Å
19	A	33.2	Very low	32	Very low	63 Å²	63	118.2 Å²	118.2	52%	0.521	68%	0.675	S	S	.	*	H	α-helix	trans	-58.7	-39.1	171.9	0	0	0	0	0	111.3	K21 M22	A19-K21 VanDerWaalsContact C-N 3.25Å; A19-K21 PolarHBondContact O-N 3.27Å; A19-M22 PolarHBondContact O-N 3.47Å
20	K	33.3	Very low	32	Very low	147 Å²	147	120.7 Å²	120.7	64%	0.639	68%	0.681	S	S	*	*	H	α-helix	trans	-65	-22.5	177.9	-133	173.6	-176.4	-179.6	0	114.5	G16 E18	G16-K20 PolarHBondContact O-N 3.48Å; G16-K20 VanDerWaalsContact O-N 3.15Å; E18-K20 PolarHBondContact O-N 2.9Å
21	K	34.7	Very low	31.7	Very low	189 Å²	189	122.5 Å²	122.5	82%	0.822	70%	0.697	S	S	*	*	H	α-helix	trans	-83.7	-12.7	176.4	-78.3	-178.5	178	173.6	0	114.7	D17 E18 A19	D17-K21 PolarHBondContact O-N 3.45Å; E18-K21 PolarHBondContact O-N 2.85Å; E18-K21 VanDerWaalsContact O-N 3.13Å; A19-K21 VanDerWaalsContact C-N 3.25Å; A19-K21 PolarHBondContact O-N 3.27Å
22	M	32.5	Very low	31.5	Very low	183 Å²	183	129.6 Å²	129.6	90%	0.901	72%	0.721	S	S	*	*	S	Bend	trans	-103.1	-1.2	175.6	-65.6	-165.4	178.9	0	0	113.7	A19	A19-M22 PolarHBondContact O-N 3.47Å
23	A	32.8	Very low	31.3	Very low	78 Å²	78	134.3 Å²	134.3	65%	0.645	73%	0.73	S	S	*	*	S	Bend	trans	-133.7	45.8	-166	0	0	0	0	0	114.8
24	E	28.5	Very low	31	Very low	181 Å²	181	138.5 Å²	138.5	85%	0.846	74%	0.743	S	S	*	*			trans	-141.9	76.8	165.8	-136.8	169.5	-111.8	0	0	113
25	G	25.2	Very low	30.7	Very low	78 Å²	78	139.7 Å²	139.7	80%	0.804	75%	0.747	S	S	*	*			trans	-122.5	40.9	-176.5	0	0	0	0	0	114.7
26	K	31.8	Very low	30.4	Very low	207 Å²	207	137.6 Å²	137.6	90%	0.9	75%	0.748	S	S	*	*			trans	38.3	100.8	169.7	-72.4	-173.4	175.8	-179.7	0	119.3
27	A	27.8	Very low	30.5	Very low	98 Å²	98	140.6 Å²	140.6	81%	0.81	76%	0.762	S	S	*	*			trans	-179.4	147.2	134.6	0	0	0	0	0	109.2
28	S	28.4	Very low	31	Very low	104 Å²	104	137.7 Å²	137.7	73%	0.727	75%	0.747	S	S	*	*			cis	172.1	115.6	-33.9	44.9	0	0	0	0	106.3
29	R	30.1	Very low	31.3	Very low	206 Å²	206	133.9 Å²	133.9	78%	0.777	73%	0.734	S	S	*	*			trans	60.3	125.4	162.4	-65.8	-173.5	107.9	127.2	12.9	121.1
30	E	30.6	Very low	31.6	Very low	143 Å²	143	136 Å²	136	67%	0.668	74%	0.741	S	S	*	*				61.8	104	125.9	-61.5	156.7	-169.9	0	0	120.1
31	S	26.1	Very low	32	Very low	127 Å²	127	136.8 Å²	136.8	89%	0.888	75%	0.746	S	S	*	*			trans	-154.5	163.4	130.2	-51.5	0	0	0	0	109.2
32	E	29.3	Very low	32.3	Very low	198 Å²	198	131.8 Å²	131.8	93%	0.925	73%	0.726	S	S	*	*			trans	-88	172.4	-170.5	-65.8	169.5	119.3	0	0	114.3
33	E	30.2	Very low	32.8	Very low	175 Å²	175	129.9 Å²	129.9	82%	0.818	71%	0.709	S	S	*	*			trans	-73.2	132.9	179.1	-60.5	-176.8	103	0	0	112.7
34	E	27.7	Very low	33.2	Very low	195 Å²	195	133.4 Å²	133.4	91%	0.911	71%	0.712	S	S	*	*			trans	-105.9	121	156.9	-129	-176.8	-169.5	0	0	110.1	V36	E34-V36 PolarHBondContact O-N 3.27Å
35	S	26.5	Very low	33.8	Very low	96 Å²	96	128.9 Å²	128.9	67%	0.671	71%	0.705	S	S	*	*			trans	-96.3	87.1	-162.4	50.2	0	0	0	0	113.3	S37	S35-S37 PolarHBondContact O-N 3.05Å
36	V	30.5	Very low	34.5	Very low	121 Å²	121	128.2 Å²	128.2	73%	0.733	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-65.1	128.1	169.9	-175	0	0	0	0	110.4	E34 R65	E34-V36 PolarHBondContact O-N 3.27Å; V36-R65 PolarHBondContact O-NH2 3.43Å
37	S	33.5	Very low	34.7	Very low	101 Å²	101	121.9 Å²	121.9	71%	0.706	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-96.7	149.9	176	54.6	0	0	0	0	111.4	S35	S35-S37 PolarHBondContact O-N 3.05Å
38	L	42	Very low	35.2	Very low	49 Å²	49	120.7 Å²	120.7	26%	0.257	67%	0.673	S	S	.	*	P	Polyproline II helix	trans	-75.6	141.7	-178.8	-71.1	167	0	0	0	111.5	E42 A64	L38-E42 HydrophobicContact CD2-CB 4.29Å; L38-A64 HydrophobicContact CD1-CB 4Å
39	T	41.6	Very low	35.8	Very low	73 Å²	73	120.9 Å²	120.9	45%	0.448	66%	0.664	S	S	.	*	P	Polyproline II helix	trans	-71.5	165.8	175.6	63.5	0	0	0	0	112.1	E42 R43	T39-E42 WeakPolarHBondContact CB-OE2 3.21Å; T39-E42 PolarHBondContact N-OE2 3.27Å; T39-E42 PolarHBondContact O-N 3.39Å; T39-E42 VanDerWaalsContact OG1-CG 3.29Å; T39-E42 WeakPolarHBondContact OG1-CG 3.4Å; T39-E42 PolarHBondContact OG1-OE2 3.35Å; T39-R43 PolarHBondContact O-N 3.49Å
40	V	40.5	Very low	36.2	Very low	108 Å²	108	116.8 Å²	116.8	66%	0.655	66%	0.657	S	S	*	*	H	α-helix	trans	-64.9	-41.1	-179.9	-179.1	0	0	0	0	111.2	E42 R43 E44	V40-E42 VanDerWaalsContact C-N 3.35Å; V40-E42 PolarHBondContact O-N 3.25Å; V40-R43 WeakPolarHBondContact O-CB 3.35Å; V40-R43 PolarHBondContact O-N 3.17Å; V40-R43 VanDerWaalsContact O-N 3.11Å; V40-E44 PolarHBondContact O-N 2.95Å
41	E	40.7	Very low	36.8	Very low	162 Å²	162	115 Å²	115	76%	0.757	66%	0.661	S	S	*	*	H	α-helix	trans	-64.4	-37.8	179.6	-60.4	179.2	132.4	0	0	111.9	R43 E44 A45	E41-R43 VanDerWaalsContact C-N 3.32Å; E41-R43 PolarHBondContact O-N 2.76Å; E41-E44 PolarHBondContact O-N 3.24Å; E41-A45 WeakPolarHBondContact O-CB 3.49Å; E41-A45 PolarHBondContact O-N 2.98Å
42	E	41.3	Very low	37.4	Very low	85 Å²	85	119.2 Å²	119.2	40%	0.397	66%	0.657	S	S	.	*	H	α-helix	trans	-65.4	-33.4	173.1	-71.7	170.6	114.3	0	0	112.7	L38 T39 V40 L46	L38-E42 HydrophobicContact CD2-CB 4.29Å; T39-E42 WeakPolarHBondContact CB-OE2 3.21Å; T39-E42 PolarHBondContact N-OE2 3.27Å; T39-E42 PolarHBondContact O-N 3.39Å; T39-E42 VanDerWaalsContact OG1-CG 3.29Å; T39-E42 WeakPolarHBondContact OG1-CG 3.4Å; T39-E42 PolarHBondContact OG1-OE2 3.35Å; V40-E42 VanDerWaalsContact C-N 3.35Å; V40-E42 PolarHBondContact O-N 3.25Å; E42-L46 WeakPolarHBondContact O-CD1 3.28Å; E42-L46 WeakPolarHBondContact O-CG 3.47Å
43	R	43.7	Very low	38	Very low	143 Å²	143	116.2 Å²	116.2	54%	0.54	65%	0.647	S	S	.	*	H	α-helix	trans	-71.5	-40.6	174.7	-79.5	179.2	166.3	164.3	-4.3	112	T39 V40 E41 L46 E61	T39-R43 PolarHBondContact O-N 3.49Å; V40-R43 WeakPolarHBondContact O-CB 3.35Å; V40-R43 PolarHBondContact O-N 3.17Å; V40-R43 VanDerWaalsContact O-N 3.11Å; E41-R43 VanDerWaalsContact C-N 3.32Å; E41-R43 PolarHBondContact O-N 2.76Å; R43-L46 PolarHBondContact O-N 3.4Å; R43-E61 IonicContact CZ-OE1 2.68Å; R43-E61 IonicContact NH2-OE1 3.07Å; R43-E61 PolarHBondContact NH2-OE1 3.36Å
44	E	40.3	Very low	38.6	Very low	152 Å²	152	114.2 Å²	114.2	71%	0.71	64%	0.636	S	S	*	*	H	α-helix	trans	-67.6	-41.4	176.8	-68	-159.8	142.6	0	0	112.4	V40 E41 L46 G47	V40-E44 PolarHBondContact O-N 2.95Å; E41-E44 PolarHBondContact O-N 3.24Å; E44-L46 PolarHBondContact O-N 3.42Å; E44-L46 VanDerWaalsContact O-N 3.1Å; E44-G47 PolarHBondContact O-N 2.88Å
45	A	42.6	Very low	39.1	Very low	85 Å²	85	108 Å²	108	70%	0.702	62%	0.624	S	S	*	*	H	α-helix	trans	-59.3	-23.9	177.1	0	0	0	0	0	113.8	E41	E41-A45 WeakPolarHBondContact O-CB 3.49Å; E41-A45 PolarHBondContact O-N 2.98Å
46	L	40	Very low	39.6	Very low	65 Å²	65	112.1 Å²	112.1	34%	0.34	63%	0.63	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.8	-16.9	177.8	-76.9	168.2	0	0	0	114.3	E42 R43 E44 G48 A64 K67	E42-L46 WeakPolarHBondContact O-CD1 3.28Å; E42-L46 WeakPolarHBondContact O-CG 3.47Å; R43-L46 PolarHBondContact O-N 3.4Å; E44-L46 PolarHBondContact O-N 3.42Å; E44-L46 VanDerWaalsContact O-N 3.1Å; L46-G48 VanDerWaalsContact C-N 3.28Å; L46-G48 PolarHBondContact O-N 3.22Å; L46-A64 HydrophobicContact CD1-CB 4.12Å; L46-K67 HydrophobicContact CD2-CD 4.19Å
47	G	35	Very low	39.8	Very low	73 Å²	73	112.5 Å²	112.5	75%	0.753	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	-16.7	-176.3	0	0	0	0	0	115.4	E44 M49	E44-G47 PolarHBondContact O-N 2.88Å; G47-M49 PolarHBondContact O-N 2.95Å
48	G	39.3	Very low	40.1	Very low	73 Å²	73	118.7 Å²	118.7	75%	0.753	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.1	11.2	-170.1	0	0	0	0	0	117.3	L46	L46-G48 VanDerWaalsContact C-N 3.28Å; L46-G48 PolarHBondContact O-N 3.22Å
49	M	40.5	Very low	39.7	Very low	108 Å²	108	121.9 Å²	121.9	53%	0.532	66%	0.657	S	S	.	*	S	Bend	trans	-132.2	127.4	-175.6	-71.5	-173.7	166.9	0	0	113	G47 S51 W92	G47-M49 PolarHBondContact O-N 2.95Å; M49-S51 PolarHBondContact O-N 2.78Å; M49-W92 HydrophobicContact CE-CH2 3.98Å; M49-W92 HydrophobicContact CE-CZ3 3.84Å
50	D	37.8	Very low	39.8	Very low	120 Å²	120	127.3 Å²	127.3	64%	0.642	68%	0.677	S	S	*	*			trans	-63.5	119.2	-176.4	-170.7	-7.4	0	0	0	112.2	R52	D50-R52 VanDerWaalsContact C-N 3.26Å; D50-R52 PolarHBondContact O-N 2.61Å; D50-R52 VanDerWaalsContact OD1-CB 3.24Å; D50-R52 WeakPolarHBondContact OD1-CB 3.37Å; D50-R52 VanDerWaalsContact OD1-CD 3.32Å; D50-R52 WeakPolarHBondContact OD1-CD 3.37Å; D50-R52 WeakPolarHBondContact OD1-CG 3.17Å; D50-R52 PolarHBondContact OD1-N 2.82Å
51	S	43.5	Very low	39.8	Very low	105 Å²	105	128 Å²	128	73%	0.734	67%	0.673	S	S	*	*	G	3₁₀ helix	trans	-75.6	-8.4	-178.7	55	0	0	0	0	114.2	M49 L53	M49-S51 PolarHBondContact O-N 2.78Å; S51-L53 VanDerWaalsContact C-N 3.3Å; S51-L53 PolarHBondContact O-N 2.68Å
52	R	39.9	Very low	39.8	Very low	216 Å²	216	124.3 Å²	124.3	82%	0.815	66%	0.658	S	S	*	*	G	3₁₀ helix	trans	-71	-15.3	-171.1	-69.5	168.1	177.7	-173.6	-1.2	115.5	D50 F54	D50-R52 VanDerWaalsContact C-N 3.26Å; D50-R52 PolarHBondContact O-N 2.61Å; D50-R52 VanDerWaalsContact OD1-CB 3.24Å; D50-R52 WeakPolarHBondContact OD1-CB 3.37Å; D50-R52 VanDerWaalsContact OD1-CD 3.32Å; D50-R52 WeakPolarHBondContact OD1-CD 3.37Å; D50-R52 WeakPolarHBondContact OD1-CG 3.17Å; D50-R52 PolarHBondContact OD1-N 2.82Å; R52-F54 PolarHBondContact O-N 3.36Å
53	L	41.1	Very low	40	Very low	135 Å²	135	122.2 Å²	122.2	71%	0.707	66%	0.66	S	S	*	*	G	3₁₀ helix	trans	-75.8	-18.7	-174	-156	71.5	0	0	0	114.5	S51	S51-L53 VanDerWaalsContact C-N 3.3Å; S51-L53 PolarHBondContact O-N 2.68Å
54	F	43.8	Very low	40.1	Very low	133 Å²	133	116 Å²	116	58%	0.583	64%	0.638	S	S	*	*	S	Bend	trans	-124.1	1.8	-169.6	-74.8	-75.9	0	0	0	116.3	R52 F56	R52-F54 PolarHBondContact O-N 3.36Å; F54-F56 HydrophobicContact CB-CD2 3.8Å; F54-F56 HydrophobicContact CB-CE2 3.98Å; F54-F56 WeakPolarHBondContact O-CD2 3.32Å; F54-F56 PolarHBondContact O-N 3.14Å; F54-F56 VanDerWaalsContact O-N 3.08Å
55	G	36.8	Very low	40.2	Very low	64 Å²	64	113.6 Å²	113.6	66%	0.66	62%	0.623	S	S	*	*			trans	67.9	8.9	167.5	0	0	0	0	0	117.3	V57	G55-V57 VanDerWaalsContact C-N 3.32Å; G55-V57 PolarHBondContact O-N 3.25Å
56	F	36.6	Very low	40.4	Very low	183 Å²	183	113.2 Å²	113.2	80%	0.803	61%	0.612	S	S	*	*			trans	-72.5	80.1	178.2	-71.5	-72.9	0	0	0	112.4	F54 R58	F54-F56 HydrophobicContact CB-CD2 3.8Å; F54-F56 HydrophobicContact CB-CE2 3.98Å; F54-F56 WeakPolarHBondContact O-CD2 3.32Å; F54-F56 PolarHBondContact O-N 3.14Å; F54-F56 VanDerWaalsContact O-N 3.08Å; F56-R58 PolarHBondContact O-N 3.09Å
57	V	36.6	Very low	40.9	Very low	130 Å²	130	115.2 Å²	115.2	79%	0.788	62%	0.618	S	S	*	*			trans	-77.7	105	171.5	178.5	0	0	0	0	109.2	G55	G55-V57 VanDerWaalsContact C-N 3.32Å; G55-V57 PolarHBondContact O-N 3.25Å
58	R	38.2	Very low	41.8	Very low	231 Å²	231	114.5 Å²	114.5	87%	0.872	60%	0.599	S	S	*	*	S	Bend	trans	73.2	101.3	-178.6	-53.6	174.3	-179.1	-177	-0.3	115.5	F56	F56-R58 PolarHBondContact O-N 3.09Å
59	L	33.6	Very low	42.4	Very low	116 Å²	116	117.4 Å²	117.4	61%	0.607	60%	0.597	S	S	*	*			trans	-174.2	85.3	136	-101.7	171.3	0	0	0	107.8	E61 D62 G63	L59-E61 PolarHBondContact O-N 2.73Å; L59-D62 HydrophobicContact CD2-CB 4.24Å; L59-D62 WeakPolarHBondContact CD2-OD2 3.5Å; L59-G63 WeakPolarHBondContact O-CA 3.46Å; L59-G63 PolarHBondContact O-N 3.34Å; L59-G63 VanDerWaalsContact O-N 3.08Å
60	H	44.1	Very low	43.1	Very low	186 Å²	186	115.3 Å²	115.3	86%	0.861	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.3	-8.8	-160	-147.8	-67.7	0	0	0	115.1
61	E	39.8	Very low	44	Very low	124 Å²	124	111.2 Å²	111.2	58%	0.579	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.8	-45.3	175.5	-62	-162.1	115.8	0	0	112	R43 L59 G63 A64 R65	R43-E61 IonicContact CZ-OE1 2.68Å; R43-E61 IonicContact NH2-OE1 3.07Å; R43-E61 PolarHBondContact NH2-OE1 3.36Å; L59-E61 PolarHBondContact O-N 2.73Å; E61-G63 VanDerWaalsContact C-N 3.26Å; E61-G63 PolarHBondContact O-N 3.42Å; E61-A64 WeakPolarHBondContact O-CA 3.41Å; E61-A64 WeakPolarHBondContact O-CB 3.36Å; E61-A64 PolarHBondContact O-N 3.06Å; E61-R65 PolarHBondContact O-N 3.14Å
62	D	41.6	Very low	44.9	Very low	84 Å²	84	113.7 Å²	113.7	45%	0.449	57%	0.571	S	S	.	*	H	α-helix	trans	-60.8	-35.4	171.2	-69	-29	0	0	0	112.5	L59 A64 R65 T66	L59-D62 HydrophobicContact CD2-CB 4.24Å; L59-D62 WeakPolarHBondContact CD2-OD2 3.5Å; D62-A64 PolarHBondContact O-N 2.97Å; D62-R65 PolarHBondContact O-N 3.44Å; D62-T66 WeakPolarHBondContact O-CB 3.47Å; D62-T66 PolarHBondContact O-N 3.17Å; D62-T66 PolarHBondContact O-OG1 3.43Å
63	G	46.2	Very low	46.8	Very low	41 Å²	41	107.1 Å²	107.1	42%	0.423	55%	0.552	S	S	.	*	H	α-helix	trans	-60.7	-33.1	172.5	0	0	0	0	0	112.6	L59 E61 K67	L59-G63 WeakPolarHBondContact O-CA 3.46Å; L59-G63 PolarHBondContact O-N 3.34Å; L59-G63 VanDerWaalsContact O-N 3.08Å; E61-G63 VanDerWaalsContact C-N 3.26Å; E61-G63 PolarHBondContact O-N 3.42Å; G63-K67 WeakPolarHBondContact O-CB 3.33Å; G63-K67 PolarHBondContact O-N 3.04Å; G63-K67 VanDerWaalsContact O-N 3.1Å
64	A	45.1	Very low	48.5	Very low	11 Å²	11	101.2 Å²	101.2	9%	0.091	52%	0.522	C	S	.	.	H	α-helix	trans	-76.2	-49.1	175.4	0	0	0	0	0	111.6	L38 L46 E61 D62 T66 K67 T68	L38-A64 HydrophobicContact CD1-CB 4Å; L46-A64 HydrophobicContact CD1-CB 4.12Å; E61-A64 WeakPolarHBondContact O-CA 3.41Å; E61-A64 WeakPolarHBondContact O-CB 3.36Å; E61-A64 PolarHBondContact O-N 3.06Å; D62-A64 PolarHBondContact O-N 2.97Å; A64-T66 PolarHBondContact O-N 3.18Å; A64-K67 PolarHBondContact O-N 3.31Å; A64-T68 PolarHBondContact O-N 2.84Å; A64-T68 PolarHBondContact O-OG1 3.32Å
65	R	43.2	Very low	50.1	Low	102 Å²	102	97.6 Å²	97.6	39%	0.385	52%	0.518	S	S	.	.	H	α-helix	trans	-56.7	-46.8	175.1	-82.2	-177.3	165.6	-174.3	-4	112	V36 E61 D62 T68 L69	V36-R65 PolarHBondContact O-NH2 3.43Å; E61-R65 PolarHBondContact O-N 3.14Å; D62-R65 PolarHBondContact O-N 3.44Å; R65-T68 PolarHBondContact O-N 3.16Å; R65-L69 PolarHBondContact O-N 2.92Å
66	T	46.3	Very low	52.2	Low	77 Å²	77	98.9 Å²	98.9	47%	0.472	51%	0.505	S	S	.	.	H	α-helix	trans	-66.3	-40.5	179.5	-50.4	0	0	0	0	111.6	D62 A64 T68 L69 L70	D62-T66 WeakPolarHBondContact O-CB 3.47Å; D62-T66 PolarHBondContact O-N 3.17Å; D62-T66 PolarHBondContact O-OG1 3.43Å; A64-T66 PolarHBondContact O-N 3.18Å; T66-T68 VanDerWaalsContact C-N 3.31Å; T66-T68 PolarHBondContact O-N 2.91Å; T66-L69 PolarHBondContact O-N 3.4Å; T66-L70 HydrophobicContact CG2-CD1 3.93Å; T66-L70 HydrophobicContact CG2-CG 4.35Å; T66-L70 WeakPolarHBondContact O-CB 3.41Å; T66-L70 VanDerWaalsContact O-CG 3.28Å; T66-L70 WeakPolarHBondContact O-CG 3.49Å; T66-L70 PolarHBondContact O-N 3.26Å
67	K	49.3	Very low	54.2	Low	107 Å²	107	90.7 Å²	90.7	47%	0.465	47%	0.47	S	S	.	.	H	α-helix	trans	-61.6	-37.2	172.9	-178.2	-179.2	-179.8	-173.9	0	111.9	L46 G63 A64 G71	L46-K67 HydrophobicContact CD2-CD 4.19Å; G63-K67 WeakPolarHBondContact O-CB 3.33Å; G63-K67 PolarHBondContact O-N 3.04Å; G63-K67 VanDerWaalsContact O-N 3.1Å; A64-K67 PolarHBondContact O-N 3.31Å; K67-G71 PolarHBondContact O-N 3.25Å
68	T	54.3	Low	56.4	Low	59 Å²	59	85.4 Å²	85.4	36%	0.362	44%	0.435	S	S	.	.	H	α-helix	trans	-72.8	-36.3	176.5	-58	0	0	0	0	112.8	A64 R65 T66 K72	A64-T68 PolarHBondContact O-N 2.84Å; A64-T68 PolarHBondContact O-OG1 3.32Å; R65-T68 PolarHBondContact O-N 3.16Å; T66-T68 VanDerWaalsContact C-N 3.31Å; T66-T68 PolarHBondContact O-N 2.91Å; T68-K72 PolarHBondContact O-N 2.75Å
69	L	52.3	Low	58	Low	133 Å²	133	75.9 Å²	75.9	70%	0.696	41%	0.409	S	S	*	.	H	α-helix	trans	-66.6	-48.8	171.1	-102.6	78.5	0	0	0	111.8	R65 T66 G71 K72 N73	R65-L69 PolarHBondContact O-N 2.92Å; T66-L69 PolarHBondContact O-N 3.4Å; L69-G71 VanDerWaalsContact C-N 3.29Å; L69-G71 PolarHBondContact O-N 3.44Å; L69-K72 PolarHBondContact O-N 3.49Å; L69-N73 PolarHBondContact O-N 3.46Å
70	L	55.4	Low	60.1	Low	64 Å²	64	72.4 Å²	72.4	34%	0.335	39%	0.391	S	S	.	.	H	α-helix	trans	-62.9	-36.2	178.5	-72.4	171.3	0	0	0	111.9	T66 K72 N73 F76	T66-L70 HydrophobicContact CG2-CD1 3.93Å; T66-L70 HydrophobicContact CG2-CG 4.35Å; T66-L70 WeakPolarHBondContact O-CB 3.41Å; T66-L70 VanDerWaalsContact O-CG 3.28Å; T66-L70 WeakPolarHBondContact O-CG 3.49Å; T66-L70 PolarHBondContact O-N 3.26Å; L70-K72 PolarHBondContact O-N 3.03Å; L70-N73 PolarHBondContact O-N 2.92Å; L70-F76 HydrophobicContact CB-CD1 3.79Å; L70-F76 HydrophobicContact CB-CE1 3.82Å; L70-F76 HydrophobicContact CB-CG 4.33Å; L70-F76 HydrophobicContact CB-CZ 4.37Å; L70-F76 HydrophobicContact CD1-CE1 4.41Å; L70-F76 HydrophobicContact CD1-CE2 4.4Å; L70-F76 HydrophobicContact CD1-CZ 4.15Å; L70-F76 HydrophobicContact CD2-CB 4.43Å; L70-F76 HydrophobicContact CD2-CD1 4.22Å; L70-F76 HydrophobicContact CD2-CD2 3.86Å; L70-F76 HydrophobicContact CD2-CE1 4.48Å; L70-F76 HydrophobicContact CD2-CE2 4.14Å; L70-F76 HydrophobicContact CD2-CG 3.9Å; L70-F76 HydrophobicContact CD2-CZ 4.45Å; L70-F76 HydrophobicContact CG-CE1 4.47Å
71	G	56.7	Low	61.8	Low	34 Å²	34	63.6 Å²	63.6	35%	0.351	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-6.8	172.5	0	0	0	0	0	115.2	K67 L69	K67-G71 PolarHBondContact O-N 3.25Å; L69-G71 VanDerWaalsContact C-N 3.29Å; L69-G71 PolarHBondContact O-N 3.44Å
72	K	62.8	Low	63.5	Low	158 Å²	158	59.2 Å²	59.2	69%	0.687	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.9	5.9	170.5	-68.3	-179.5	-179.9	-177.9	0	112.9	T68 L69 L70 V103	T68-K72 PolarHBondContact O-N 2.75Å; L69-K72 PolarHBondContact O-N 3.49Å; L70-K72 PolarHBondContact O-N 3.03Å; K72-V103 WeakPolarHBondContact O-CG1 3.44Å
73	N	78.8	Confident	65.1	Low	77 Å²	77	58.7 Å²	58.7	41%	0.412	33%	0.331	S	S	.	.			trans	-103.1	105.8	177.7	-174.2	-47.8	0	0	0	110.6	L69 L70 A75 F76 L77	L69-N73 PolarHBondContact O-N 3.46Å; L70-N73 PolarHBondContact O-N 2.92Å; N73-A75 VanDerWaalsContact C-N 3.28Å; N73-A75 PolarHBondContact O-N 3.09Å; N73-A75 WeakPolarHBondContact OD1-CB 3.35Å; N73-A75 PolarHBondContact OD1-N 3.45Å; N73-F76 HydrophobicContact CB-CB 4.01Å; N73-F76 PolarHBondContact O-N 3.26Å; N73-F76 VanDerWaalsContact O-N 3.14Å; N73-F76 PolarHBondContact OD1-N 3.36Å; N73-L77 PolarHBondContact O-N 3.24Å
74	A	76.7	Confident	66.5	Low	11 Å²	11	59.4 Å²	59.4	9%	0.091	32%	0.321	C	S	.	.	H	α-helix	trans	-56.6	-36.7	-179.3	0	0	0	0	0	113.6	Y78 V100 V103 D104 F107	A74-Y78 WeakPolarHBondContact O-CB 3.33Å; A74-Y78 PolarHBondContact O-N 2.7Å; A74-V100 HydrophobicContact CB-CG1 4.21Å; A74-V103 HydrophobicContact CB-CG1 4.44Å; A74-D104 HydrophobicContact CB-CB 3.62Å; A74-F107 HydrophobicContact CB-CD2 3.75Å; A74-F107 HydrophobicContact CB-CE2 4.08Å; A74-F107 HydrophobicContact CB-CG 4.49Å
75	A	78.3	Confident	67.7	Low	58 Å²	58	60.9 Å²	60.9	48%	0.479	33%	0.325	S	S	.	.	H	α-helix	trans	-70.3	-37.3	177.9	0	0	0	0	0	112.5	N73 G79 F107	N73-A75 VanDerWaalsContact C-N 3.28Å; N73-A75 PolarHBondContact O-N 3.09Å; N73-A75 WeakPolarHBondContact OD1-CB 3.35Å; N73-A75 PolarHBondContact OD1-N 3.45Å; A75-G79 PolarHBondContact O-N 3.29Å; A75-F107 HydrophobicContact CB-CE2 4.15Å; A75-F107 HydrophobicContact CB-CZ 4.43Å
76	F	81.1	Confident	68.8	Low	91 Å²	91	64 Å²	64	40%	0.399	34%	0.338	S	S	.	.	H	α-helix	trans	-67.6	-48.6	173.7	177.9	-96.9	0	0	0	111.8	L70 N73 Y78 G79 L80	L70-F76 HydrophobicContact CB-CD1 3.79Å; L70-F76 HydrophobicContact CB-CE1 3.82Å; L70-F76 HydrophobicContact CB-CG 4.33Å; L70-F76 HydrophobicContact CB-CZ 4.37Å; L70-F76 HydrophobicContact CD1-CE1 4.41Å; L70-F76 HydrophobicContact CD1-CE2 4.4Å; L70-F76 HydrophobicContact CD1-CZ 4.15Å; L70-F76 HydrophobicContact CD2-CB 4.43Å; L70-F76 HydrophobicContact CD2-CD1 4.22Å; L70-F76 HydrophobicContact CD2-CD2 3.86Å; L70-F76 HydrophobicContact CD2-CE1 4.48Å; L70-F76 HydrophobicContact CD2-CE2 4.14Å; L70-F76 HydrophobicContact CD2-CG 3.9Å; L70-F76 HydrophobicContact CD2-CZ 4.45Å; L70-F76 HydrophobicContact CG-CE1 4.47Å; N73-F76 HydrophobicContact CB-CB 4.01Å; N73-F76 PolarHBondContact O-N 3.26Å; N73-F76 VanDerWaalsContact O-N 3.14Å; N73-F76 PolarHBondContact OD1-N 3.36Å; F76-Y78 PolarHBondContact O-N 3.05Å; F76-G79 PolarHBondContact O-N 3.01Å; F76-G79 VanDerWaalsContact O-N 3.16Å; F76-L80 HydrophobicContact CE1-CD2 4.33Å; F76-L80 WeakPolarHBondContact O-CB 3.23Å; F76-L80 PolarHBondContact O-N 3.01Å
77	L	78.4	Confident	69.8	Low	11 Å²	11	69.3 Å²	69.3	6%	0.058	35%	0.351	C	S	.	.	H	α-helix	trans	-58.2	-37.6	175.6	-72.8	173.9	0	0	0	111.7	N73 L80 G81 D99 V100 V103	N73-L77 PolarHBondContact O-N 3.24Å; L77-L80 PolarHBondContact O-N 3.4Å; L77-G81 PolarHBondContact O-N 2.88Å; L77-D99 HydrophobicContact CD1-CB 4.01Å; L77-D99 HydrophobicContact CD2-CB 4.4Å; L77-V100 VanDerWaalsContact C-CG2 3.47Å; L77-V100 HydrophobicContact CB-CG2 3.48Å; L77-V100 VanDerWaalsContact CB-CG2 3.48Å; L77-V103 HydrophobicContact CD1-CG2 4.16Å
78	Y	81.9	Confident	70.7	Confident	18 Å²	18	69.7 Å²	69.7	7%	0.071	36%	0.358	C	S	.	.	H	α-helix	trans	-65.7	-45.4	175.1	172.3	-103	0	0	0	112.3	A74 F76 L80 G81 L82 F97 F107 R109 E112 I113	A74-Y78 WeakPolarHBondContact O-CB 3.33Å; A74-Y78 PolarHBondContact O-N 2.7Å; F76-Y78 PolarHBondContact O-N 3.05Å; Y78-L80 VanDerWaalsContact C-N 3.33Å; Y78-L80 PolarHBondContact O-N 3.24Å; Y78-G81 PolarHBondContact O-N 2.77Å; Y78-L82 HydrophobicContact CD1-CD1 4.11Å; Y78-L82 HydrophobicContact CE1-CD1 3.41Å; Y78-L82 VanDerWaalsContact CE1-CD1 3.41Å; Y78-L82 HydrophobicContact CE1-CG 4.16Å; Y78-L82 HydrophobicContact CE2-CD1 4.34Å; Y78-L82 HydrophobicContact CE2-CG 4.24Å; Y78-L82 WeakPolarHBondContact O-CG 3.34Å; Y78-L82 PolarHBondContact O-N 2.88Å; Y78-F97 HydrophobicContact CD2-CD1 4.23Å; Y78-F97 AromaticContact CD2-CE1 3.71Å; Y78-F97 HydrophobicContact CD2-CE1 3.71Å; Y78-F97 AromaticContact CE2-CE1 3.93Å; Y78-F97 HydrophobicContact CE2-CE1 3.93Å; Y78-F107 AromaticContact CD1-CE1 3.99Å; Y78-F107 HydrophobicContact CD1-CE1 3.99Å; Y78-F107 HydrophobicContact CD1-CZ 4.04Å; Y78-F107 AromaticContact CD2-CE1 3.78Å; Y78-F107 HydrophobicContact CD2-CE1 3.78Å; Y78-F107 HydrophobicContact CE2-CE1 4.45Å; Y78-F107 AromaticContact CG-CE1 3.53Å; Y78-F107 HydrophobicContact CG-CE1 3.53Å; Y78-F107 AromaticContact CG-CZ 3.84Å; Y78-F107 HydrophobicContact CG-CZ 3.84Å; Y78-R109 VanDerWaalsContact CE1-CD 3.5Å; Y78-R109 HydrophobicContact CE2-CB 4.2Å; Y78-R109 VanDerWaalsContact OH-CD 3.29Å; Y78-R109 WeakPolarHBondContact OH-CD 3.47Å; Y78-R109 PolarHBondContact OH-NH1 3.29Å; Y78-E112 PolarHBondContact OH-OE1 2.64Å; Y78-E112 VanDerWaalsContact OH-OE1 3.13Å; Y78-E112 PolarHBondContact OH-OE2 3.26Å; Y78-I113 HydrophobicContact CD2-CD1 3.6Å; Y78-I113 HydrophobicContact CD2-CG1 3.66Å; Y78-I113 HydrophobicContact CE2-CD1 4.19Å; Y78-I113 HydrophobicContact CE2-CG1 3.76Å
79	G	72.1	Confident	71.6	Confident	31 Å²	31	68.3 Å²	68.3	32%	0.32	35%	0.353	S	S	.	.	H	α-helix	trans	-60.2	-41.5	173.4	0	0	0	0	0	112.5	A75 F76 L82 V83	A75-G79 PolarHBondContact O-N 3.29Å; F76-G79 PolarHBondContact O-N 3.01Å; F76-G79 VanDerWaalsContact O-N 3.16Å; G79-L82 WeakPolarHBondContact O-CB 3.21Å; G79-L82 PolarHBondContact O-N 2.69Å; G79-V83 WeakPolarHBondContact O-CG2 3.45Å; G79-V83 PolarHBondContact O-N 3.38Å
80	L	77	Confident	72.5	Confident	44 Å²	44	63.7 Å²	63.7	23%	0.23	33%	0.327	C	S	.	.	H	α-helix	trans	-65.4	-42.4	176.1	-176.8	62.8	0	0	0	112	F76 L77 Y78 L82 V83 Y84	F76-L80 HydrophobicContact CE1-CD2 4.33Å; F76-L80 WeakPolarHBondContact O-CB 3.23Å; F76-L80 PolarHBondContact O-N 3.01Å; L77-L80 PolarHBondContact O-N 3.4Å; Y78-L80 VanDerWaalsContact C-N 3.33Å; Y78-L80 PolarHBondContact O-N 3.24Å; L80-L82 PolarHBondContact O-N 3.01Å; L80-V83 PolarHBondContact O-N 2.94Å; L80-Y84 HydrophobicContact CD1-CD2 4.22Å; L80-Y84 HydrophobicContact CD1-CE1 4.43Å; L80-Y84 HydrophobicContact CD1-CE2 3.62Å; L80-Y84 HydrophobicContact CD2-CE2 3.97Å; L80-Y84 HydrophobicContact CG-CD2 3.98Å; L80-Y84 HydrophobicContact CG-CE2 3.51Å; L80-Y84 WeakPolarHBondContact O-CD2 3.34Å; L80-Y84 PolarHBondContact O-N 3.1Å
81	G	79.8	Confident	72.8	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-60.6	-41.4	173.4	0	0	0	0	0	112.7	L77 Y78 Y84 F85 F97	L77-G81 PolarHBondContact O-N 2.88Å; Y78-G81 PolarHBondContact O-N 2.77Å; G81-Y84 PolarHBondContact O-N 3.26Å; G81-F85 VanDerWaalsContact O-CB 3.3Å; G81-F85 WeakPolarHBondContact O-CB 2.57Å; G81-F85 PolarHBondContact O-N 3.34Å; G81-F97 WeakPolarHBondContact O-CE2 3.43Å; G81-F97 WeakPolarHBondContact O-CZ 3.29Å
82	L	76.4	Confident	73.3	Confident	32 Å²	32	70.5 Å²	70.5	17%	0.168	34%	0.343	C	S	.	.	H	α-helix	trans	-61.3	-46.5	172.1	-76.1	174.9	0	0	0	112	Y78 G79 L80 F85 Y86 F97	Y78-L82 HydrophobicContact CD1-CD1 4.11Å; Y78-L82 HydrophobicContact CE1-CD1 3.41Å; Y78-L82 VanDerWaalsContact CE1-CD1 3.41Å; Y78-L82 HydrophobicContact CE1-CG 4.16Å; Y78-L82 HydrophobicContact CE2-CD1 4.34Å; Y78-L82 HydrophobicContact CE2-CG 4.24Å; Y78-L82 WeakPolarHBondContact O-CG 3.34Å; Y78-L82 PolarHBondContact O-N 2.88Å; G79-L82 WeakPolarHBondContact O-CB 3.21Å; G79-L82 PolarHBondContact O-N 2.69Å; L80-L82 PolarHBondContact O-N 3.01Å; L82-F85 WeakPolarHBondContact O-CB 3.43Å; L82-F85 PolarHBondContact O-N 2.83Å; L82-Y86 HydrophobicContact CD2-CE2 4.5Å; L82-Y86 WeakPolarHBondContact O-CD2 3.17Å; L82-Y86 PolarHBondContact O-N 2.85Å; L82-F97 HydrophobicContact CD2-CZ 4.15Å; L82-F97 HydrophobicContact CG-CE1 4.46Å; L82-F97 HydrophobicContact CG-CZ 4.2Å
83	V	73.9	Confident	74	Confident	74 Å²	74	63 Å²	63	45%	0.448	31%	0.31	S	S	.	.	H	α-helix	trans	-59	-49.6	177.8	169.1	0	0	0	0	110.7	G79 L80 F85 Y86 Y87	G79-V83 WeakPolarHBondContact O-CG2 3.45Å; G79-V83 PolarHBondContact O-N 3.38Å; L80-V83 PolarHBondContact O-N 2.94Å; V83-F85 VanDerWaalsContact C-N 3.29Å; V83-F85 PolarHBondContact O-N 3.22Å; V83-Y86 PolarHBondContact O-N 2.85Å; V83-Y87 HydrophobicContact CG1-CD2 3.93Å; V83-Y87 HydrophobicContact CG1-CE2 4.07Å; V83-Y87 VanDerWaalsContact O-CD2 3.3Å; V83-Y87 WeakPolarHBondContact O-CD2 3.41Å; V83-Y87 PolarHBondContact O-N 2.93Å; V83-Y87 VanDerWaalsContact O-N 3.13Å
84	Y	75.9	Confident	73.7	Confident	55 Å²	55	60 Å²	60	22%	0.216	29%	0.294	C	S	.	.	H	α-helix	trans	-62.3	-35.1	176.4	-68.7	-43.1	0	0	0	112.8	L80 G81 Y87 N88 A89 W92 A96	L80-Y84 HydrophobicContact CD1-CD2 4.22Å; L80-Y84 HydrophobicContact CD1-CE1 4.43Å; L80-Y84 HydrophobicContact CD1-CE2 3.62Å; L80-Y84 HydrophobicContact CD2-CE2 3.97Å; L80-Y84 HydrophobicContact CG-CD2 3.98Å; L80-Y84 HydrophobicContact CG-CE2 3.51Å; L80-Y84 WeakPolarHBondContact O-CD2 3.34Å; L80-Y84 PolarHBondContact O-N 3.1Å; G81-Y84 PolarHBondContact O-N 3.26Å; Y84-Y87 PolarHBondContact O-N 3.36Å; Y84-N88 PolarHBondContact O-N 3.45Å; Y84-A89 HydrophobicContact CD1-CB 4.14Å; Y84-A89 HydrophobicContact CG-CB 4.49Å; Y84-A89 WeakPolarHBondContact O-CB 3.23Å; Y84-A89 PolarHBondContact O-N 2.91Å; Y84-W92 HydrophobicContact CD1-CB 4.04Å; Y84-W92 HydrophobicContact CD2-CB 3.6Å; Y84-W92 HydrophobicContact CE1-CB 4.21Å; Y84-W92 HydrophobicContact CE2-CB 3.77Å; Y84-W92 HydrophobicContact CG-CB 3.75Å; Y84-A96 HydrophobicContact CD2-CB 4.33Å
85	F	71.2	Confident	73.5	Confident	43 Å²	43	64.2 Å²	64.2	19%	0.189	31%	0.31	C	S	.	.	H	α-helix	trans	-63.2	-47	174.8	-177.6	-81.7	0	0	0	111.6	G81 L82 V83 Y87 N88 A93 F97 R116 M120	G81-F85 VanDerWaalsContact O-CB 3.3Å; G81-F85 WeakPolarHBondContact O-CB 2.57Å; G81-F85 PolarHBondContact O-N 3.34Å; L82-F85 WeakPolarHBondContact O-CB 3.43Å; L82-F85 PolarHBondContact O-N 2.83Å; V83-F85 VanDerWaalsContact C-N 3.29Å; V83-F85 PolarHBondContact O-N 3.22Å; F85-Y87 VanDerWaalsContact C-N 3.29Å; F85-Y87 PolarHBondContact O-N 3.31Å; F85-N88 PolarHBondContact O-N 3.3Å; F85-N88 VanDerWaalsContact O-N 3.1Å; F85-A93 HydrophobicContact CB-CB 4.25Å; F85-F97 HydrophobicContact CB-CE2 4.19Å; F85-F97 HydrophobicContact CD2-CE2 4.39Å; F85-R116 VanDerWaalsContact CD1-NH1 3.35Å; F85-R116 HydrophobicContact CD2-CB 4.28Å; F85-R116 HydrophobicContact CD2-CG 4.46Å; F85-R116 VanDerWaalsContact CE1-NH1 3.29Å; F85-R116 HydrophobicContact CE2-CB 4.04Å; F85-R116 HydrophobicContact CE2-CG 4.1Å; F85-R116 HydrophobicContact CZ-CG 4.44Å; F85-M120 HydrophobicContact CD2-CE 4.33Å; F85-M120 HydrophobicContact CD2-CG 3.9Å; F85-M120 HydrophobicContact CD2-SD 3.7Å; F85-M120 HydrophobicContact CE2-CG 3.92Å; F85-M120 HydrophobicContact CE2-SD 4.32Å
86	Y	65.1	Low	73.4	Confident	167 Å²	167	61.6 Å²	61.6	66%	0.655	29%	0.289	S	S	*	.	H	α-helix	trans	-65.7	-28.5	179	-80.7	-67.5	0	0	0	113.7	L82 V83 N88	L82-Y86 HydrophobicContact CD2-CE2 4.5Å; L82-Y86 WeakPolarHBondContact O-CD2 3.17Å; L82-Y86 PolarHBondContact O-N 2.85Å; V83-Y86 PolarHBondContact O-N 2.85Å; Y86-N88 VanDerWaalsContact C-N 3.33Å
87	Y	68.4	Low	73.2	Confident	188 Å²	188	57.3 Å²	57.3	74%	0.737	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	13.7	173.5	-72.1	-69.1	0	0	0	114.1	V83 Y84 F85 A89	V83-Y87 HydrophobicContact CG1-CD2 3.93Å; V83-Y87 HydrophobicContact CG1-CE2 4.07Å; V83-Y87 VanDerWaalsContact O-CD2 3.3Å; V83-Y87 WeakPolarHBondContact O-CD2 3.41Å; V83-Y87 PolarHBondContact O-N 2.93Å; V83-Y87 VanDerWaalsContact O-N 3.13Å; Y84-Y87 PolarHBondContact O-N 3.36Å; F85-Y87 VanDerWaalsContact C-N 3.29Å; F85-Y87 PolarHBondContact O-N 3.31Å; Y87-A89 PolarHBondContact O-N 3.48Å; Y87-A89 VanDerWaalsContact O-N 3.09Å
88	N	68.9	Low	72.9	Confident	116 Å²	116	61.4 Å²	61.4	62%	0.62	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.2	20.3	-177	-60.9	-45.4	0	0	0	114.8	Y84 F85 Y86 F90	Y84-N88 PolarHBondContact O-N 3.45Å; F85-N88 PolarHBondContact O-N 3.3Å; F85-N88 VanDerWaalsContact O-N 3.1Å; Y86-N88 VanDerWaalsContact C-N 3.33Å; N88-F90 HydrophobicContact CB-CE1 4.26Å; N88-F90 HydrophobicContact CB-CE2 4.11Å; N88-F90 HydrophobicContact CB-CZ 3.84Å; N88-F90 PolarHBondContact O-N 3Å; N88-F90 VanDerWaalsContact OD1-CZ 3.26Å; N88-F90 WeakPolarHBondContact OD1-CZ 3.35Å
89	A	73	Confident	72.6	Confident	30 Å²	30	63.2 Å²	63.2	25%	0.248	30%	0.3	C	S	.	.			trans	-80.7	53.2	179.9	0	0	0	0	0	110.9	Y84 Y87 H91 W92 A93	Y84-A89 HydrophobicContact CD1-CB 4.14Å; Y84-A89 HydrophobicContact CG-CB 4.49Å; Y84-A89 WeakPolarHBondContact O-CB 3.23Å; Y84-A89 PolarHBondContact O-N 2.91Å; Y87-A89 PolarHBondContact O-N 3.48Å; Y87-A89 VanDerWaalsContact O-N 3.09Å; A89-H91 VanDerWaalsContact C-N 3.26Å; A89-H91 PolarHBondContact O-N 3.29Å; A89-W92 PolarHBondContact O-N 2.94Å; A89-A93 PolarHBondContact O-N 3.37Å
90	F	71.1	Confident	73	Confident	36 Å²	36	61.8 Å²	61.8	16%	0.158	29%	0.285	C	S	.	.	H	α-helix	trans	-57.3	-30.9	-162.2	-58.4	-47.3	0	0	0	114.6	N88 W92 A93 I94 M120 V123	N88-F90 HydrophobicContact CB-CE1 4.26Å; N88-F90 HydrophobicContact CB-CE2 4.11Å; N88-F90 HydrophobicContact CB-CZ 3.84Å; N88-F90 PolarHBondContact O-N 3Å; N88-F90 VanDerWaalsContact OD1-CZ 3.26Å; N88-F90 WeakPolarHBondContact OD1-CZ 3.35Å; F90-W92 PolarHBondContact O-N 3.45Å; F90-A93 PolarHBondContact O-N 3.07Å; F90-I94 VanDerWaalsContact O-CB 3.26Å; F90-I94 WeakPolarHBondContact O-CB 3.46Å; F90-I94 WeakPolarHBondContact O-CD1 3.04Å; F90-I94 WeakPolarHBondContact O-CG1 3.3Å; F90-I94 PolarHBondContact O-N 3.5Å; F90-M120 HydrophobicContact CB-CB 4.46Å; F90-M120 HydrophobicContact CB-CG 4.37Å; F90-M120 HydrophobicContact CB-SD 4.17Å; F90-M120 HydrophobicContact CD1-CB 4.46Å; F90-M120 HydrophobicContact CD1-CG 3.64Å; F90-M120 HydrophobicContact CD1-SD 3.72Å; F90-M120 HydrophobicContact CE1-CG 4.25Å; F90-M120 HydrophobicContact CG-CG 4.21Å; F90-M120 HydrophobicContact CG-SD 4.35Å; F90-V123 HydrophobicContact CD2-CG1 4.16Å; F90-V123 HydrophobicContact CE2-CG1 3.64Å; F90-V123 HydrophobicContact CZ-CG1 4.3Å
91	H	61.5	Low	72.7	Confident	122 Å²	122	61 Å²	61	57%	0.565	28%	0.281	S	S	*	.	H	α-helix	trans	-61.6	-43.4	174.8	-171.7	-91.3	0	0	0	112.4	A89 K95	A89-H91 VanDerWaalsContact C-N 3.26Å; A89-H91 PolarHBondContact O-N 3.29Å; H91-K95 PolarHBondContact O-N 3.09Å
92	W	67.7	Low	72.2	Confident	118 Å²	118	70.7 Å²	70.7	45%	0.447	32%	0.319	S	S	.	.	H	α-helix	trans	-77.9	-35	178.6	-59	115.7	0	0	0	112.1	M49 Y84 A89 F90 K95 A96	M49-W92 HydrophobicContact CE-CH2 3.98Å; M49-W92 HydrophobicContact CE-CZ3 3.84Å; Y84-W92 HydrophobicContact CD1-CB 4.04Å; Y84-W92 HydrophobicContact CD2-CB 3.6Å; Y84-W92 HydrophobicContact CE1-CB 4.21Å; Y84-W92 HydrophobicContact CE2-CB 3.77Å; Y84-W92 HydrophobicContact CG-CB 3.75Å; A89-W92 PolarHBondContact O-N 2.94Å; F90-W92 PolarHBondContact O-N 3.45Å; W92-K95 PolarHBondContact O-N 3.38Å; W92-A96 WeakPolarHBondContact O-CB 3.46Å; W92-A96 PolarHBondContact O-N 3.13Å
93	A	75.8	Confident	72.1	Confident	0 Å²	0	72 Å²	72	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-63.3	-47	172.8	0	0	0	0	0	111.9	F85 A89 F90 K95 A96 F97 M120	F85-A93 HydrophobicContact CB-CB 4.25Å; A89-A93 PolarHBondContact O-N 3.37Å; F90-A93 PolarHBondContact O-N 3.07Å; A93-K95 PolarHBondContact O-N 3.14Å; A93-A96 PolarHBondContact O-N 2.91Å; A93-F97 VanDerWaalsContact O-CB 3.29Å; A93-F97 WeakPolarHBondContact O-CB 3.49Å; A93-F97 WeakPolarHBondContact O-CD2 3.31Å; A93-F97 WeakPolarHBondContact O-CG 3.09Å; A93-F97 PolarHBondContact O-N 2.96Å; A93-M120 HydrophobicContact CB-CE 4.11Å; A93-M120 HydrophobicContact CB-SD 3.48Å; A93-M120 WeakPolarHBondContact CB-SD 3.25Å
94	I	73.6	Confident	71.8	Confident	16 Å²	16	70.5 Å²	70.5	8%	0.082	32%	0.318	C	S	.	.	H	α-helix	trans	-56.2	-50.6	174.6	-73.5	163.2	0	0	0	109.8	F90 F97 Q98 L117 M120 F121	F90-I94 VanDerWaalsContact O-CB 3.26Å; F90-I94 WeakPolarHBondContact O-CB 3.46Å; F90-I94 WeakPolarHBondContact O-CD1 3.04Å; F90-I94 WeakPolarHBondContact O-CG1 3.3Å; F90-I94 PolarHBondContact O-N 3.5Å; I94-F97 PolarHBondContact O-N 2.78Å; I94-Q98 HydrophobicContact CG2-CG 4.43Å; I94-Q98 WeakPolarHBondContact O-CB 3.3Å; I94-Q98 VanDerWaalsContact O-CG 3.31Å; I94-Q98 WeakPolarHBondContact O-CG 3.44Å; I94-Q98 PolarHBondContact O-N 3.25Å; I94-L117 HydrophobicContact CB-CD2 4.2Å; I94-L117 HydrophobicContact CG1-CD2 4.15Å; I94-L117 HydrophobicContact CG2-CD2 4.03Å; I94-M120 HydrophobicContact CB-CE 4.4Å; I94-M120 HydrophobicContact CD1-CB 3.95Å; I94-M120 HydrophobicContact CG1-CB 3.88Å; I94-M120 HydrophobicContact CG1-CE 3.6Å; I94-M120 HydrophobicContact CG1-SD 3.94Å; I94-F121 HydrophobicContact CD1-CD1 3.99Å; I94-F121 HydrophobicContact CD1-CE1 3.79Å; I94-F121 HydrophobicContact CG1-CE1 4.24Å; I94-F121 HydrophobicContact CG2-CE1 3.87Å; I94-F121 HydrophobicContact CG2-CZ 3.79Å
95	K	73.1	Confident	71.4	Confident	98 Å²	98	72.8 Å²	72.8	43%	0.426	34%	0.339	S	S	.	.	H	α-helix	trans	-59.8	-54.7	179.5	-175.6	178.1	175.7	-177.5	0	111.6	H91 W92 A93 F97 Q98 D99	H91-K95 PolarHBondContact O-N 3.09Å; W92-K95 PolarHBondContact O-N 3.38Å; A93-K95 PolarHBondContact O-N 3.14Å; K95-F97 VanDerWaalsContact C-N 3.25Å; K95-F97 PolarHBondContact O-N 3.47Å; K95-Q98 PolarHBondContact O-N 2.81Å; K95-D99 VanDerWaalsContact CE-OD2 3.26Å; K95-D99 WeakPolarHBondContact CE-OD2 3.34Å; K95-D99 WeakPolarHBondContact CG-OD2 3.47Å; K95-D99 PolarHBondContact O-N 3.45Å
96	A	75.4	Confident	71.3	Confident	4 Å²	4	75.8 Å²	75.8	3%	0.033	37%	0.365	C	S	.	.	H	α-helix	trans	-57.3	-39.3	-178.1	0	0	0	0	0	112.2	Y84 W92 A93 D99 V100	Y84-A96 HydrophobicContact CD2-CB 4.33Å; W92-A96 WeakPolarHBondContact O-CB 3.46Å; W92-A96 PolarHBondContact O-N 3.13Å; A93-A96 PolarHBondContact O-N 2.91Å; A96-D99 PolarHBondContact O-N 3.09Å; A96-V100 WeakPolarHBondContact O-CG2 3.36Å; A96-V100 PolarHBondContact O-N 2.92Å
97	F	76.8	Confident	71.9	Confident	0 Å²	0	68.9 Å²	68.9	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-71	-32.2	175.6	-79.5	-42.4	0	0	0	114.3	Y78 G81 L82 F85 A93 I94 K95 L101 I113 R116 L117 M120	Y78-F97 HydrophobicContact CD2-CD1 4.23Å; Y78-F97 AromaticContact CD2-CE1 3.71Å; Y78-F97 HydrophobicContact CD2-CE1 3.71Å; Y78-F97 AromaticContact CE2-CE1 3.93Å; Y78-F97 HydrophobicContact CE2-CE1 3.93Å; G81-F97 WeakPolarHBondContact O-CE2 3.43Å; G81-F97 WeakPolarHBondContact O-CZ 3.29Å; L82-F97 HydrophobicContact CD2-CZ 4.15Å; L82-F97 HydrophobicContact CG-CE1 4.46Å; L82-F97 HydrophobicContact CG-CZ 4.2Å; F85-F97 HydrophobicContact CB-CE2 4.19Å; F85-F97 HydrophobicContact CD2-CE2 4.39Å; A93-F97 VanDerWaalsContact O-CB 3.29Å; A93-F97 WeakPolarHBondContact O-CB 3.49Å; A93-F97 WeakPolarHBondContact O-CD2 3.31Å; A93-F97 WeakPolarHBondContact O-CG 3.09Å; A93-F97 PolarHBondContact O-N 2.96Å; I94-F97 PolarHBondContact O-N 2.78Å; K95-F97 VanDerWaalsContact C-N 3.25Å; K95-F97 PolarHBondContact O-N 3.47Å; F97-L101 WeakPolarHBondContact O-CG 3.35Å; F97-L101 PolarHBondContact O-N 2.99Å; F97-I113 HydrophobicContact CB-CG2 3.55Å; F97-I113 HydrophobicContact CD1-CB 4.37Å; F97-I113 HydrophobicContact CD1-CD1 4.36Å; F97-I113 HydrophobicContact CD1-CG1 3.98Å; F97-I113 HydrophobicContact CD1-CG2 3.7Å; F97-I113 HydrophobicContact CE1-CG1 4.29Å; F97-I113 HydrophobicContact CG-CG2 3.78Å; F97-R116 HydrophobicContact CE2-CB 4.22Å; F97-L117 HydrophobicContact CB-CD1 4.37Å; F97-L117 HydrophobicContact CB-CD2 3.99Å; F97-L117 HydrophobicContact CB-CG 4.13Å; F97-M120 HydrophobicContact CD2-CE 3.65Å; F97-M120 HydrophobicContact CE2-CE 4.11Å
98	Q	72.9	Confident	71.9	Confident	98 Å²	98	65.5 Å²	65.5	46%	0.458	34%	0.341	S	S	.	.	H	α-helix	trans	-69	-40.3	169.7	-72.1	179.1	-56.3	0	0	111.1	I94 K95 V100 L101 Y102 L117	I94-Q98 HydrophobicContact CG2-CG 4.43Å; I94-Q98 WeakPolarHBondContact O-CB 3.3Å; I94-Q98 VanDerWaalsContact O-CG 3.31Å; I94-Q98 WeakPolarHBondContact O-CG 3.44Å; I94-Q98 PolarHBondContact O-N 3.25Å; K95-Q98 PolarHBondContact O-N 2.81Å; Q98-V100 VanDerWaalsContact C-N 3.31Å; Q98-V100 PolarHBondContact O-N 3.47Å; Q98-L101 PolarHBondContact O-N 3.11Å; Q98-Y102 WeakPolarHBondContact O-CB 3.36Å; Q98-Y102 PolarHBondContact O-N 3.23Å; Q98-L117 HydrophobicContact CG-CD1 4.37Å; Q98-L117 HydrophobicContact CG-CD2 4.19Å
99	D	75.9	Confident	72	Confident	56 Å²	56	65.8 Å²	65.8	30%	0.299	33%	0.334	S	S	.	.	H	α-helix	trans	-62	-36.8	175.8	-61.3	-21.4	0	0	0	110.9	L77 K95 A96 Y102 V103	L77-D99 HydrophobicContact CD1-CB 4.01Å; L77-D99 HydrophobicContact CD2-CB 4.4Å; K95-D99 VanDerWaalsContact CE-OD2 3.26Å; K95-D99 WeakPolarHBondContact CE-OD2 3.34Å; K95-D99 WeakPolarHBondContact CG-OD2 3.47Å; K95-D99 PolarHBondContact O-N 3.45Å; A96-D99 PolarHBondContact O-N 3.09Å; D99-Y102 PolarHBondContact O-N 3.47Å; D99-V103 WeakPolarHBondContact O-CB 3.13Å; D99-V103 VanDerWaalsContact O-CG2 3.29Å; D99-V103 WeakPolarHBondContact O-CG2 3.42Å; D99-V103 PolarHBondContact O-N 3.05Å
100	V	78.9	Confident	71.4	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-57.8	-53.7	170.4	178.2	0	0	0	0	111.5	A74 L77 A96 Q98 Y102 V103 D104 F107 I113	A74-V100 HydrophobicContact CB-CG1 4.21Å; L77-V100 VanDerWaalsContact C-CG2 3.47Å; L77-V100 HydrophobicContact CB-CG2 3.48Å; L77-V100 VanDerWaalsContact CB-CG2 3.48Å; A96-V100 WeakPolarHBondContact O-CG2 3.36Å; A96-V100 PolarHBondContact O-N 2.92Å; Q98-V100 VanDerWaalsContact C-N 3.31Å; Q98-V100 PolarHBondContact O-N 3.47Å; V100-Y102 PolarHBondContact O-N 2.81Å; V100-V103 PolarHBondContact O-N 3.45Å; V100-D104 PolarHBondContact O-N 3.15Å; V100-F107 HydrophobicContact CG1-CB 4.17Å; V100-F107 HydrophobicContact CG1-CD1 3.84Å; V100-F107 HydrophobicContact CG1-CD2 4.49Å; V100-F107 HydrophobicContact CG1-CE1 4.35Å; V100-F107 HydrophobicContact CG1-CG 3.92Å; V100-I113 HydrophobicContact CB-CD1 3.96Å; V100-I113 HydrophobicContact CG1-CD1 3.46Å; V100-I113 VanDerWaalsContact CG1-CD1 3.46Å; V100-I113 HydrophobicContact CG2-CD1 4.36Å
101	L	72.1	Confident	70.4	Confident	29 Å²	29	70.5 Å²	70.5	15%	0.152	35%	0.351	C	S	.	.	H	α-helix	trans	-68.4	-21.5	-175.2	-65.7	171.5	0	0	0	112.6	F97 Q98 P105 A110 I113 L117	F97-L101 WeakPolarHBondContact O-CG 3.35Å; F97-L101 PolarHBondContact O-N 2.99Å; Q98-L101 PolarHBondContact O-N 3.11Å; L101-P105 WeakPolarHBondContact O-CA 3.42Å; L101-P105 WeakPolarHBondContact O-CG 3.38Å; L101-A110 HydrophobicContact CD2-CB 3.61Å; L101-I113 HydrophobicContact CD1-CB 4.5Å; L101-I113 HydrophobicContact CD1-CG2 3.78Å; L101-I113 HydrophobicContact CD2-CB 4.42Å; L101-I113 HydrophobicContact CD2-CD1 4.42Å; L101-I113 HydrophobicContact CD2-CG2 4.36Å; L101-I113 HydrophobicContact CG-CG2 3.96Å; L101-L117 HydrophobicContact CD1-CD1 3.77Å
102	Y	69.4	Low	70.5	Confident	203 Å²	203	67.2 Å²	67.2	80%	0.796	34%	0.336	S	S	*	.	H	α-helix	trans	-79.8	-38.4	172.9	-177.4	-96.1	0	0	0	112.5	Q98 D99 V100	Q98-Y102 WeakPolarHBondContact O-CB 3.36Å; Q98-Y102 PolarHBondContact O-N 3.23Å; D99-Y102 PolarHBondContact O-N 3.47Å; V100-Y102 PolarHBondContact O-N 2.81Å
103	V	72.4	Confident	70.5	Confident	59 Å²	59	61.6 Å²	61.6	36%	0.358	32%	0.315	S	S	.	.	H	α-helix	trans	-79.8	-37.6	179.8	170	0	0	0	0	112.3	K72 A74 L77 D99 V100	K72-V103 WeakPolarHBondContact O-CG1 3.44Å; A74-V103 HydrophobicContact CB-CG1 4.44Å; L77-V103 HydrophobicContact CD1-CG2 4.16Å; D99-V103 WeakPolarHBondContact O-CB 3.13Å; D99-V103 VanDerWaalsContact O-CG2 3.29Å; D99-V103 WeakPolarHBondContact O-CG2 3.42Å; D99-V103 PolarHBondContact O-N 3.05Å; V100-V103 PolarHBondContact O-N 3.45Å
104	D	69.3	Low	69.7	Low	43 Å²	43	65.3 Å²	65.3	23%	0.23	33%	0.332	C	S	.	.			trans	-141.1	91.4	175.2	179.2	9.1	0	0	0	110.6	A74 V100 S106 F107	A74-D104 HydrophobicContact CB-CB 3.62Å; V100-D104 PolarHBondContact O-N 3.15Å; D104-S106 PolarHBondContact O-N 3.1Å; D104-S106 VanDerWaalsContact OD1-CA 3.31Å; D104-S106 WeakPolarHBondContact OD1-CA 3.3Å; D104-S106 WeakPolarHBondContact OD1-CB 3.22Å; D104-S106 PolarHBondContact OD1-N 3.16Å; D104-S106 PolarHBondContact OD1-OG 3.3Å; D104-F107 HydrophobicContact CB-CB 4.13Å; D104-F107 VanDerWaalsContact CG-N 3.3Å; D104-F107 VanDerWaalsContact O-CB 3.32Å; D104-F107 WeakPolarHBondContact O-CB 3.41Å; D104-F107 PolarHBondContact O-N 2.81Å; D104-F107 PolarHBondContact OD1-N 3.4Å; D104-F107 WeakPolarHBondContact OD2-CA 3.34Å; D104-F107 WeakPolarHBondContact OD2-CB 3.36Å; D104-F107 PolarHBondContact OD2-N 3.33Å
105	P	66.8	Low	68.7	Low	103 Å²	103	69.9 Å²	69.9	67%	0.669	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-19.5	173.3	-22.3	32.7	0	0	0	113.9	L101	L101-P105 WeakPolarHBondContact O-CA 3.42Å; L101-P105 WeakPolarHBondContact O-CG 3.38Å
106	S	68.5	Low	68.5	Low	106 Å²	106	67 Å²	67	74%	0.741	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	0.2	-179.2	72.8	0	0	0	0	113.8	D104 C108	D104-S106 PolarHBondContact O-N 3.1Å; D104-S106 VanDerWaalsContact OD1-CA 3.31Å; D104-S106 WeakPolarHBondContact OD1-CA 3.3Å; D104-S106 WeakPolarHBondContact OD1-CB 3.22Å; D104-S106 PolarHBondContact OD1-N 3.16Å; D104-S106 PolarHBondContact OD1-OG 3.3Å; S106-C108 PolarHBondContact O-N 3.5Å
107	F	79.4	Confident	67.8	Low	22 Å²	22	67.4 Å²	67.4	10%	0.096	34%	0.344	C	S	.	.			trans	-48.9	134.1	-170.5	-174.2	-109.1	0	0	0	112.2	A74 A75 Y78 V100 D104 R109 A110 I113	A74-F107 HydrophobicContact CB-CD2 3.75Å; A74-F107 HydrophobicContact CB-CE2 4.08Å; A74-F107 HydrophobicContact CB-CG 4.49Å; A75-F107 HydrophobicContact CB-CE2 4.15Å; A75-F107 HydrophobicContact CB-CZ 4.43Å; Y78-F107 AromaticContact CD1-CE1 3.99Å; Y78-F107 HydrophobicContact CD1-CE1 3.99Å; Y78-F107 HydrophobicContact CD1-CZ 4.04Å; Y78-F107 AromaticContact CD2-CE1 3.78Å; Y78-F107 HydrophobicContact CD2-CE1 3.78Å; Y78-F107 HydrophobicContact CE2-CE1 4.45Å; Y78-F107 AromaticContact CG-CE1 3.53Å; Y78-F107 HydrophobicContact CG-CE1 3.53Å; Y78-F107 AromaticContact CG-CZ 3.84Å; Y78-F107 HydrophobicContact CG-CZ 3.84Å; V100-F107 HydrophobicContact CG1-CB 4.17Å; V100-F107 HydrophobicContact CG1-CD1 3.84Å; V100-F107 HydrophobicContact CG1-CD2 4.49Å; V100-F107 HydrophobicContact CG1-CE1 4.35Å; V100-F107 HydrophobicContact CG1-CG 3.92Å; D104-F107 HydrophobicContact CB-CB 4.13Å; D104-F107 VanDerWaalsContact CG-N 3.3Å; D104-F107 VanDerWaalsContact O-CB 3.32Å; D104-F107 WeakPolarHBondContact O-CB 3.41Å; D104-F107 PolarHBondContact O-N 2.81Å; D104-F107 PolarHBondContact OD1-N 3.4Å; D104-F107 WeakPolarHBondContact OD2-CA 3.34Å; D104-F107 WeakPolarHBondContact OD2-CB 3.36Å; D104-F107 PolarHBondContact OD2-N 3.33Å; F107-R109 HydrophobicContact CD1-CB 4.1Å; F107-R109 HydrophobicContact CE1-CB 3.88Å; F107-R109 HydrophobicContact CE1-CG 4.43Å; F107-R109 PolarHBondContact O-N 3.47Å; F107-A110 VanDerWaalsContact O-CB 3.28Å; F107-A110 WeakPolarHBondContact O-CB 3.37Å; F107-A110 PolarHBondContact O-N 2.95Å; F107-I113 HydrophobicContact CD1-CD1 3.73Å; F107-I113 HydrophobicContact CE1-CD1 4.13Å
108	C	67.1	Low	66.6	Low	117 Å²	117	68.5 Å²	68.5	79%	0.791	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-16.4	-167.8	64.2	0	0	0	0	115	S106	S106-C108 PolarHBondContact O-N 3.5Å
109	R	72.2	Confident	65.7	Low	122 Å²	122	68 Å²	68	46%	0.46	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.8	15	175	-58.9	-179.2	178.2	-133.3	10.3	114.7	Y78 F107 K111 E112 I113	Y78-R109 VanDerWaalsContact CE1-CD 3.5Å; Y78-R109 HydrophobicContact CE2-CB 4.2Å; Y78-R109 VanDerWaalsContact OH-CD 3.29Å; Y78-R109 WeakPolarHBondContact OH-CD 3.47Å; Y78-R109 PolarHBondContact OH-NH1 3.29Å; F107-R109 HydrophobicContact CD1-CB 4.1Å; F107-R109 HydrophobicContact CE1-CB 3.88Å; F107-R109 HydrophobicContact CE1-CG 4.43Å; F107-R109 PolarHBondContact O-N 3.47Å; R109-K111 PolarHBondContact O-N 3.43Å; R109-E112 HydrophobicContact CB-CB 4.23Å; R109-E112 IonicContact NH1-OE2 2.73Å; R109-E112 PolarHBondContact NH1-OE2 3.13Å; R109-E112 VanDerWaalsContact NH1-OE2 3.07Å; R109-E112 WeakPolarHBondContact O-CA 3.32Å; R109-E112 VanDerWaalsContact O-CB 3.27Å; R109-E112 WeakPolarHBondContact O-CB 3.45Å; R109-E112 PolarHBondContact O-N 3.28Å; R109-I113 WeakPolarHBondContact O-CG1 3.22Å; R109-I113 PolarHBondContact O-N 2.87Å
110	A	59.3	Low	65.4	Low	15 Å²	15	65.5 Å²	65.5	12%	0.124	34%	0.342	C	S	.	.	H	α-helix	trans	-48.9	-38.3	179.5	0	0	0	0	0	113.1	L101 F107 E112 I113 H114	L101-A110 HydrophobicContact CD2-CB 3.61Å; F107-A110 VanDerWaalsContact O-CB 3.28Å; F107-A110 WeakPolarHBondContact O-CB 3.37Å; F107-A110 PolarHBondContact O-N 2.95Å; A110-E112 PolarHBondContact O-N 3.42Å; A110-I113 WeakPolarHBondContact O-CB 3.43Å; A110-I113 PolarHBondContact O-N 3.01Å; A110-I113 VanDerWaalsContact O-N 3.12Å; A110-H114 PolarHBondContact O-CD2 3.16Å; A110-H114 PolarHBondContact O-N 2.63Å
111	K	51.4	Low	64.4	Low	149 Å²	149	70 Å²	70	65%	0.648	36%	0.362	S	S	*	.	H	α-helix	trans	-59.9	-40.5	174.1	-62	173.7	-175.5	170.3	0	113.2	R109 L115	R109-K111 PolarHBondContact O-N 3.43Å; K111-L115 PolarHBondContact O-N 3.25Å
112	E	63.1	Low	63.3	Low	53 Å²	53	76 Å²	76	25%	0.248	39%	0.387	C	S	.	.	H	α-helix	trans	-67.1	-39.2	173.8	-161.7	-168.4	147.8	0	0	110.7	Y78 R109 A110 L115 R116	Y78-E112 PolarHBondContact OH-OE1 2.64Å; Y78-E112 VanDerWaalsContact OH-OE1 3.13Å; Y78-E112 PolarHBondContact OH-OE2 3.26Å; R109-E112 HydrophobicContact CB-CB 4.23Å; R109-E112 IonicContact NH1-OE2 2.73Å; R109-E112 PolarHBondContact NH1-OE2 3.13Å; R109-E112 VanDerWaalsContact NH1-OE2 3.07Å; R109-E112 WeakPolarHBondContact O-CA 3.32Å; R109-E112 VanDerWaalsContact O-CB 3.27Å; R109-E112 WeakPolarHBondContact O-CB 3.45Å; R109-E112 PolarHBondContact O-N 3.28Å; A110-E112 PolarHBondContact O-N 3.42Å; E112-L115 PolarHBondContact O-N 3.18Å; E112-R116 WeakPolarHBondContact O-CG 3.31Å; E112-R116 PolarHBondContact O-N 3.44Å; E112-R116 IonicContact OE1-CZ 3.31Å; E112-R116 IonicContact OE1-NE 2.66Å; E112-R116 PolarHBondContact OE1-NE 2.82Å; E112-R116 IonicContact OE1-NH2 3.2Å; E112-R116 PolarHBondContact OE1-NH2 3Å
113	I	67.3	Low	62.5	Low	0 Å²	0	70.5 Å²	70.5	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-64.5	-49.3	178.5	-60.3	176.2	0	0	0	111.1	Y78 F97 V100 L101 F107 R109 A110 L115 R116 L117	Y78-I113 HydrophobicContact CD2-CD1 3.6Å; Y78-I113 HydrophobicContact CD2-CG1 3.66Å; Y78-I113 HydrophobicContact CE2-CD1 4.19Å; Y78-I113 HydrophobicContact CE2-CG1 3.76Å; F97-I113 HydrophobicContact CB-CG2 3.55Å; F97-I113 HydrophobicContact CD1-CB 4.37Å; F97-I113 HydrophobicContact CD1-CD1 4.36Å; F97-I113 HydrophobicContact CD1-CG1 3.98Å; F97-I113 HydrophobicContact CD1-CG2 3.7Å; F97-I113 HydrophobicContact CE1-CG1 4.29Å; F97-I113 HydrophobicContact CG-CG2 3.78Å; V100-I113 HydrophobicContact CB-CD1 3.96Å; V100-I113 HydrophobicContact CG1-CD1 3.46Å; V100-I113 VanDerWaalsContact CG1-CD1 3.46Å; V100-I113 HydrophobicContact CG2-CD1 4.36Å; L101-I113 HydrophobicContact CD1-CB 4.5Å; L101-I113 HydrophobicContact CD1-CG2 3.78Å; L101-I113 HydrophobicContact CD2-CB 4.42Å; L101-I113 HydrophobicContact CD2-CD1 4.42Å; L101-I113 HydrophobicContact CD2-CG2 4.36Å; L101-I113 HydrophobicContact CG-CG2 3.96Å; F107-I113 HydrophobicContact CD1-CD1 3.73Å; F107-I113 HydrophobicContact CE1-CD1 4.13Å; R109-I113 WeakPolarHBondContact O-CG1 3.22Å; R109-I113 PolarHBondContact O-N 2.87Å; A110-I113 WeakPolarHBondContact O-CB 3.43Å; A110-I113 PolarHBondContact O-N 3.01Å; A110-I113 VanDerWaalsContact O-N 3.12Å; I113-L115 VanDerWaalsContact C-N 3.29Å; I113-L115 PolarHBondContact O-N 3.4Å; I113-R116 PolarHBondContact O-N 2.91Å; I113-L117 HydrophobicContact CG2-CD1 3.97Å; I113-L117 HydrophobicContact CG2-CG 4.37Å; I113-L117 WeakPolarHBondContact O-CB 3.48Å; I113-L117 WeakPolarHBondContact O-CG 3.25Å; I113-L117 PolarHBondContact O-N 3.04Å
114	H	59.5	Low	61.7	Low	78 Å²	78	71.2 Å²	71.2	36%	0.361	38%	0.376	S	S	.	.	H	α-helix	trans	-58.9	-38.8	175.6	-78.3	-76.4	0	0	0	112.2	A110 L117 G118	A110-H114 PolarHBondContact O-CD2 3.16Å; A110-H114 PolarHBondContact O-N 2.63Å; H114-L117 PolarHBondContact O-N 3.21Å; H114-G118 PolarHBondContact O-N 3.02Å
115	L	51.4	Low	60.7	Low	112 Å²	112	74.1 Å²	74.1	59%	0.586	40%	0.395	S	S	*	.	H	α-helix	trans	-65.4	-45	175.5	-174	66.3	0	0	0	111.9	K111 E112 I113 G118 L119	K111-L115 PolarHBondContact O-N 3.25Å; E112-L115 PolarHBondContact O-N 3.18Å; I113-L115 VanDerWaalsContact C-N 3.29Å; I113-L115 PolarHBondContact O-N 3.4Å; L115-G118 PolarHBondContact O-N 3.32Å; L115-L119 WeakPolarHBondContact O-CG 3.23Å; L115-L119 PolarHBondContact O-N 3Å
116	R	68.6	Low	59.6	Low	39 Å²	39	76.7 Å²	76.7	15%	0.147	40%	0.404	C	S	.	.	H	α-helix	trans	-64.9	-38.8	176.1	-72.2	175.5	-176.9	-88.5	5.4	112.2	F85 F97 E112 I113 L119 M120	F85-R116 VanDerWaalsContact CD1-NH1 3.35Å; F85-R116 HydrophobicContact CD2-CB 4.28Å; F85-R116 HydrophobicContact CD2-CG 4.46Å; F85-R116 VanDerWaalsContact CE1-NH1 3.29Å; F85-R116 HydrophobicContact CE2-CB 4.04Å; F85-R116 HydrophobicContact CE2-CG 4.1Å; F85-R116 HydrophobicContact CZ-CG 4.44Å; F97-R116 HydrophobicContact CE2-CB 4.22Å; E112-R116 WeakPolarHBondContact O-CG 3.31Å; E112-R116 PolarHBondContact O-N 3.44Å; E112-R116 IonicContact OE1-CZ 3.31Å; E112-R116 IonicContact OE1-NE 2.66Å; E112-R116 PolarHBondContact OE1-NE 2.82Å; E112-R116 IonicContact OE1-NH2 3.2Å; E112-R116 PolarHBondContact OE1-NH2 3Å; I113-R116 PolarHBondContact O-N 2.91Å; R116-L119 PolarHBondContact O-N 3.02Å; R116-M120 WeakPolarHBondContact O-CG 3.25Å; R116-M120 PolarHBondContact O-N 3.41Å
117	L	61.7	Low	58.4	Low	11 Å²	11	79.6 Å²	79.6	6%	0.058	40%	0.399	C	S	.	.	H	α-helix	trans	-60.3	-49.5	172.1	-76.4	169.7	0	0	0	111.1	I94 F97 Q98 L101 I113 H114 L119 M120 F121	I94-L117 HydrophobicContact CB-CD2 4.2Å; I94-L117 HydrophobicContact CG1-CD2 4.15Å; I94-L117 HydrophobicContact CG2-CD2 4.03Å; F97-L117 HydrophobicContact CB-CD1 4.37Å; F97-L117 HydrophobicContact CB-CD2 3.99Å; F97-L117 HydrophobicContact CB-CG 4.13Å; Q98-L117 HydrophobicContact CG-CD1 4.37Å; Q98-L117 HydrophobicContact CG-CD2 4.19Å; L101-L117 HydrophobicContact CD1-CD1 3.77Å; I113-L117 HydrophobicContact CG2-CD1 3.97Å; I113-L117 HydrophobicContact CG2-CG 4.37Å; I113-L117 WeakPolarHBondContact O-CB 3.48Å; I113-L117 WeakPolarHBondContact O-CG 3.25Å; I113-L117 PolarHBondContact O-N 3.04Å; H114-L117 PolarHBondContact O-N 3.21Å; L117-L119 VanDerWaalsContact C-N 3.32Å; L117-L119 PolarHBondContact O-N 2.88Å; L117-M120 HydrophobicContact CD2-CE 3.99Å; L117-M120 PolarHBondContact O-N 3.39Å; L117-F121 HydrophobicContact CB-CD2 4.35Å; L117-F121 HydrophobicContact CB-CE2 4.02Å; L117-F121 HydrophobicContact CD2-CE2 4.23Å; L117-F121 HydrophobicContact CD2-CZ 4.37Å; L117-F121 WeakPolarHBondContact O-CD2 3.44Å; L117-F121 WeakPolarHBondContact O-CG 3.46Å; L117-F121 PolarHBondContact O-N 2.91Å
118	G	50.8	Low	56.4	Low	24 Å²	24	87.5 Å²	87.5	25%	0.247	43%	0.434	C	S	.	.	H	α-helix	trans	-56.5	-43	175.3	0	0	0	0	0	113.1	H114 L115 F121 K122	H114-G118 PolarHBondContact O-N 3.02Å; L115-G118 PolarHBondContact O-N 3.32Å; G118-F121 PolarHBondContact O-N 2.97Å; G118-K122 WeakPolarHBondContact O-CB 3.34Å; G118-K122 PolarHBondContact O-N 2.87Å
119	L	55.5	Low	55	Low	88 Å²	88	87 Å²	87	46%	0.461	43%	0.431	S	S	.	.	H	α-helix	trans	-63.1	-44.3	174.9	-72	169.7	0	0	0	112.7	L115 R116 L117 K122 V123	L115-L119 WeakPolarHBondContact O-CG 3.23Å; L115-L119 PolarHBondContact O-N 3Å; R116-L119 PolarHBondContact O-N 3.02Å; L117-L119 VanDerWaalsContact C-N 3.32Å; L117-L119 PolarHBondContact O-N 2.88Å; L119-K122 PolarHBondContact O-N 3.43Å; L119-V123 WeakPolarHBondContact O-CG2 3.47Å; L119-V123 PolarHBondContact O-N 3.31Å
120	M	69	Low	53.4	Low	2 Å²	2	83.1 Å²	83.1	1%	0.01	42%	0.423	C	S	.	.	H	α-helix	trans	-69.4	-36.1	178.4	-67.7	-175.6	-69.2	0	0	112.8	F85 F90 A93 I94 F97 R116 L117 K122 V123 N124	F85-M120 HydrophobicContact CD2-CE 4.33Å; F85-M120 HydrophobicContact CD2-CG 3.9Å; F85-M120 HydrophobicContact CD2-SD 3.7Å; F85-M120 HydrophobicContact CE2-CG 3.92Å; F85-M120 HydrophobicContact CE2-SD 4.32Å; F90-M120 HydrophobicContact CB-CB 4.46Å; F90-M120 HydrophobicContact CB-CG 4.37Å; F90-M120 HydrophobicContact CB-SD 4.17Å; F90-M120 HydrophobicContact CD1-CB 4.46Å; F90-M120 HydrophobicContact CD1-CG 3.64Å; F90-M120 HydrophobicContact CD1-SD 3.72Å; F90-M120 HydrophobicContact CE1-CG 4.25Å; F90-M120 HydrophobicContact CG-CG 4.21Å; F90-M120 HydrophobicContact CG-SD 4.35Å; A93-M120 HydrophobicContact CB-CE 4.11Å; A93-M120 HydrophobicContact CB-SD 3.48Å; A93-M120 WeakPolarHBondContact CB-SD 3.25Å; I94-M120 HydrophobicContact CB-CE 4.4Å; I94-M120 HydrophobicContact CD1-CB 3.95Å; I94-M120 HydrophobicContact CG1-CB 3.88Å; I94-M120 HydrophobicContact CG1-CE 3.6Å; I94-M120 HydrophobicContact CG1-SD 3.94Å; F97-M120 HydrophobicContact CD2-CE 3.65Å; F97-M120 HydrophobicContact CE2-CE 4.11Å; R116-M120 WeakPolarHBondContact O-CG 3.25Å; R116-M120 PolarHBondContact O-N 3.41Å; L117-M120 HydrophobicContact CD2-CE 3.99Å; L117-M120 PolarHBondContact O-N 3.39Å; M120-K122 VanDerWaalsContact C-N 3.33Å; M120-V123 PolarHBondContact O-N 3.5Å; M120-N124 WeakPolarHBondContact O-CB 3.49Å; M120-N124 PolarHBondContact O-N 3.3Å
121	F	57.6	Low	52.7	Low	95 Å²	95	87 Å²	87	42%	0.417	44%	0.441	S	S	.	.	H	α-helix	trans	-66.2	-35.2	172.1	-66.6	-49.7	0	0	0	111.8	I94 L117 G118 V123	I94-F121 HydrophobicContact CD1-CD1 3.99Å; I94-F121 HydrophobicContact CD1-CE1 3.79Å; I94-F121 HydrophobicContact CG1-CE1 4.24Å; I94-F121 HydrophobicContact CG2-CE1 3.87Å; I94-F121 HydrophobicContact CG2-CZ 3.79Å; L117-F121 HydrophobicContact CB-CD2 4.35Å; L117-F121 HydrophobicContact CB-CE2 4.02Å; L117-F121 HydrophobicContact CD2-CE2 4.23Å; L117-F121 HydrophobicContact CD2-CZ 4.37Å; L117-F121 WeakPolarHBondContact O-CD2 3.44Å; L117-F121 WeakPolarHBondContact O-CG 3.46Å; L117-F121 PolarHBondContact O-N 2.91Å; G118-F121 PolarHBondContact O-N 2.97Å; F121-V123 VanDerWaalsContact C-N 3.3Å; F121-V123 PolarHBondContact O-N 3Å
122	K	49.8	Very low	52.4	Low	155 Å²	155	86.3 Å²	86.3	67%	0.674	44%	0.438	S	S	*	.	H	α-helix	trans	-67.7	-24.2	171.9	-176.1	173.7	179.6	176.3	0	113.6	G118 L119 M120 T125	G118-K122 WeakPolarHBondContact O-CB 3.34Å; G118-K122 PolarHBondContact O-N 2.87Å; L119-K122 PolarHBondContact O-N 3.43Å; M120-K122 VanDerWaalsContact C-N 3.33Å; K122-T125 WeakPolarHBondContact O-CG2 3.43Å
123	V	51.2	Low	51.5	Low	88 Å²	88	94.3 Å²	94.3	53%	0.533	47%	0.466	S	S	.	.	H	α-helix	trans	-91.1	-31.9	179.4	170.2	0	0	0	0	113	F90 L119 M120 F121 T125	F90-V123 HydrophobicContact CD2-CG1 4.16Å; F90-V123 HydrophobicContact CE2-CG1 3.64Å; F90-V123 HydrophobicContact CZ-CG1 4.3Å; L119-V123 WeakPolarHBondContact O-CG2 3.47Å; L119-V123 PolarHBondContact O-N 3.31Å; M120-V123 PolarHBondContact O-N 3.5Å; F121-V123 VanDerWaalsContact C-N 3.3Å; F121-V123 PolarHBondContact O-N 3Å; V123-T125 PolarHBondContact O-N 3.37Å; V123-T125 VanDerWaalsContact O-N 3.08Å
124	N	55.9	Low	50.8	Low	74 Å²	74	99.9 Å²	99.9	40%	0.396	49%	0.49	S	S	.	.			trans	-80.7	28.6	-177.5	-85.5	-25	0	0	0	114.9	M120 D126	M120-N124 WeakPolarHBondContact O-CB 3.49Å; M120-N124 PolarHBondContact O-N 3.3Å; N124-D126 VanDerWaalsContact C-N 3.29Å; N124-D126 PolarHBondContact O-N 3.48Å; N124-D126 VanDerWaalsContact O-N 3.16Å
125	T	49.7	Very low	50.5	Low	104 Å²	104	97.1 Å²	97.1	64%	0.638	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-9.3	-166.2	42.1	0	0	0	0	116.7	K122 V123	K122-T125 WeakPolarHBondContact O-CG2 3.43Å; V123-T125 PolarHBondContact O-N 3.37Å; V123-T125 VanDerWaalsContact O-N 3.08Å
126	D	41.9	Very low	50.7	Low	157 Å²	157	96.4 Å²	96.4	84%	0.84	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-16.7	-179.4	-83.2	-31.3	0	0	0	114.8	N124 K128	N124-D126 VanDerWaalsContact C-N 3.29Å; N124-D126 PolarHBondContact O-N 3.48Å; N124-D126 VanDerWaalsContact O-N 3.16Å; D126-K128 PolarHBondContact O-N 3.3Å
127	Y	43.9	Very low	50.1	Low	166 Å²	166	98 Å²	98	65%	0.651	49%	0.487	S	S	*	.			trans	-86.7	53.3	-173.5	-149.4	-118.6	0	0	0	113.8	S129 S130	Y127-S129 PolarHBondContact O-N 2.98Å; Y127-S130 VanDerWaalsContact CD1-CB 3.42Å; Y127-S130 PolarHBondContact O-N 3.37Å
128	K	37.5	Very low	49.9	Very low	189 Å²	189	99.1 Å²	99.1	82%	0.822	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-22.2	-164.5	-147.2	171.1	-172.1	176.5	0	115.6	D126	D126-K128 PolarHBondContact O-N 3.3Å
129	S	38.3	Very low	50.6	Low	105 Å²	105	100.2 Å²	100.2	73%	0.734	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-24.4	-178.6	51.8	0	0	0	0	114.9	Y127	Y127-S129 PolarHBondContact O-N 2.98Å
130	S	38.6	Very low	50.9	Low	41 Å²	41	100.6 Å²	100.6	29%	0.287	50%	0.496	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-14.4	-179.3	-169	0	0	0	0	113.3	Y127 K132	Y127-S130 VanDerWaalsContact CD1-CB 3.42Å; Y127-S130 PolarHBondContact O-N 3.37Å; S130-K132 PolarHBondContact O-N 3Å
131	L	44.7	Very low	50.4	Low	97 Å²	97	103 Å²	103	51%	0.508	52%	0.516	S	S	.	.	H	α-helix	trans	-71.6	-28.8	-162.8	-139.3	73.5	0	0	0	114.7	R133 K134 Y135	L131-R133 VanDerWaalsContact C-N 3.27Å; L131-R133 PolarHBondContact O-N 3.42Å; L131-R133 VanDerWaalsContact O-N 3.14Å; L131-K134 PolarHBondContact O-N 2.98Å; L131-Y135 PolarHBondContact O-N 2.93Å
132	K	44.5	Very low	50.9	Low	135 Å²	135	100.8 Å²	100.8	59%	0.587	51%	0.505	S	S	*	.	H	α-helix	trans	-51.1	-41.3	-177.3	-93.6	-169.2	173.5	-173.6	0	113.6	S130 H136 L172	S130-K132 PolarHBondContact O-N 3Å; K132-H136 PolarHBondContact O-ND1 3.23Å; K132-L172 HydrophobicContact CD-CD1 4.39Å; K132-L172 HydrophobicContact CG-CD1 4.19Å
133	R	43.9	Very low	52	Low	220 Å²	220	96.1 Å²	96.1	83%	0.83	49%	0.486	S	S	*	.	H	α-helix	trans	-83.4	-25.1	-178.2	-162.9	171.7	-177.3	175.7	0.5	113	L131	L131-R133 VanDerWaalsContact C-N 3.27Å; L131-R133 PolarHBondContact O-N 3.42Å; L131-R133 VanDerWaalsContact O-N 3.14Å
134	K	52.2	Low	52.9	Low	118 Å²	118	98.1 Å²	98.1	51%	0.513	49%	0.489	S	S	.	.	H	α-helix	trans	-85.3	-28.6	-179.8	-63.9	-177.1	-179.9	179.9	0	113	L131 H136 A138	L131-K134 PolarHBondContact O-N 2.98Å; K134-H136 PolarHBondContact O-N 3.29Å; K134-A138 WeakPolarHBondContact O-CB 3.11Å; K134-A138 PolarHBondContact O-N 2.89Å; K134-A138 VanDerWaalsContact O-N 3.07Å
135	Y	54.4	Low	53.3	Low	19 Å²	19	96.5 Å²	96.5	8%	0.075	48%	0.48	C	S	.	.	H	α-helix	trans	-57.6	-46.4	175.5	176.1	-94.1	0	0	0	112.7	L131 A138 K139 M166 M170	L131-Y135 PolarHBondContact O-N 2.93Å; Y135-A138 PolarHBondContact O-N 3.16Å; Y135-K139 HydrophobicContact CE1-CD 4.22Å; Y135-K139 WeakPolarHBondContact O-CB 3.46Å; Y135-K139 PolarHBondContact O-N 3.35Å; Y135-M166 HydrophobicContact CD2-CE 3.69Å; Y135-M166 HydrophobicContact CE2-CB 3.87Å; Y135-M166 HydrophobicContact CE2-CE 3.49Å; Y135-M166 VanDerWaalsContact CE2-CE 3.49Å; Y135-M166 HydrophobicContact CE2-CG 4.25Å; Y135-M166 HydrophobicContact CG-CE 4.45Å; Y135-M166 PolarHBondContact OH-O 3.31Å; Y135-M170 HydrophobicContact CD1-CE 3.92Å; Y135-M170 HydrophobicContact CD2-CE 3.88Å; Y135-M170 HydrophobicContact CD2-CG 3.88Å; Y135-M170 HydrophobicContact CD2-SD 3.85Å; Y135-M170 HydrophobicContact CE1-CE 4.23Å; Y135-M170 HydrophobicContact CE1-CG 4.49Å; Y135-M170 HydrophobicContact CE2-CE 4.19Å; Y135-M170 HydrophobicContact CE2-CG 3.39Å; Y135-M170 HydrophobicContact CE2-SD 4.03Å; Y135-M170 HydrophobicContact CG-CE 3.74Å; Y135-M170 HydrophobicContact CG-SD 4.31Å
136	H	55.8	Low	54.4	Low	98 Å²	98	94 Å²	94	45%	0.454	46%	0.463	S	S	.	.	H	α-helix	trans	-61.9	-53.1	-177.3	-69.7	85	0	0	0	111.2	K132 K134 A138 K139 E140	K132-H136 PolarHBondContact O-ND1 3.23Å; K134-H136 PolarHBondContact O-N 3.29Å; H136-A138 VanDerWaalsContact C-N 3.29Å; H136-A138 PolarHBondContact O-N 3.03Å; H136-K139 WeakPolarHBondContact O-CB 3.45Å; H136-K139 PolarHBondContact O-N 3.42Å; H136-K139 VanDerWaalsContact O-N 3.09Å; H136-E140 WeakPolarHBondContact O-CB 3.37Å; H136-E140 VanDerWaalsContact O-CG 3.29Å; H136-E140 WeakPolarHBondContact O-CG 3.29Å; H136-E140 PolarHBondContact O-N 3.49Å
137	S	55	Low	55.9	Low	71 Å²	71	94.6 Å²	94.6	50%	0.497	46%	0.46	S	S	.	.	H	α-helix	trans	-63.5	-30.3	177.4	-49.9	0	0	0	0	113.9	E140 A141	S137-E140 WeakPolarHBondContact CA-OE2 3.37Å; S137-A141 VanDerWaalsContact O-CB 3.28Å; S137-A141 WeakPolarHBondContact O-CB 3.3Å; S137-A141 PolarHBondContact O-N 3.05Å
138	A	57.1	Low	57.3	Low	36 Å²	36	90.6 Å²	90.6	30%	0.298	45%	0.453	S	S	.	.	H	α-helix	trans	-69.6	-41.8	172.6	0	0	0	0	0	111.9	K134 Y135 H136 Y142 M166	K134-A138 WeakPolarHBondContact O-CB 3.11Å; K134-A138 PolarHBondContact O-N 2.89Å; K134-A138 VanDerWaalsContact O-N 3.07Å; Y135-A138 PolarHBondContact O-N 3.16Å; H136-A138 VanDerWaalsContact C-N 3.29Å; H136-A138 PolarHBondContact O-N 3.03Å; A138-Y142 WeakPolarHBondContact O-CD2 3.49Å; A138-Y142 PolarHBondContact O-N 3.14Å; A138-Y142 VanDerWaalsContact O-N 3.11Å; A138-M166 HydrophobicContact CB-CE 4.13Å
139	K	66.7	Low	58.5	Low	47 Å²	47	89.6 Å²	89.6	20%	0.204	45%	0.452	C	S	.	.	H	α-helix	trans	-63.7	-48.9	175.5	-177.4	179	176.6	-73.9	0	110.8	Y135 H136 A141 Y142 E143 L163 M166 H167	Y135-K139 HydrophobicContact CE1-CD 4.22Å; Y135-K139 WeakPolarHBondContact O-CB 3.46Å; Y135-K139 PolarHBondContact O-N 3.35Å; H136-K139 WeakPolarHBondContact O-CB 3.45Å; H136-K139 PolarHBondContact O-N 3.42Å; H136-K139 VanDerWaalsContact O-N 3.09Å; K139-A141 VanDerWaalsContact C-N 3.34Å; K139-A141 PolarHBondContact O-N 2.96Å; K139-Y142 PolarHBondContact O-N 2.88Å; K139-E143 HydrophobicContact CG-CG 4.48Å; K139-E143 IonicContact NZ-OE1 3.32Å; K139-E143 PolarHBondContact NZ-OE1 2.96Å; K139-E143 IonicContact NZ-OE2 3.6Å; K139-E143 PolarHBondContact NZ-OE2 3.49Å; K139-E143 WeakPolarHBondContact O-CG 3.19Å; K139-E143 PolarHBondContact O-N 2.91Å; K139-L163 HydrophobicContact CG-CD2 3.94Å; K139-M166 HydrophobicContact CB-CE 3.92Å; K139-H167 WeakPolarHBondContact CE-NE2 3.08Å
140	E	62.1	Low	60.1	Low	96 Å²	96	92.1 Å²	92.1	45%	0.449	46%	0.457	S	S	.	.	H	α-helix	trans	-56.6	-45.1	176.7	-72	157.8	-172.5	0	0	111.6	H136 S137 Y142 E143 Q144	H136-E140 WeakPolarHBondContact O-CB 3.37Å; H136-E140 VanDerWaalsContact O-CG 3.29Å; H136-E140 WeakPolarHBondContact O-CG 3.29Å; H136-E140 PolarHBondContact O-N 3.49Å; S137-E140 WeakPolarHBondContact CA-OE2 3.37Å; E140-Y142 PolarHBondContact O-N 3.19Å; E140-E143 PolarHBondContact O-N 3.44Å; E140-Q144 WeakPolarHBondContact O-CB 3.14Å; E140-Q144 VanDerWaalsContact O-CG 3.26Å; E140-Q144 WeakPolarHBondContact O-CG 3.5Å; E140-Q144 PolarHBondContact O-N 2.72Å
141	A	58.7	Low	61.6	Low	51 Å²	51	92.1 Å²	92.1	42%	0.421	45%	0.453	S	S	.	.	H	α-helix	trans	-64.2	-39.5	177.2	0	0	0	0	0	113	S137 K139 L145	S137-A141 VanDerWaalsContact O-CB 3.28Å; S137-A141 WeakPolarHBondContact O-CB 3.3Å; S137-A141 PolarHBondContact O-N 3.05Å; K139-A141 VanDerWaalsContact C-N 3.34Å; K139-A141 PolarHBondContact O-N 2.96Å; A141-L145 VanDerWaalsContact O-CB 3.28Å; A141-L145 WeakPolarHBondContact O-CB 3.33Å; A141-L145 PolarHBondContact O-N 3.44Å
142	Y	66.3	Low	63.1	Low	50 Å²	50	90.3 Å²	90.3	20%	0.196	45%	0.447	C	S	.	.	H	α-helix	trans	-69	-36.6	174.1	-73.1	-49.5	0	0	0	112.5	A138 K139 E140 L146 V159 Q162 L163 M166	A138-Y142 WeakPolarHBondContact O-CD2 3.49Å; A138-Y142 PolarHBondContact O-N 3.14Å; A138-Y142 VanDerWaalsContact O-N 3.11Å; K139-Y142 PolarHBondContact O-N 2.88Å; E140-Y142 PolarHBondContact O-N 3.19Å; Y142-L146 WeakPolarHBondContact O-CG 3.47Å; Y142-L146 PolarHBondContact O-N 3.19Å; Y142-V159 HydrophobicContact CD1-CG1 3.86Å; Y142-V159 HydrophobicContact CD1-CG2 4.34Å; Y142-V159 HydrophobicContact CG-CG1 4.24Å; Y142-Q162 HydrophobicContact CE2-CB 4.21Å; Y142-L163 HydrophobicContact CD2-CD2 4.46Å; Y142-L163 HydrophobicContact CG-CG 4.46Å; Y142-M166 HydrophobicContact CD2-SD 3.83Å; Y142-M166 HydrophobicContact CE2-SD 3.77Å
143	E	74.6	Confident	64.6	Low	57 Å²	57	86.6 Å²	86.6	27%	0.266	44%	0.442	S	S	.	.	H	α-helix	trans	-70.5	-39.6	176.7	-73.4	177.9	136.9	0	0	112.5	K139 E140 L146 Q147 L163 Y186	K139-E143 HydrophobicContact CG-CG 4.48Å; K139-E143 IonicContact NZ-OE1 3.32Å; K139-E143 PolarHBondContact NZ-OE1 2.96Å; K139-E143 IonicContact NZ-OE2 3.6Å; K139-E143 PolarHBondContact NZ-OE2 3.49Å; K139-E143 WeakPolarHBondContact O-CG 3.19Å; K139-E143 PolarHBondContact O-N 2.91Å; E140-E143 PolarHBondContact O-N 3.44Å; E143-L146 PolarHBondContact O-N 3.18Å; E143-Q147 PolarHBondContact O-N 2.83Å; E143-L163 HydrophobicContact CG-CD1 4.29Å; E143-L163 HydrophobicContact CG-CD2 4.31Å; E143-Y186 PolarHBondContact OE1-OH 2.78Å
144	Q	68.1	Low	65.8	Low	130 Å²	130	81.2 Å²	81.2	61%	0.607	43%	0.426	S	S	*	.	H	α-helix	trans	-62.8	-43.4	172.2	-73.9	171.2	2.5	0	0	111.7	E140 L146 Q147	E140-Q144 WeakPolarHBondContact O-CB 3.14Å; E140-Q144 VanDerWaalsContact O-CG 3.26Å; E140-Q144 WeakPolarHBondContact O-CG 3.5Å; E140-Q144 PolarHBondContact O-N 2.72Å; Q144-L146 PolarHBondContact O-N 2.74Å; Q144-Q147 WeakPolarHBondContact O-CB 3.47Å; Q144-Q147 PolarHBondContact O-N 2.92Å
145	L	64.7	Low	66.7	Low	40 Å²	40	77.5 Å²	77.5	21%	0.209	41%	0.413	C	S	.	.	H	α-helix	trans	-67	-23.7	179.4	-171.3	144.3	0	0	0	112.5	A141 Q147 T148 L151 V155 V159	A141-L145 VanDerWaalsContact O-CB 3.28Å; A141-L145 WeakPolarHBondContact O-CB 3.33Å; A141-L145 PolarHBondContact O-N 3.44Å; L145-Q147 VanDerWaalsContact C-N 3.34Å; L145-T148 PolarHBondContact O-N 2.94Å; L145-T148 PolarHBondContact O-OG1 3.29Å; L145-L151 HydrophobicContact CD2-CD1 3.87Å; L145-L151 HydrophobicContact CD2-CD2 3.92Å; L145-L151 HydrophobicContact CG-CD1 4.48Å; L145-V155 HydrophobicContact CD2-CG1 4.37Å; L145-V159 HydrophobicContact CD2-CB 4.49Å; L145-V159 HydrophobicContact CD2-CG1 4.36Å; L145-V159 HydrophobicContact CD2-CG2 3.59Å
146	L	73.6	Confident	67.7	Low	52 Å²	52	81.5 Å²	81.5	27%	0.272	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-14.4	169.2	-72.1	174.1	0	0	0	114.6	Y142 E143 Q144 L151 K156 V159 L160 L163	Y142-L146 WeakPolarHBondContact O-CG 3.47Å; Y142-L146 PolarHBondContact O-N 3.19Å; E143-L146 PolarHBondContact O-N 3.18Å; Q144-L146 PolarHBondContact O-N 2.74Å; L146-L151 HydrophobicContact CD2-CD2 4.18Å; L146-K156 HydrophobicContact CD2-CG 4.04Å; L146-V159 HydrophobicContact CD1-CG1 4.08Å; L146-V159 HydrophobicContact CD2-CB 4.26Å; L146-V159 HydrophobicContact CD2-CG1 3.89Å; L146-V159 HydrophobicContact CG-CG1 3.71Å; L146-L160 HydrophobicContact CD1-CD2 3.62Å; L146-L160 HydrophobicContact CD1-CG 4.24Å; L146-L160 HydrophobicContact CD2-CD2 4.18Å; L146-L160 HydrophobicContact CD2-CG 4.04Å; L146-L163 HydrophobicContact CD1-CD1 3.54Å
147	Q	74	Confident	68.8	Low	168 Å²	168	76.9 Å²	76.9	79%	0.785	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-3.9	172.3	-61.8	-172.8	15.8	0	0	112.9	E143 Q144 L145 E149	E143-Q147 PolarHBondContact O-N 2.83Å; Q144-Q147 WeakPolarHBondContact O-CB 3.47Å; Q144-Q147 PolarHBondContact O-N 2.92Å; L145-Q147 VanDerWaalsContact C-N 3.34Å; Q147-E149 PolarHBondContact O-N 2.89Å
148	T	73.1	Confident	69.7	Low	83 Å²	83	76.4 Å²	76.4	51%	0.509	40%	0.404	S	S	.	.	S	Bend	trans	-73.8	123.5	177.1	-53.6	0	0	0	0	110.5	L145	L145-T148 PolarHBondContact O-N 2.94Å; L145-T148 PolarHBondContact O-OG1 3.29Å
149	E	62.1	Low	70.4	Confident	168 Å²	168	75.1 Å²	75.1	79%	0.785	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	148.6	176.8	-62.7	-169.9	163.7	0	0	112	Q147 L151	Q147-E149 PolarHBondContact O-N 2.89Å; E149-L151 VanDerWaalsContact C-N 3.28Å; E149-L151 PolarHBondContact O-N 3.32Å
150	N	72.2	Confident	71.2	Confident	157 Å²	157	73.3 Å²	73.3	84%	0.84	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.7	26.2	178.8	-57.9	-67.1	0	0	0	115.9	P152	N150-P152 WeakPolarHBondContact O-CD 3.15Å
151	L	69.9	Low	72.3	Confident	41 Å²	41	69.5 Å²	69.5	22%	0.215	37%	0.367	C	S	.	.			trans	-60.8	125.1	173.7	-169.3	72.5	0	0	0	111.9	L145 L146 E149 V155 K156	L145-L151 HydrophobicContact CD2-CD1 3.87Å; L145-L151 HydrophobicContact CD2-CD2 3.92Å; L145-L151 HydrophobicContact CG-CD1 4.48Å; L146-L151 HydrophobicContact CD2-CD2 4.18Å; E149-L151 VanDerWaalsContact C-N 3.28Å; E149-L151 PolarHBondContact O-N 3.32Å; L151-V155 HydrophobicContact CD1-CB 4.28Å; L151-V155 HydrophobicContact CD1-CG1 3.86Å; L151-V155 HydrophobicContact CG-CB 4.34Å; L151-V155 HydrophobicContact CG-CG1 4.31Å; L151-K156 HydrophobicContact CD2-CB 3.89Å; L151-K156 HydrophobicContact CD2-CG 4.36Å; L151-K156 HydrophobicContact CG-CB 4.42Å
152	P	76.9	Confident	73.1	Confident	59 Å²	59	69.8 Å²	69.8	38%	0.383	36%	0.36	S	S	.	.			trans	-62	141	-178.7	-24.4	34.1	0	0	0	113.1	N150 Q154 V155 K156	N150-P152 WeakPolarHBondContact O-CD 3.15Å; P152-Q154 VanDerWaalsContact C-N 3.33Å; P152-Q154 PolarHBondContact O-N 3.23Å; P152-V155 HydrophobicContact CB-CG2 4.23Å; P152-V155 HydrophobicContact CG-CG2 4.44Å; P152-V155 WeakPolarHBondContact O-CA 3.41Å; P152-V155 WeakPolarHBondContact O-CB 3.39Å; P152-V155 PolarHBondContact O-N 2.95Å; P152-K156 PolarHBondContact O-N 3.09Å
153	A	75.4	Confident	73.7	Confident	58 Å²	58	67.4 Å²	67.4	48%	0.479	35%	0.351	S	S	.	.	H	α-helix	trans	-50.7	-46.1	-174.4	0	0	0	0	0	113.8	V155 K156 A157	A153-V155 VanDerWaalsContact C-N 3.32Å; A153-V155 PolarHBondContact O-N 2.86Å; A153-K156 WeakPolarHBondContact O-CB 3.33Å; A153-K156 PolarHBondContact O-N 2.86Å; A153-A157 WeakPolarHBondContact O-CB 3.48Å; A153-A157 PolarHBondContact O-N 2.74Å
154	Q	69.9	Low	74.2	Confident	106 Å²	106	64.7 Å²	64.7	50%	0.495	34%	0.338	S	S	.	.	H	α-helix	trans	-60.8	-37.7	177.3	-160.8	65	40.7	0	0	113.4	P152 T158 D194	P152-Q154 VanDerWaalsContact C-N 3.33Å; P152-Q154 PolarHBondContact O-N 3.23Å; Q154-T158 WeakPolarHBondContact O-CB 3.43Å; Q154-T158 PolarHBondContact O-N 2.89Å; Q154-T158 PolarHBondContact O-OG1 3.36Å; Q154-D194 PolarHBondContact NE2-OD2 3.06Å
155	V	69.8	Low	74.9	Confident	40 Å²	40	61.4 Å²	61.4	24%	0.242	32%	0.32	C	S	.	.	H	α-helix	trans	-72.8	-44.5	177.5	-176	0	0	0	0	109.8	L145 L151 P152 A153 A157 T158 V159	L145-V155 HydrophobicContact CD2-CG1 4.37Å; L151-V155 HydrophobicContact CD1-CB 4.28Å; L151-V155 HydrophobicContact CD1-CG1 3.86Å; L151-V155 HydrophobicContact CG-CB 4.34Å; L151-V155 HydrophobicContact CG-CG1 4.31Å; P152-V155 HydrophobicContact CB-CG2 4.23Å; P152-V155 HydrophobicContact CG-CG2 4.44Å; P152-V155 WeakPolarHBondContact O-CA 3.41Å; P152-V155 WeakPolarHBondContact O-CB 3.39Å; P152-V155 PolarHBondContact O-N 2.95Å; A153-V155 VanDerWaalsContact C-N 3.32Å; A153-V155 PolarHBondContact O-N 2.86Å; V155-A157 PolarHBondContact O-N 3.44Å; V155-T158 PolarHBondContact O-N 3.1Å; V155-V159 HydrophobicContact CG1-CG2 4.25Å; V155-V159 WeakPolarHBondContact O-CB 3.49Å; V155-V159 WeakPolarHBondContact O-CG2 3.41Å; V155-V159 PolarHBondContact O-N 2.92Å
156	K	76.6	Confident	75.4	Confident	104 Å²	104	61.1 Å²	61.1	45%	0.452	32%	0.318	S	S	.	.	H	α-helix	trans	-55.1	-49.5	174	-172	-179.7	178.5	-176.7	0	111.2	L146 L151 P152 A153 V159 L160 A193	L146-K156 HydrophobicContact CD2-CG 4.04Å; L151-K156 HydrophobicContact CD2-CB 3.89Å; L151-K156 HydrophobicContact CD2-CG 4.36Å; L151-K156 HydrophobicContact CG-CB 4.42Å; P152-K156 PolarHBondContact O-N 3.09Å; A153-K156 WeakPolarHBondContact O-CB 3.33Å; A153-K156 PolarHBondContact O-N 2.86Å; K156-V159 PolarHBondContact O-N 2.86Å; K156-L160 HydrophobicContact CG-CD1 3.84Å; K156-L160 WeakPolarHBondContact O-CB 3.27Å; K156-L160 WeakPolarHBondContact O-CD1 3.06Å; K156-L160 WeakPolarHBondContact O-CG 3.45Å; K156-L160 PolarHBondContact O-N 2.7Å; K156-A193 HydrophobicContact CG-CB 4.48Å
157	A	78.3	Confident	75.7	Confident	1 Å²	1	59.5 Å²	59.5	1%	0.008	31%	0.309	C	S	.	.	H	α-helix	trans	-56.2	-53.9	173.9	0	0	0	0	0	111.4	A153 V155 V159 L160 Q161 S190 A193 D194	A153-A157 WeakPolarHBondContact O-CB 3.48Å; A153-A157 PolarHBondContact O-N 2.74Å; V155-A157 PolarHBondContact O-N 3.44Å; A157-V159 VanDerWaalsContact C-N 3.26Å; A157-V159 PolarHBondContact O-N 3.5Å; A157-L160 PolarHBondContact O-N 3.49Å; A157-Q161 WeakPolarHBondContact O-CB 3.34Å; A157-Q161 PolarHBondContact O-N 3.28Å; A157-S190 WeakPolarHBondContact CB-O 3.4Å; A157-S190 PolarHBondContact O-OG 2.65Å; A157-A193 HydrophobicContact CB-CB 3.77Å; A157-D194 HydrophobicContact CB-CB 3.6Å
158	T	73.4	Confident	76	Confident	60 Å²	60	52.4 Å²	52.4	37%	0.368	28%	0.276	S	S	.	.	H	α-helix	trans	-57.3	-39.3	-178.4	-54.2	0	0	0	0	112.1	Q154 V155 Q161 Q162	Q154-T158 WeakPolarHBondContact O-CB 3.43Å; Q154-T158 PolarHBondContact O-N 2.89Å; Q154-T158 PolarHBondContact O-OG1 3.36Å; V155-T158 PolarHBondContact O-N 3.1Å; T158-Q161 WeakPolarHBondContact O-CB 3.22Å; T158-Q162 WeakPolarHBondContact O-CG 3.36Å; T158-Q162 PolarHBondContact O-N 3.37Å; T158-Q162 VanDerWaalsContact O-N 3.07Å
159	V	72.1	Confident	75.9	Confident	10 Å²	10	52.6 Å²	52.6	6%	0.061	27%	0.274	C	S	.	.	H	α-helix	trans	-71.7	-43.9	179.7	172.9	0	0	0	0	111.7	Y142 L145 L146 V155 K156 A157 Q161 Q162 L163	Y142-V159 HydrophobicContact CD1-CG1 3.86Å; Y142-V159 HydrophobicContact CD1-CG2 4.34Å; Y142-V159 HydrophobicContact CG-CG1 4.24Å; L145-V159 HydrophobicContact CD2-CB 4.49Å; L145-V159 HydrophobicContact CD2-CG1 4.36Å; L145-V159 HydrophobicContact CD2-CG2 3.59Å; L146-V159 HydrophobicContact CD1-CG1 4.08Å; L146-V159 HydrophobicContact CD2-CB 4.26Å; L146-V159 HydrophobicContact CD2-CG1 3.89Å; L146-V159 HydrophobicContact CG-CG1 3.71Å; V155-V159 HydrophobicContact CG1-CG2 4.25Å; V155-V159 WeakPolarHBondContact O-CB 3.49Å; V155-V159 WeakPolarHBondContact O-CG2 3.41Å; V155-V159 PolarHBondContact O-N 2.92Å; K156-V159 PolarHBondContact O-N 2.86Å; A157-V159 VanDerWaalsContact C-N 3.26Å; A157-V159 PolarHBondContact O-N 3.5Å; V159-Q161 VanDerWaalsContact C-N 3.31Å; V159-Q161 PolarHBondContact O-N 3.34Å; V159-Q162 PolarHBondContact O-N 2.96Å; V159-L163 HydrophobicContact CG1-CD1 4.35Å; V159-L163 PolarHBondContact O-N 3.5Å
160	L	83.6	Confident	76	Confident	8 Å²	8	46.1 Å²	46.1	4%	0.042	24%	0.244	C	C	.	.	H	α-helix	trans	-61.8	-39.5	173.6	-68.8	164.9	0	0	0	111.5	L146 K156 A157 L163 G164 Y186 K189	L146-L160 HydrophobicContact CD1-CD2 3.62Å; L146-L160 HydrophobicContact CD1-CG 4.24Å; L146-L160 HydrophobicContact CD2-CD2 4.18Å; L146-L160 HydrophobicContact CD2-CG 4.04Å; K156-L160 HydrophobicContact CG-CD1 3.84Å; K156-L160 WeakPolarHBondContact O-CB 3.27Å; K156-L160 WeakPolarHBondContact O-CD1 3.06Å; K156-L160 WeakPolarHBondContact O-CG 3.45Å; K156-L160 PolarHBondContact O-N 2.7Å; A157-L160 PolarHBondContact O-N 3.49Å; L160-L163 PolarHBondContact O-N 2.92Å; L160-G164 PolarHBondContact O-N 3.18Å; L160-Y186 HydrophobicContact CD2-CD1 3.79Å; L160-Y186 HydrophobicContact CD2-CE1 4.38Å; L160-K189 HydrophobicContact CD1-CB 3.91Å; L160-K189 WeakPolarHBondContact CD1-O 3.35Å; L160-K189 HydrophobicContact CD2-CB 4.26Å
161	Q	84.9	Confident	75.3	Confident	16 Å²	16	45.5 Å²	45.5	8%	0.075	24%	0.241	C	C	.	.	H	α-helix	trans	-59.9	-48.4	173.9	-175	-165.4	72.6	0	0	112	A157 T158 V159 G164 W165 L187 S197 S200 F203	A157-Q161 WeakPolarHBondContact O-CB 3.34Å; A157-Q161 PolarHBondContact O-N 3.28Å; T158-Q161 WeakPolarHBondContact O-CB 3.22Å; V159-Q161 VanDerWaalsContact C-N 3.31Å; V159-Q161 PolarHBondContact O-N 3.34Å; Q161-G164 PolarHBondContact O-N 3.24Å; Q161-W165 WeakPolarHBondContact O-CB 3.35Å; Q161-W165 PolarHBondContact O-N 2.86Å; Q161-L187 HydrophobicContact CG-CD2 4.3Å; Q161-S197 PolarHBondContact NE2-OG 3.2Å; Q161-S200 PolarHBondContact NE2-OG 3.36Å; Q161-F203 HydrophobicContact CG-CD2 3.67Å; Q161-F203 HydrophobicContact CG-CE2 3.81Å
162	Q	76.6	Confident	74.6	Confident	57 Å²	57	48.7 Å²	48.7	27%	0.266	26%	0.257	S	S	.	.	H	α-helix	trans	-65.8	-40.8	178.9	-64.7	-44.8	-68.1	0	0	111.6	Y142 T158 V159 W165 M166	Y142-Q162 HydrophobicContact CE2-CB 4.21Å; T158-Q162 WeakPolarHBondContact O-CG 3.36Å; T158-Q162 PolarHBondContact O-N 3.37Å; T158-Q162 VanDerWaalsContact O-N 3.07Å; V159-Q162 PolarHBondContact O-N 2.96Å; Q162-W165 PolarHBondContact O-N 3.18Å; Q162-M166 WeakPolarHBondContact O-CB 3.41Å; Q162-M166 VanDerWaalsContact O-CG 3.26Å; Q162-M166 WeakPolarHBondContact O-CG 3.5Å; Q162-M166 PolarHBondContact O-N 3.45Å
163	L	78.3	Confident	73.5	Confident	0 Å²	0	49 Å²	49	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-59.8	-46.1	173.5	-79.1	169.7	0	0	0	112.1	K139 Y142 E143 L146 V159 L160 W165 M166 H167 Y186	K139-L163 HydrophobicContact CG-CD2 3.94Å; Y142-L163 HydrophobicContact CD2-CD2 4.46Å; Y142-L163 HydrophobicContact CG-CG 4.46Å; E143-L163 HydrophobicContact CG-CD1 4.29Å; E143-L163 HydrophobicContact CG-CD2 4.31Å; L146-L163 HydrophobicContact CD1-CD1 3.54Å; V159-L163 HydrophobicContact CG1-CD1 4.35Å; V159-L163 PolarHBondContact O-N 3.5Å; L160-L163 PolarHBondContact O-N 2.92Å; L163-W165 PolarHBondContact O-N 2.94Å; L163-M166 WeakPolarHBondContact O-CB 3.46Å; L163-M166 PolarHBondContact O-N 3.1Å; L163-H167 PolarHBondContact O-CD2 3.14Å; L163-H167 VanDerWaalsContact O-CD2 3.32Å; L163-H167 PolarHBondContact O-N 3.02Å; L163-Y186 HydrophobicContact CB-CD1 4.09Å; L163-Y186 HydrophobicContact CB-CE1 4.38Å; L163-Y186 HydrophobicContact CB-CG 4.17Å; L163-Y186 HydrophobicContact CD1-CD1 4.3Å; L163-Y186 HydrophobicContact CD1-CE1 4.01Å
164	G	84.1	Confident	72.8	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-60.4	-44.4	176.7	0	0	0	0	0	112.7	L160 Q161 M166 H167 H168 A183	L160-G164 PolarHBondContact O-N 3.18Å; Q161-G164 PolarHBondContact O-N 3.24Å; G164-M166 PolarHBondContact O-N 3.43Å; G164-H167 PolarHBondContact O-N 3.36Å; G164-H168 PolarHBondContact O-N 2.86Å; G164-H168 VanDerWaalsContact O-N 3.17Å; G164-A183 WeakPolarHBondContact O-CB 3.4Å
165	W	83.4	Confident	72.8	Confident	62 Å²	62	49.4 Å²	49.4	24%	0.235	27%	0.271	C	S	.	.	H	α-helix	trans	-66.6	-34.5	176.1	-170.2	-119.6	0	0	0	113	Q161 Q162 L163 H168 N169 F203 R206	Q161-W165 WeakPolarHBondContact O-CB 3.35Å; Q161-W165 PolarHBondContact O-N 2.86Å; Q162-W165 PolarHBondContact O-N 3.18Å; L163-W165 PolarHBondContact O-N 2.94Å; W165-H168 HydrophobicContact CE3-CB 4.43Å; W165-H168 AromaticContact CE3-CD2 3.93Å; W165-H168 AromaticContact CH2-CD2 3.98Å; W165-H168 AromaticContact CZ3-CD2 3.38Å; W165-H168 WeakPolarHBondContact CZ3-CD2 3.28Å; W165-H168 AromaticContact CZ3-NE2 3.98Å; W165-H168 PolarHBondContact O-N 3.49Å; W165-N169 VanDerWaalsContact CZ2-ND2 3.3Å; W165-N169 WeakPolarHBondContact CZ2-ND2 3.45Å; W165-N169 PolarHBondContact O-N 3.18Å; W165-N169 PolarHBondContact O-ND2 3.47Å; W165-F203 HydrophobicContact CB-CD2 4.16Å; W165-F203 HydrophobicContact CB-CE2 4.09Å; W165-F203 HydrophobicContact CB-CZ 4.41Å; W165-F203 AromaticContact CD2-CD1 3.57Å; W165-F203 HydrophobicContact CD2-CD1 3.57Å; W165-F203 HydrophobicContact CD2-CD2 4.4Å; W165-F203 AromaticContact CD2-CE1 3.42Å; W165-F203 HydrophobicContact CD2-CE1 3.42Å; W165-F203 VanDerWaalsContact CD2-CE1 3.42Å; W165-F203 HydrophobicContact CD2-CE2 4.28Å; W165-F203 HydrophobicContact CD2-CG 4.08Å; W165-F203 AromaticContact CD2-CZ 3.8Å; W165-F203 HydrophobicContact CD2-CZ 3.8Å; W165-F203 AromaticContact CE2-CE1 3.58Å; W165-F203 HydrophobicContact CE3-CB 4.1Å; W165-F203 AromaticContact CE3-CD1 3.19Å; W165-F203 HydrophobicContact CE3-CD1 3.19Å; W165-F203 HydrophobicContact CE3-CD2 4.38Å; W165-F203 AromaticContact CE3-CE1 3.57Å; W165-F203 HydrophobicContact CE3-CE1 3.57Å; W165-F203 AromaticContact CE3-CG 3.66Å; W165-F203 HydrophobicContact CE3-CG 3.66Å; W165-F203 HydrophobicContact CE3-CZ 4.31Å; W165-F203 HydrophobicContact CG-CD1 4.31Å; W165-F203 HydrophobicContact CG-CD2 4.34Å; W165-F203 AromaticContact CG-CE1 3.99Å; W165-F203 HydrophobicContact CG-CE1 3.99Å; W165-F203 HydrophobicContact CG-CE2 4.04Å; W165-F203 HydrophobicContact CG-CG 4.48Å; W165-F203 AromaticContact CG-CZ 3.85Å; W165-F203 HydrophobicContact CG-CZ 3.85Å; W165-F203 HydrophobicContact CH2-CD1 4.02Å; W165-F203 HydrophobicContact CH2-CE1 4.04Å; W165-F203 HydrophobicContact CZ2-CD1 4.33Å; W165-F203 AromaticContact CZ2-CE1 3.9Å; W165-F203 HydrophobicContact CZ2-CE1 3.9Å; W165-F203 AromaticContact CZ3-CD1 3.45Å; W165-F203 HydrophobicContact CZ3-CD1 3.45Å; W165-F203 VanDerWaalsContact CZ3-CD1 3.45Å; W165-F203 AromaticContact CZ3-CE1 3.88Å; W165-F203 HydrophobicContact CZ3-CE1 3.88Å; W165-F203 HydrophobicContact CZ3-CG 4.25Å; W165-R206 HydrophobicContact CZ3-CB 4.24Å; W165-R206 HydrophobicContact CZ3-CG 4.38Å
166	M	76.1	Confident	72.8	Confident	34 Å²	34	53 Å²	53	17%	0.167	28%	0.283	C	S	.	.	H	α-helix	trans	-64.3	-38.5	172.5	-80.9	175.1	66.7	0	0	112.6	Y135 A138 K139 Y142 Q162 L163 G164 M170	Y135-M166 HydrophobicContact CD2-CE 3.69Å; Y135-M166 HydrophobicContact CE2-CB 3.87Å; Y135-M166 HydrophobicContact CE2-CE 3.49Å; Y135-M166 VanDerWaalsContact CE2-CE 3.49Å; Y135-M166 HydrophobicContact CE2-CG 4.25Å; Y135-M166 HydrophobicContact CG-CE 4.45Å; Y135-M166 PolarHBondContact OH-O 3.31Å; A138-M166 HydrophobicContact CB-CE 4.13Å; K139-M166 HydrophobicContact CB-CE 3.92Å; Y142-M166 HydrophobicContact CD2-SD 3.83Å; Y142-M166 HydrophobicContact CE2-SD 3.77Å; Q162-M166 WeakPolarHBondContact O-CB 3.41Å; Q162-M166 VanDerWaalsContact O-CG 3.26Å; Q162-M166 WeakPolarHBondContact O-CG 3.5Å; Q162-M166 PolarHBondContact O-N 3.45Å; L163-M166 WeakPolarHBondContact O-CB 3.46Å; L163-M166 PolarHBondContact O-N 3.1Å; G164-M166 PolarHBondContact O-N 3.43Å; M166-M170 WeakPolarHBondContact O-CG 3.42Å
167	H	78.8	Confident	72.7	Confident	17 Å²	17	50.8 Å²	50.8	8%	0.079	29%	0.285	C	S	.	.	H	α-helix	trans	-68.4	-38.2	176	-88.2	-85.2	0	0	0	113.1	K139 L163 G164 A183 Y186	K139-H167 WeakPolarHBondContact CE-NE2 3.08Å; L163-H167 PolarHBondContact O-CD2 3.14Å; L163-H167 VanDerWaalsContact O-CD2 3.32Å; L163-H167 PolarHBondContact O-N 3.02Å; G164-H167 PolarHBondContact O-N 3.36Å; H167-A183 HydrophobicContact CB-CB 3.98Å; H167-Y186 AromaticContact CD2-CD2 3.9Å; H167-Y186 AromaticContact CD2-CE2 3.73Å; H167-Y186 AromaticContact NE2-CE2 3.67Å
168	H	79.9	Confident	72.7	Confident	20 Å²	20	53.6 Å²	53.6	9%	0.093	30%	0.302	C	S	.	.	H	α-helix	trans	-63.5	-48.4	177.7	-177	70.8	0	0	0	112.6	G164 W165 M170 K179 E180 A183	G164-H168 PolarHBondContact O-N 2.86Å; G164-H168 VanDerWaalsContact O-N 3.17Å; W165-H168 HydrophobicContact CE3-CB 4.43Å; W165-H168 AromaticContact CE3-CD2 3.93Å; W165-H168 AromaticContact CH2-CD2 3.98Å; W165-H168 AromaticContact CZ3-CD2 3.38Å; W165-H168 WeakPolarHBondContact CZ3-CD2 3.28Å; W165-H168 AromaticContact CZ3-NE2 3.98Å; W165-H168 PolarHBondContact O-N 3.49Å; H168-M170 VanDerWaalsContact C-N 3.33Å; H168-M170 PolarHBondContact O-N 3.42Å; H168-K179 PolarHBondContact O-NZ 2.69Å; H168-E180 IonicContact CE1-OE1 3.23Å; H168-E180 IonicContact CE1-OE2 3.66Å; H168-E180 IonicContact CG-OE2 2.7Å; H168-E180 IonicContact ND1-OE1 3.07Å; H168-E180 PolarHBondContact ND1-OE1 2.83Å; H168-E180 IonicContact ND1-OE2 2.74Å; H168-E180 PolarHBondContact ND1-OE2 3.05Å; H168-A183 HydrophobicContact CB-CB 4.2Å
169	N	71.2	Confident	72.9	Confident	86 Å²	86	51.9 Å²	51.9	46%	0.46	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	6.8	-168.2	-70.5	-88.6	0	0	0	115.5	W165	W165-N169 VanDerWaalsContact CZ2-ND2 3.3Å; W165-N169 WeakPolarHBondContact CZ2-ND2 3.45Å; W165-N169 PolarHBondContact O-N 3.18Å; W165-N169 PolarHBondContact O-ND2 3.47Å
170	M	65.6	Low	73.4	Confident	32 Å²	32	51.7 Å²	51.7	16%	0.158	29%	0.287	C	S	.	.			trans	-108.2	129.4	-179	-73.7	-69.4	-73.6	0	0	112.2	Y135 M166 H168 L172 K179	Y135-M170 HydrophobicContact CD1-CE 3.92Å; Y135-M170 HydrophobicContact CD2-CE 3.88Å; Y135-M170 HydrophobicContact CD2-CG 3.88Å; Y135-M170 HydrophobicContact CD2-SD 3.85Å; Y135-M170 HydrophobicContact CE1-CE 4.23Å; Y135-M170 HydrophobicContact CE1-CG 4.49Å; Y135-M170 HydrophobicContact CE2-CE 4.19Å; Y135-M170 HydrophobicContact CE2-CG 3.39Å; Y135-M170 HydrophobicContact CE2-SD 4.03Å; Y135-M170 HydrophobicContact CG-CE 3.74Å; Y135-M170 HydrophobicContact CG-SD 4.31Å; M166-M170 WeakPolarHBondContact O-CG 3.42Å; H168-M170 VanDerWaalsContact C-N 3.33Å; H168-M170 PolarHBondContact O-N 3.42Å; M170-L172 HydrophobicContact CE-CB 4.37Å; M170-K179 WeakPolarHBondContact O-CD 3.25Å; M170-K179 PolarHBondContact O-NZ 3.13Å
171	D	57.1	Low	73.5	Confident	145 Å²	145	54.8 Å²	54.8	78%	0.775	31%	0.31	S	S	*	.	S	Bend	trans	-101.6	25.1	-179.9	-56.4	-41.5	0	0	0	112.5	K179	D171-K179 IonicContact OD1-NZ 2.8Å; D171-K179 PolarHBondContact OD1-NZ 3.28Å
172	L	55.1	Low	73.5	Confident	107 Å²	107	60 Å²	60	56%	0.56	33%	0.33	S	S	*	.	S	Bend	trans	-131.3	2.1	-167.7	-91	154.2	0	0	0	114.5	K132 M170	K132-L172 HydrophobicContact CD-CD1 4.39Å; K132-L172 HydrophobicContact CG-CD1 4.19Å; M170-L172 HydrophobicContact CE-CB 4.37Å
173	V	53.3	Low	74	Confident	65 Å²	65	57.2 Å²	57.2	39%	0.394	32%	0.317	S	S	.	.	S	Bend	trans	-133.7	103.7	-176.9	-176.1	0	0	0	0	109.9
174	G	60.4	Low	74.6	Confident	65 Å²	65	58.1 Å²	58.1	67%	0.67	32%	0.322	S	S	*	.	S	Bend	trans	77.6	177.3	174.2	0	0	0	0	0	115.4
175	D	70.8	Confident	74.9	Confident	108 Å²	108	62.3 Å²	62.3	58%	0.578	34%	0.341	S	S	*	.			trans	-70.3	154.6	168.6	171.2	51.1	0	0	0	110.6	A177 T178 K179	D175-A177 VanDerWaalsContact C-N 3.25Å; D175-A177 PolarHBondContact O-N 3.15Å; D175-A177 WeakPolarHBondContact OD2-CB 3.48Å; D175-A177 PolarHBondContact OD2-N 3.18Å; D175-T178 HydrophobicContact CB-CG2 4.42Å; D175-T178 PolarHBondContact N-OG1 3.09Å; D175-T178 VanDerWaalsContact N-OG1 3.13Å; D175-T178 WeakPolarHBondContact O-CA 3.15Å; D175-T178 PolarHBondContact O-N 3.46Å; D175-T178 PolarHBondContact O-OG1 2.96Å; D175-K179 PolarHBondContact O-N 3.29Å; D175-K179 VanDerWaalsContact O-N 3.1Å
176	K	69.9	Low	75.2	Confident	115 Å²	115	61 Å²	61	50%	0.5	34%	0.337	S	S	.	.	H	α-helix	trans	-54	-41.1	-178.1	-172.1	-174.4	171	-167.5	0	111.7	T178 K179 E180 S210	K176-T178 VanDerWaalsContact C-N 3.28Å; K176-T178 PolarHBondContact O-N 3.41Å; K176-K179 PolarHBondContact O-N 2.68Å; K176-E180 WeakPolarHBondContact O-CG 3.24Å; K176-E180 PolarHBondContact O-N 3.26Å; K176-S210 WeakPolarHBondContact CE-O 3.44Å; K176-S210 PolarHBondContact NZ-O 3.4Å
177	A	74.6	Confident	75.9	Confident	59 Å²	59	59.4 Å²	59.4	49%	0.488	33%	0.329	S	S	.	.	H	α-helix	trans	-62.7	-36.8	178	0	0	0	0	0	112.2	D175 S181	D175-A177 VanDerWaalsContact C-N 3.25Å; D175-A177 PolarHBondContact O-N 3.15Å; D175-A177 WeakPolarHBondContact OD2-CB 3.48Å; D175-A177 PolarHBondContact OD2-N 3.18Å; A177-S181 WeakPolarHBondContact O-CB 3.26Å; A177-S181 PolarHBondContact O-N 3.1Å; A177-S181 PolarHBondContact O-OG 3.26Å
178	T	77.3	Confident	76.6	Confident	60 Å²	60	62.4 Å²	62.4	37%	0.368	34%	0.342	S	S	.	.	H	α-helix	trans	-72.3	-42.2	-179.3	67.1	0	0	0	0	112.6	D175 K176 E180 S181 Y182	D175-T178 HydrophobicContact CB-CG2 4.42Å; D175-T178 PolarHBondContact N-OG1 3.09Å; D175-T178 VanDerWaalsContact N-OG1 3.13Å; D175-T178 WeakPolarHBondContact O-CA 3.15Å; D175-T178 PolarHBondContact O-N 3.46Å; D175-T178 PolarHBondContact O-OG1 2.96Å; K176-T178 VanDerWaalsContact C-N 3.28Å; K176-T178 PolarHBondContact O-N 3.41Å; T178-E180 PolarHBondContact O-N 2.75Å; T178-S181 PolarHBondContact O-N 3.16Å; T178-Y182 WeakPolarHBondContact O-CD2 3.23Å; T178-Y182 PolarHBondContact O-N 3.38Å; T178-Y182 VanDerWaalsContact O-N 3.13Å
179	K	78.1	Confident	77.2	Confident	23 Å²	23	65.2 Å²	65.2	10%	0.1	35%	0.354	C	S	.	.	H	α-helix	trans	-65.4	-42	-179.1	77.3	168.7	-176	162.2	0	112.6	H168 M170 D171 D175 K176 S181 Y182 A183	H168-K179 PolarHBondContact O-NZ 2.69Å; M170-K179 WeakPolarHBondContact O-CD 3.25Å; M170-K179 PolarHBondContact O-NZ 3.13Å; D171-K179 IonicContact OD1-NZ 2.8Å; D171-K179 PolarHBondContact OD1-NZ 3.28Å; D175-K179 PolarHBondContact O-N 3.29Å; D175-K179 VanDerWaalsContact O-N 3.1Å; K176-K179 PolarHBondContact O-N 2.68Å; K179-S181 VanDerWaalsContact C-N 3.34Å; K179-Y182 PolarHBondContact O-N 2.95Å; K179-A183 WeakPolarHBondContact O-CB 3.28Å; K179-A183 PolarHBondContact O-N 3.36Å
180	E	82.9	Confident	78.1	Confident	6 Å²	6	61.1 Å²	61.1	3%	0.028	33%	0.332	C	S	.	.	H	α-helix	trans	-70.1	-33.6	178.6	-56.8	-61.3	166.3	0	0	111.2	H168 K176 T178 A183 I184 S210 I211	H168-E180 IonicContact CE1-OE1 3.23Å; H168-E180 IonicContact CE1-OE2 3.66Å; H168-E180 IonicContact CG-OE2 2.7Å; H168-E180 IonicContact ND1-OE1 3.07Å; H168-E180 PolarHBondContact ND1-OE1 2.83Å; H168-E180 IonicContact ND1-OE2 2.74Å; H168-E180 PolarHBondContact ND1-OE2 3.05Å; K176-E180 WeakPolarHBondContact O-CG 3.24Å; K176-E180 PolarHBondContact O-N 3.26Å; T178-E180 PolarHBondContact O-N 2.75Å; E180-A183 PolarHBondContact O-N 3.42Å; E180-I184 WeakPolarHBondContact O-CB 3.19Å; E180-I184 WeakPolarHBondContact O-CD1 3.36Å; E180-I184 VanDerWaalsContact O-CG1 3.23Å; E180-I184 WeakPolarHBondContact O-CG1 3.32Å; E180-I184 PolarHBondContact O-N 2.99Å; E180-S210 PolarHBondContact OE1-OG 3.17Å; E180-S210 PolarHBondContact OE2-OG 3.03Å; E180-I211 HydrophobicContact CB-CG2 3.51Å; E180-I211 HydrophobicContact CG-CG2 3.66Å
181	S	85.5	Confident	79.2	Confident	74 Å²	74	60.3 Å²	60.3	52%	0.517	33%	0.329	S	S	.	.	H	α-helix	trans	-62	-43.9	174.1	-62.5	0	0	0	0	112.2	A177 T178 K179 Q185	A177-S181 WeakPolarHBondContact O-CB 3.26Å; A177-S181 PolarHBondContact O-N 3.1Å; A177-S181 PolarHBondContact O-OG 3.26Å; T178-S181 PolarHBondContact O-N 3.16Å; K179-S181 VanDerWaalsContact C-N 3.34Å; S181-Q185 WeakPolarHBondContact O-CB 3.26Å; S181-Q185 PolarHBondContact O-N 3.06Å
182	Y	84.4	Confident	80.8	Confident	124 Å²	124	60.7 Å²	60.7	49%	0.486	33%	0.326	S	S	.	.	H	α-helix	trans	-66.2	-44.5	173	-75.5	-67.1	0	0	0	111.8	T178 K179 I184 Q185 Y186	T178-Y182 WeakPolarHBondContact O-CD2 3.23Å; T178-Y182 PolarHBondContact O-N 3.38Å; T178-Y182 VanDerWaalsContact O-N 3.13Å; K179-Y182 PolarHBondContact O-N 2.95Å; Y182-I184 PolarHBondContact O-N 3.23Å; Y182-Q185 PolarHBondContact O-N 2.81Å; Y182-Y186 WeakPolarHBondContact O-CD2 3.43Å; Y182-Y186 PolarHBondContact O-N 3Å
183	A	86.8	Confident	82.3	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-56.2	-48.6	178	0	0	0	0	0	112	G164 H167 H168 K179 E180 Q185 Y186 L187	G164-A183 WeakPolarHBondContact O-CB 3.4Å; H167-A183 HydrophobicContact CB-CB 3.98Å; H168-A183 HydrophobicContact CB-CB 4.2Å; K179-A183 WeakPolarHBondContact O-CB 3.28Å; K179-A183 PolarHBondContact O-N 3.36Å; E180-A183 PolarHBondContact O-N 3.42Å; A183-Q185 PolarHBondContact O-N 2.83Å; A183-Y186 PolarHBondContact O-N 2.64Å; A183-L187 WeakPolarHBondContact O-CB 3.21Å; A183-L187 WeakPolarHBondContact O-CD1 3.33Å; A183-L187 VanDerWaalsContact O-CG 3.25Å; A183-L187 WeakPolarHBondContact O-CG 3.3Å; A183-L187 PolarHBondContact O-N 3.02Å
184	I	91.2	Very high	83.7	Confident	19 Å²	19	54.4 Å²	54.4	10%	0.097	29%	0.294	C	S	.	.	H	α-helix	trans	-59.5	-46.1	175.5	-70.6	164.5	0	0	0	111	E180 Y182 Y186 L187 Q188 L204 C207 Y208 I211	E180-I184 WeakPolarHBondContact O-CB 3.19Å; E180-I184 WeakPolarHBondContact O-CD1 3.36Å; E180-I184 VanDerWaalsContact O-CG1 3.23Å; E180-I184 WeakPolarHBondContact O-CG1 3.32Å; E180-I184 PolarHBondContact O-N 2.99Å; Y182-I184 PolarHBondContact O-N 3.23Å; I184-Y186 PolarHBondContact O-N 2.71Å; I184-L187 PolarHBondContact O-N 3.04Å; I184-Q188 HydrophobicContact CG2-CG 4.26Å; I184-Q188 WeakPolarHBondContact O-CB 3.49Å; I184-Q188 VanDerWaalsContact O-CG 3.3Å; I184-Q188 WeakPolarHBondContact O-CG 3.39Å; I184-Q188 PolarHBondContact O-N 2.85Å; I184-L204 HydrophobicContact CB-CD1 4.37Å; I184-L204 HydrophobicContact CG1-CD1 4.18Å; I184-L204 HydrophobicContact CG2-CD1 4.05Å; I184-C207 HydrophobicContact CD1-CB 4.18Å; I184-C207 HydrophobicContact CG1-CB 3.61Å; I184-Y208 HydrophobicContact CD1-CD1 3.83Å; I184-Y208 HydrophobicContact CD1-CE1 3.86Å; I184-Y208 HydrophobicContact CG1-CD1 4.38Å; I184-Y208 HydrophobicContact CG1-CE1 4.23Å; I184-Y208 HydrophobicContact CG2-CE1 4.13Å; I184-I211 HydrophobicContact CD1-CD1 3.95Å
185	Q	90.8	Very high	84.9	Confident	88 Å²	88	55 Å²	55	41%	0.411	29%	0.286	S	S	.	.	H	α-helix	trans	-63.6	-41.3	-179.2	-164.6	-166.1	79.2	0	0	112.5	S181 Y182 A183 K189	S181-Q185 WeakPolarHBondContact O-CB 3.26Å; S181-Q185 PolarHBondContact O-N 3.06Å; Y182-Q185 PolarHBondContact O-N 2.81Å; A183-Q185 PolarHBondContact O-N 2.83Å; Q185-K189 HydrophobicContact CG-CD 4.41Å; Q185-K189 WeakPolarHBondContact O-CG 3.49Å; Q185-K189 PolarHBondContact O-N 3.07Å; Q185-K189 VanDerWaalsContact O-N 3.12Å
186	Y	89.9	Confident	85.6	Confident	35 Å²	35	54.9 Å²	54.9	14%	0.137	29%	0.285	C	S	.	.	H	α-helix	trans	-67.4	-38.2	175.4	-77.5	-68.4	0	0	0	111.9	E143 L160 L163 H167 Y182 A183 I184 K189 S190	E143-Y186 PolarHBondContact OE1-OH 2.78Å; L160-Y186 HydrophobicContact CD2-CD1 3.79Å; L160-Y186 HydrophobicContact CD2-CE1 4.38Å; L163-Y186 HydrophobicContact CB-CD1 4.09Å; L163-Y186 HydrophobicContact CB-CE1 4.38Å; L163-Y186 HydrophobicContact CB-CG 4.17Å; L163-Y186 HydrophobicContact CD1-CD1 4.3Å; L163-Y186 HydrophobicContact CD1-CE1 4.01Å; H167-Y186 AromaticContact CD2-CD2 3.9Å; H167-Y186 AromaticContact CD2-CE2 3.73Å; H167-Y186 AromaticContact NE2-CE2 3.67Å; Y182-Y186 WeakPolarHBondContact O-CD2 3.43Å; Y182-Y186 PolarHBondContact O-N 3Å; A183-Y186 PolarHBondContact O-N 2.64Å; I184-Y186 PolarHBondContact O-N 2.71Å; Y186-K189 PolarHBondContact O-N 3Å; Y186-S190 PolarHBondContact O-N 3.26Å
187	L	91.1	Very high	86.2	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-71.2	-35.1	178	-70.9	164.5	0	0	0	113.1	Q161 A183 I184 S190 L191 F203 L204 C207	Q161-L187 HydrophobicContact CG-CD2 4.3Å; A183-L187 WeakPolarHBondContact O-CB 3.21Å; A183-L187 WeakPolarHBondContact O-CD1 3.33Å; A183-L187 VanDerWaalsContact O-CG 3.25Å; A183-L187 WeakPolarHBondContact O-CG 3.3Å; A183-L187 PolarHBondContact O-N 3.02Å; I184-L187 PolarHBondContact O-N 3.04Å; L187-S190 WeakPolarHBondContact O-CB 3.35Å; L187-S190 PolarHBondContact O-N 3.29Å; L187-L191 WeakPolarHBondContact O-CG 3.32Å; L187-L191 PolarHBondContact O-N 2.6Å; L187-F203 HydrophobicContact CD1-CB 3.81Å; L187-F203 HydrophobicContact CD2-CB 3.68Å; L187-F203 HydrophobicContact CD2-CD2 4.21Å; L187-F203 HydrophobicContact CD2-CG 4.47Å; L187-F203 HydrophobicContact CG-CB 4.42Å; L187-L204 HydrophobicContact CB-CB 4.41Å; L187-L204 HydrophobicContact CB-CD1 4.27Å; L187-C207 VanDerWaalsContact CD1-SG 3.6Å
188	Q	92.9	Very high	86.7	Confident	79 Å²	79	47.7 Å²	47.7	37%	0.369	25%	0.246	S	C	.	.	H	α-helix	trans	-62.6	-49.3	170.7	-74.3	170.2	-18.3	0	0	110.9	I184 S190 L191 E192 Y208	I184-Q188 HydrophobicContact CG2-CG 4.26Å; I184-Q188 WeakPolarHBondContact O-CB 3.49Å; I184-Q188 VanDerWaalsContact O-CG 3.3Å; I184-Q188 WeakPolarHBondContact O-CG 3.39Å; I184-Q188 PolarHBondContact O-N 2.85Å; Q188-S190 PolarHBondContact O-N 3.22Å; Q188-L191 CarbonylContact O-C 3.46Å; Q188-L191 PolarHBondContact O-N 2.9Å; Q188-E192 WeakPolarHBondContact O-CG 3.27Å; Q188-E192 PolarHBondContact O-N 2.8Å; Q188-Y208 PolarHBondContact NE2-OH 3.02Å
189	K	91.3	Very high	87	Confident	79 Å²	79	48.4 Å²	48.4	34%	0.343	25%	0.246	S	C	.	.	H	α-helix	trans	-61.6	-27.9	174.3	-69	169.1	177.2	171.5	0	113.2	L160 Q185 Y186 A193	L160-K189 HydrophobicContact CD1-CB 3.91Å; L160-K189 WeakPolarHBondContact CD1-O 3.35Å; L160-K189 HydrophobicContact CD2-CB 4.26Å; Q185-K189 HydrophobicContact CG-CD 4.41Å; Q185-K189 WeakPolarHBondContact O-CG 3.49Å; Q185-K189 PolarHBondContact O-N 3.07Å; Q185-K189 VanDerWaalsContact O-N 3.12Å; Y186-K189 PolarHBondContact O-N 3Å; K189-A193 PolarHBondContact O-N 3.38Å
190	S	90.1	Very high	87.4	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-66.3	-44.7	171	-178.3	0	0	0	0	111.4	A157 Y186 L187 Q188 A193 D194 S200	A157-S190 WeakPolarHBondContact CB-O 3.4Å; A157-S190 PolarHBondContact O-OG 2.65Å; Y186-S190 PolarHBondContact O-N 3.26Å; L187-S190 WeakPolarHBondContact O-CB 3.35Å; L187-S190 PolarHBondContact O-N 3.29Å; Q188-S190 PolarHBondContact O-N 3.22Å; S190-A193 CarbonylContact O-C 3.47Å; S190-A193 PolarHBondContact O-N 2.84Å; S190-A193 VanDerWaalsContact O-N 3.12Å; S190-D194 PolarHBondContact O-N 3.37Å; S190-S200 PolarHBondContact OG-OG 3.1Å
191	L	90.1	Very high	87.8	Confident	16 Å²	16	49.7 Å²	49.7	8%	0.084	25%	0.25	C	C	.	.	H	α-helix	trans	-71.7	-27.9	178.2	-68.8	170.2	0	0	0	113.1	L187 Q188 A193 D194 P195 W201 L204	L187-L191 WeakPolarHBondContact O-CG 3.32Å; L187-L191 PolarHBondContact O-N 2.6Å; Q188-L191 CarbonylContact O-C 3.46Å; Q188-L191 PolarHBondContact O-N 2.9Å; L191-A193 PolarHBondContact O-N 2.73Å; L191-D194 CarbonylContact O-C 3.5Å; L191-P195 WeakPolarHBondContact O-CA 3.44Å; L191-P195 WeakPolarHBondContact O-CD 3.32Å; L191-P195 WeakPolarHBondContact O-CG 3.45Å; L191-P195 VanDerWaalsContact O-N 3.14Å; L191-W201 HydrophobicContact CD1-CD2 3.71Å; L191-W201 HydrophobicContact CD1-CE3 3.76Å; L191-W201 HydrophobicContact CD1-CG 4.32Å; L191-W201 HydrophobicContact CD1-CH2 4.04Å; L191-W201 HydrophobicContact CD1-CZ2 3.98Å; L191-W201 HydrophobicContact CD1-CZ3 3.93Å; L191-W201 HydrophobicContact CD2-CD2 3.97Å; L191-W201 HydrophobicContact CD2-CG 3.96Å; L191-W201 HydrophobicContact CD2-CZ2 4.26Å; L191-L204 HydrophobicContact CD1-CD2 3.77Å
192	E	90.9	Very high	88.1	Confident	152 Å²	152	46.9 Å²	46.9	71%	0.71	23%	0.228	S	C	*	.	H	α-helix	trans	-63.6	-28.2	167.2	-69.9	166	-169	0	0	112.5	Q188	Q188-E192 WeakPolarHBondContact O-CG 3.27Å; Q188-E192 PolarHBondContact O-N 2.8Å
193	A	84.9	Confident	88.3	Confident	22 Å²	22	41.7 Å²	41.7	18%	0.182	21%	0.208	C	C	.	.	H	α-helix	trans	-96	-28	-179.3	0	0	0	0	0	113.8	K156 A157 K189 S190 L191	K156-A193 HydrophobicContact CG-CB 4.48Å; A157-A193 HydrophobicContact CB-CB 3.77Å; K189-A193 PolarHBondContact O-N 3.38Å; S190-A193 CarbonylContact O-C 3.47Å; S190-A193 PolarHBondContact O-N 2.84Å; S190-A193 VanDerWaalsContact O-N 3.12Å; L191-A193 PolarHBondContact O-N 2.73Å
194	D	83.8	Confident	88.5	Confident	19 Å²	19	42 Å²	42	10%	0.102	21%	0.209	C	C	.	.			trans	-145.2	95.1	168	174.8	14	0	0	0	110.8	Q154 A157 S190 L191 N196 S197	Q154-D194 PolarHBondContact NE2-OD2 3.06Å; A157-D194 HydrophobicContact CB-CB 3.6Å; S190-D194 PolarHBondContact O-N 3.37Å; L191-D194 CarbonylContact O-C 3.5Å; D194-N196 PolarHBondContact O-N 3.25Å; D194-N196 PolarHBondContact OD1-N 3.36Å; D194-S197 VanDerWaalsContact O-CB 3.3Å; D194-S197 WeakPolarHBondContact O-CB 3.45Å; D194-S197 PolarHBondContact O-N 3.25Å; D194-S197 PolarHBondContact OD1-N 2.8Å; D194-S197 WeakPolarHBondContact OD2-CB 3.32Å
195	P	86.6	Confident	88.4	Confident	78 Å²	78	41 Å²	41	51%	0.506	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-18.5	178.6	-23.8	33.8	0	0	0	114.9	L191 S197 W201	L191-P195 WeakPolarHBondContact O-CA 3.44Å; L191-P195 WeakPolarHBondContact O-CD 3.32Å; L191-P195 WeakPolarHBondContact O-CG 3.45Å; L191-P195 VanDerWaalsContact O-N 3.14Å; P195-S197 VanDerWaalsContact C-N 3.34Å; P195-W201 PolarHBondContact O-NE1 2.97Å; P195-W201 VanDerWaalsContact O-NE1 3.16Å
196	N	83.7	Confident	88.3	Confident	105 Å²	105	41.1 Å²	41.1	56%	0.561	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.5	2.7	-179	-65	-46.6	0	0	0	112.6	D194 G198	D194-N196 PolarHBondContact O-N 3.25Å; D194-N196 PolarHBondContact OD1-N 3.36Å; N196-G198 VanDerWaalsContact C-N 3.34Å; N196-G198 PolarHBondContact O-N 2.85Å
197	S	83.3	Confident	88.3	Confident	17 Å²	17	39.5 Å²	39.5	12%	0.119	20%	0.195	C	C	.	.			trans	-71.3	80.3	179.4	-162.9	0	0	0	0	112.3	Q161 D194 P195 Q199 S200 W201	Q161-S197 PolarHBondContact NE2-OG 3.2Å; D194-S197 VanDerWaalsContact O-CB 3.3Å; D194-S197 WeakPolarHBondContact O-CB 3.45Å; D194-S197 PolarHBondContact O-N 3.25Å; D194-S197 PolarHBondContact OD1-N 2.8Å; D194-S197 WeakPolarHBondContact OD2-CB 3.32Å; P195-S197 VanDerWaalsContact C-N 3.34Å; S197-Q199 PolarHBondContact O-N 3.41Å; S197-S200 WeakPolarHBondContact CB-OG 3.3Å; S197-S200 WeakPolarHBondContact O-CA 3.2Å; S197-S200 VanDerWaalsContact O-CB 3.29Å; S197-S200 WeakPolarHBondContact O-CB 3.31Å; S197-S200 PolarHBondContact O-N 3.46Å; S197-S200 PolarHBondContact OG-OG 3Å; S197-W201 PolarHBondContact O-N 2.96Å
198	G	84.7	Confident	88.3	Confident	5 Å²	5	40.9 Å²	40.9	5%	0.052	20%	0.2	C	C	.	.	H	α-helix	trans	-51.9	-40	177.3	0	0	0	0	0	113.4	N196 S200 W201 Y202 S224	N196-G198 VanDerWaalsContact C-N 3.34Å; N196-G198 PolarHBondContact O-N 2.85Å; G198-S200 PolarHBondContact O-N 3.3Å; G198-W201 WeakPolarHBondContact O-CB 3.12Å; G198-W201 PolarHBondContact O-N 3.3Å; G198-W201 VanDerWaalsContact O-N 3.08Å; G198-Y202 PolarHBondContact O-N 3.11Å; G198-S224 PolarHBondContact O-OG 2.85Å
199	Q	83.8	Confident	88.1	Confident	76 Å²	76	38.2 Å²	38.2	36%	0.355	19%	0.19	S	C	.	.	H	α-helix	trans	-61	-29.2	174.7	-174.4	65.8	73.6	0	0	113.5	S197 F203	S197-Q199 PolarHBondContact O-N 3.41Å; Q199-F203 HydrophobicContact CG-CD2 4.45Å; Q199-F203 HydrophobicContact CG-CE2 3.89Å; Q199-F203 HydrophobicContact CG-CZ 4.07Å; Q199-F203 VanDerWaalsContact NE2-CE1 3.26Å; Q199-F203 VanDerWaalsContact NE2-CZ 3.27Å; Q199-F203 VanDerWaalsContact O-CD2 3.3Å; Q199-F203 WeakPolarHBondContact O-CD2 3.33Å; Q199-F203 WeakPolarHBondContact O-CG 3.38Å; Q199-F203 PolarHBondContact O-N 2.55Å
200	S	87.4	Confident	87.8	Confident	0 Å²	0	36 Å²	36	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-74.9	-39.8	173	-56.5	0	0	0	0	111.6	Q161 S190 S197 G198 Y202 F203 L204	Q161-S200 PolarHBondContact NE2-OG 3.36Å; S190-S200 PolarHBondContact OG-OG 3.1Å; S197-S200 WeakPolarHBondContact CB-OG 3.3Å; S197-S200 WeakPolarHBondContact O-CA 3.2Å; S197-S200 VanDerWaalsContact O-CB 3.29Å; S197-S200 WeakPolarHBondContact O-CB 3.31Å; S197-S200 PolarHBondContact O-N 3.46Å; S197-S200 PolarHBondContact OG-OG 3Å; G198-S200 PolarHBondContact O-N 3.3Å; S200-Y202 VanDerWaalsContact C-N 3.34Å; S200-F203 PolarHBondContact O-N 2.81Å; S200-L204 WeakPolarHBondContact O-CB 3.26Å; S200-L204 PolarHBondContact O-N 3.26Å
201	W	91.1	Very high	87.6	Confident	56 Å²	56	39.3 Å²	39.3	21%	0.212	20%	0.202	C	C	.	.	H	α-helix	trans	-60.4	-41.2	171.6	-73.7	111.9	0	0	0	112.1	L191 P195 S197 G198 L204 G205 Q223	L191-W201 HydrophobicContact CD1-CD2 3.71Å; L191-W201 HydrophobicContact CD1-CE3 3.76Å; L191-W201 HydrophobicContact CD1-CG 4.32Å; L191-W201 HydrophobicContact CD1-CH2 4.04Å; L191-W201 HydrophobicContact CD1-CZ2 3.98Å; L191-W201 HydrophobicContact CD1-CZ3 3.93Å; L191-W201 HydrophobicContact CD2-CD2 3.97Å; L191-W201 HydrophobicContact CD2-CG 3.96Å; L191-W201 HydrophobicContact CD2-CZ2 4.26Å; P195-W201 PolarHBondContact O-NE1 2.97Å; P195-W201 VanDerWaalsContact O-NE1 3.16Å; S197-W201 PolarHBondContact O-N 2.96Å; G198-W201 WeakPolarHBondContact O-CB 3.12Å; G198-W201 PolarHBondContact O-N 3.3Å; G198-W201 VanDerWaalsContact O-N 3.08Å; W201-L204 HydrophobicContact CE3-CD2 4.18Å; W201-L204 HydrophobicContact CZ3-CD2 4.15Å; W201-L204 PolarHBondContact O-N 3.36Å; W201-G205 PolarHBondContact O-N 3.22Å; W201-Q223 HydrophobicContact CB-CB 4.3Å; W201-Q223 HydrophobicContact CD2-CB 3.57Å; W201-Q223 HydrophobicContact CD2-CG 4.35Å; W201-Q223 HydrophobicContact CE3-CB 3.78Å; W201-Q223 HydrophobicContact CE3-CG 4.28Å; W201-Q223 HydrophobicContact CG-CB 3.82Å; W201-Q223 HydrophobicContact CH2-CG 4.46Å; W201-Q223 HydrophobicContact CZ3-CB 4.34Å; W201-Q223 HydrophobicContact CZ3-CG 4.34Å
202	Y	90.4	Very high	87.3	Confident	14 Å²	14	41.2 Å²	41.2	6%	0.055	23%	0.225	C	C	.	.	H	α-helix	trans	-58.7	-52.5	172.7	171.3	-107.4	0	0	0	112.1	G198 S200 L204 G205 R206 Y221 S224 D233 T234 S237	G198-Y202 PolarHBondContact O-N 3.11Å; S200-Y202 VanDerWaalsContact C-N 3.34Å; Y202-L204 VanDerWaalsContact C-N 3.27Å; Y202-L204 PolarHBondContact O-N 3.3Å; Y202-G205 PolarHBondContact O-N 3.44Å; Y202-G205 VanDerWaalsContact O-N 3.15Å; Y202-R206 HydrophobicContact CD1-CG 4.34Å; Y202-R206 HydrophobicContact CD2-CG 4.4Å; Y202-R206 HydrophobicContact CE1-CG 3.9Å; Y202-R206 HydrophobicContact CE2-CG 3.93Å; Y202-R206 WeakPolarHBondContact O-CG 3.33Å; Y202-R206 PolarHBondContact O-N 3.3Å; Y202-R206 PolarHBondContact OH-NH1 3.2Å; Y202-Y221 HydrophobicContact CD2-CD1 4.08Å; Y202-Y221 AromaticContact CD2-CE1 3.96Å; Y202-Y221 HydrophobicContact CD2-CE1 3.96Å; Y202-Y221 HydrophobicContact CE2-CE1 4.14Å; Y202-S224 WeakPolarHBondContact CB-OG 3.27Å; Y202-D233 HydrophobicContact CE1-CB 4.43Å; Y202-D233 HydrophobicContact CE2-CB 4.23Å; Y202-D233 WeakPolarHBondContact CE2-O 3.17Å; Y202-T234 HydrophobicContact CD2-CG2 4.24Å; Y202-T234 VanDerWaalsContact CD2-OG1 3.27Å; Y202-T234 WeakPolarHBondContact CD2-OG1 3.35Å; Y202-S237 WeakPolarHBondContact CE2-OG 3.34Å; Y202-S237 PolarHBondContact OH-OG 3.18Å
203	F	89.6	Confident	87.2	Confident	16 Å²	16	38.9 Å²	38.9	7%	0.07	21%	0.212	C	C	.	.	H	α-helix	trans	-62.5	-35.1	179.6	-66.7	-31.5	0	0	0	112.2	Q161 W165 L187 Q199 S200 R206 C207	Q161-F203 HydrophobicContact CG-CD2 3.67Å; Q161-F203 HydrophobicContact CG-CE2 3.81Å; W165-F203 HydrophobicContact CB-CD2 4.16Å; W165-F203 HydrophobicContact CB-CE2 4.09Å; W165-F203 HydrophobicContact CB-CZ 4.41Å; W165-F203 AromaticContact CD2-CD1 3.57Å; W165-F203 HydrophobicContact CD2-CD1 3.57Å; W165-F203 HydrophobicContact CD2-CD2 4.4Å; W165-F203 AromaticContact CD2-CE1 3.42Å; W165-F203 HydrophobicContact CD2-CE1 3.42Å; W165-F203 VanDerWaalsContact CD2-CE1 3.42Å; W165-F203 HydrophobicContact CD2-CE2 4.28Å; W165-F203 HydrophobicContact CD2-CG 4.08Å; W165-F203 AromaticContact CD2-CZ 3.8Å; W165-F203 HydrophobicContact CD2-CZ 3.8Å; W165-F203 AromaticContact CE2-CE1 3.58Å; W165-F203 HydrophobicContact CE3-CB 4.1Å; W165-F203 AromaticContact CE3-CD1 3.19Å; W165-F203 HydrophobicContact CE3-CD1 3.19Å; W165-F203 HydrophobicContact CE3-CD2 4.38Å; W165-F203 AromaticContact CE3-CE1 3.57Å; W165-F203 HydrophobicContact CE3-CE1 3.57Å; W165-F203 AromaticContact CE3-CG 3.66Å; W165-F203 HydrophobicContact CE3-CG 3.66Å; W165-F203 HydrophobicContact CE3-CZ 4.31Å; W165-F203 HydrophobicContact CG-CD1 4.31Å; W165-F203 HydrophobicContact CG-CD2 4.34Å; W165-F203 AromaticContact CG-CE1 3.99Å; W165-F203 HydrophobicContact CG-CE1 3.99Å; W165-F203 HydrophobicContact CG-CE2 4.04Å; W165-F203 HydrophobicContact CG-CG 4.48Å; W165-F203 AromaticContact CG-CZ 3.85Å; W165-F203 HydrophobicContact CG-CZ 3.85Å; W165-F203 HydrophobicContact CH2-CD1 4.02Å; W165-F203 HydrophobicContact CH2-CE1 4.04Å; W165-F203 HydrophobicContact CZ2-CD1 4.33Å; W165-F203 AromaticContact CZ2-CE1 3.9Å; W165-F203 HydrophobicContact CZ2-CE1 3.9Å; W165-F203 AromaticContact CZ3-CD1 3.45Å; W165-F203 HydrophobicContact CZ3-CD1 3.45Å; W165-F203 VanDerWaalsContact CZ3-CD1 3.45Å; W165-F203 AromaticContact CZ3-CE1 3.88Å; W165-F203 HydrophobicContact CZ3-CE1 3.88Å; W165-F203 HydrophobicContact CZ3-CG 4.25Å; L187-F203 HydrophobicContact CD1-CB 3.81Å; L187-F203 HydrophobicContact CD2-CB 3.68Å; L187-F203 HydrophobicContact CD2-CD2 4.21Å; L187-F203 HydrophobicContact CD2-CG 4.47Å; L187-F203 HydrophobicContact CG-CB 4.42Å; Q199-F203 HydrophobicContact CG-CD2 4.45Å; Q199-F203 HydrophobicContact CG-CE2 3.89Å; Q199-F203 HydrophobicContact CG-CZ 4.07Å; Q199-F203 VanDerWaalsContact NE2-CE1 3.26Å; Q199-F203 VanDerWaalsContact NE2-CZ 3.27Å; Q199-F203 VanDerWaalsContact O-CD2 3.3Å; Q199-F203 WeakPolarHBondContact O-CD2 3.33Å; Q199-F203 WeakPolarHBondContact O-CG 3.38Å; Q199-F203 PolarHBondContact O-N 2.55Å; S200-F203 PolarHBondContact O-N 2.81Å; F203-R206 WeakPolarHBondContact O-CB 3.45Å; F203-R206 PolarHBondContact O-N 2.95Å; F203-C207 PolarHBondContact O-N 3Å; F203-C207 PolarHBondContact O-SG 3.36Å
204	L	90.4	Very high	87.2	Confident	5 Å²	5	40 Å²	40	3%	0.026	22%	0.217	C	C	.	.	H	α-helix	trans	-65.2	-42.2	174.7	-176.6	61.2	0	0	0	111.2	I184 L187 L191 S200 W201 Y202 R206 C207 Y208	I184-L204 HydrophobicContact CB-CD1 4.37Å; I184-L204 HydrophobicContact CG1-CD1 4.18Å; I184-L204 HydrophobicContact CG2-CD1 4.05Å; L187-L204 HydrophobicContact CB-CB 4.41Å; L187-L204 HydrophobicContact CB-CD1 4.27Å; L191-L204 HydrophobicContact CD1-CD2 3.77Å; S200-L204 WeakPolarHBondContact O-CB 3.26Å; S200-L204 PolarHBondContact O-N 3.26Å; W201-L204 HydrophobicContact CE3-CD2 4.18Å; W201-L204 HydrophobicContact CZ3-CD2 4.15Å; W201-L204 PolarHBondContact O-N 3.36Å; Y202-L204 VanDerWaalsContact C-N 3.27Å; Y202-L204 PolarHBondContact O-N 3.3Å; L204-R206 VanDerWaalsContact C-N 3.34Å; L204-R206 PolarHBondContact O-N 2.53Å; L204-C207 PolarHBondContact O-N 3.29Å; L204-Y208 HydrophobicContact CD1-CD2 4.25Å; L204-Y208 HydrophobicContact CD1-CE1 4.31Å; L204-Y208 HydrophobicContact CD1-CE2 3.72Å; L204-Y208 HydrophobicContact CD2-CE2 3.89Å; L204-Y208 HydrophobicContact CG-CD2 3.94Å; L204-Y208 HydrophobicContact CG-CE2 3.49Å; L204-Y208 VanDerWaalsContact CG-CE2 3.49Å; L204-Y208 WeakPolarHBondContact O-CD2 3.24Å; L204-Y208 PolarHBondContact O-N 3.43Å
205	G	90.3	Very high	87.3	Confident	0 Å²	0	45 Å²	45	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-60.5	-39.1	172.4	0	0	0	0	0	113.4	W201 Y202 Y208 S209 A217 Y221	W201-G205 PolarHBondContact O-N 3.22Å; Y202-G205 PolarHBondContact O-N 3.44Å; Y202-G205 VanDerWaalsContact O-N 3.15Å; G205-Y208 PolarHBondContact O-N 2.9Å; G205-S209 VanDerWaalsContact O-CB 3.3Å; G205-S209 WeakPolarHBondContact O-CB 3.41Å; G205-S209 PolarHBondContact O-N 2.86Å; G205-A217 WeakPolarHBondContact O-CB 3.36Å; G205-Y221 VanDerWaalsContact C-CE1 3.48Å; G205-Y221 PolarHBondContact O-OH 3.2Å
206	R	88.6	Confident	87.3	Confident	90 Å²	90	43.7 Å²	43.7	34%	0.34	23%	0.228	S	C	.	.	H	α-helix	trans	-61.6	-43.4	173.5	-67.6	-69.8	-66.7	-148	1.9	112	W165 Y202 F203 L204 S209 S210 Y221 S237	W165-R206 HydrophobicContact CZ3-CB 4.24Å; W165-R206 HydrophobicContact CZ3-CG 4.38Å; Y202-R206 HydrophobicContact CD1-CG 4.34Å; Y202-R206 HydrophobicContact CD2-CG 4.4Å; Y202-R206 HydrophobicContact CE1-CG 3.9Å; Y202-R206 HydrophobicContact CE2-CG 3.93Å; Y202-R206 WeakPolarHBondContact O-CG 3.33Å; Y202-R206 PolarHBondContact O-N 3.3Å; Y202-R206 PolarHBondContact OH-NH1 3.2Å; F203-R206 WeakPolarHBondContact O-CB 3.45Å; F203-R206 PolarHBondContact O-N 2.95Å; L204-R206 VanDerWaalsContact C-N 3.34Å; L204-R206 PolarHBondContact O-N 2.53Å; R206-S209 PolarHBondContact O-N 2.97Å; R206-S210 WeakPolarHBondContact O-CB 3.11Å; R206-S210 PolarHBondContact O-N 3.42Å; R206-Y221 WeakPolarHBondContact CA-OH 3.18Å; R206-Y221 WeakPolarHBondContact CD-OH 3.28Å; R206-Y221 HydrophobicContact CG-CE1 4.24Å; R206-Y221 PolarHBondContact N-OH 3.42Å; R206-S237 PolarHBondContact NH1-OG 3.07Å
207	C	89.6	Confident	87.6	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-64.5	-49.3	176.6	-59.4	0	0	0	0	111	I184 L187 F203 L204 S209 S210 I211	I184-C207 HydrophobicContact CD1-CB 4.18Å; I184-C207 HydrophobicContact CG1-CB 3.61Å; L187-C207 VanDerWaalsContact CD1-SG 3.6Å; F203-C207 PolarHBondContact O-N 3Å; F203-C207 PolarHBondContact O-SG 3.36Å; L204-C207 PolarHBondContact O-N 3.29Å; C207-S209 VanDerWaalsContact C-N 3.34Å; C207-S209 PolarHBondContact O-N 3.16Å; C207-S210 PolarHBondContact O-N 3.43Å; C207-S210 VanDerWaalsContact O-N 3.15Å; C207-S210 PolarHBondContact O-OG 3.28Å; C207-I211 PolarHBondContact O-N 3.12Å
208	Y	90.6	Very high	87.7	Confident	29 Å²	29	40.7 Å²	40.7	11%	0.114	21%	0.208	C	C	.	.	H	α-helix	trans	-60.2	-39.7	176.9	-70.2	-38.4	0	0	0	113.1	I184 Q188 L204 G205 I211 G212 K213 D216 S220	I184-Y208 HydrophobicContact CD1-CD1 3.83Å; I184-Y208 HydrophobicContact CD1-CE1 3.86Å; I184-Y208 HydrophobicContact CG1-CD1 4.38Å; I184-Y208 HydrophobicContact CG1-CE1 4.23Å; I184-Y208 HydrophobicContact CG2-CE1 4.13Å; Q188-Y208 PolarHBondContact NE2-OH 3.02Å; L204-Y208 HydrophobicContact CD1-CD2 4.25Å; L204-Y208 HydrophobicContact CD1-CE1 4.31Å; L204-Y208 HydrophobicContact CD1-CE2 3.72Å; L204-Y208 HydrophobicContact CD2-CE2 3.89Å; L204-Y208 HydrophobicContact CG-CD2 3.94Å; L204-Y208 HydrophobicContact CG-CE2 3.49Å; L204-Y208 VanDerWaalsContact CG-CE2 3.49Å; L204-Y208 WeakPolarHBondContact O-CD2 3.24Å; L204-Y208 PolarHBondContact O-N 3.43Å; G205-Y208 PolarHBondContact O-N 2.9Å; Y208-I211 HydrophobicContact CD1-CD1 4.23Å; Y208-I211 VanDerWaalsContact O-CG1 3.24Å; Y208-I211 WeakPolarHBondContact O-CG1 3.43Å; Y208-I211 PolarHBondContact O-N 3.01Å; Y208-G212 PolarHBondContact O-N 3.07Å; Y208-K213 HydrophobicContact CD1-CD 4.37Å; Y208-K213 PolarHBondContact O-N 3.01Å; Y208-D216 HydrophobicContact CD1-CB 4.12Å; Y208-D216 HydrophobicContact CD2-CB 3.57Å; Y208-D216 WeakPolarHBondContact CD2-O 3.43Å; Y208-D216 HydrophobicContact CE1-CB 4.39Å; Y208-D216 HydrophobicContact CE2-CB 3.85Å; Y208-D216 HydrophobicContact CG-CB 3.7Å; Y208-S220 WeakPolarHBondContact CD2-OG 3.42Å; Y208-S220 WeakPolarHBondContact CE2-OG 3.4Å
209	S	88.6	Confident	87.9	Confident	24 Å²	24	44.4 Å²	44.4	17%	0.168	23%	0.226	C	C	.	.	H	α-helix	trans	-62.3	-43.6	174.2	176.7	0	0	0	0	111.4	G205 R206 C207 I211 G212	G205-S209 VanDerWaalsContact O-CB 3.3Å; G205-S209 WeakPolarHBondContact O-CB 3.41Å; G205-S209 PolarHBondContact O-N 2.86Å; R206-S209 PolarHBondContact O-N 2.97Å; C207-S209 VanDerWaalsContact C-N 3.34Å; C207-S209 PolarHBondContact O-N 3.16Å; S209-I211 VanDerWaalsContact C-N 3.28Å; S209-I211 PolarHBondContact O-N 2.82Å; S209-G212 PolarHBondContact O-N 2.81Å
210	S	84.9	Confident	88.2	Confident	31 Å²	31	41 Å²	41	22%	0.217	21%	0.21	C	C	.	.	H	α-helix	trans	-66.6	-24.8	-178.8	78.6	0	0	0	0	114.5	K176 E180 R206 C207	K176-S210 WeakPolarHBondContact CE-O 3.44Å; K176-S210 PolarHBondContact NZ-O 3.4Å; E180-S210 PolarHBondContact OE1-OG 3.17Å; E180-S210 PolarHBondContact OE2-OG 3.03Å; R206-S210 WeakPolarHBondContact O-CB 3.11Å; R206-S210 PolarHBondContact O-N 3.42Å; C207-S210 PolarHBondContact O-N 3.43Å; C207-S210 VanDerWaalsContact O-N 3.15Å; C207-S210 PolarHBondContact O-OG 3.28Å
211	I	87.4	Confident	88.4	Confident	71 Å²	71	41 Å²	41	36%	0.364	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	4.9	172.5	66.4	168.1	0	0	0	113.4	E180 I184 C207 Y208 S209 K213	E180-I211 HydrophobicContact CB-CG2 3.51Å; E180-I211 HydrophobicContact CG-CG2 3.66Å; I184-I211 HydrophobicContact CD1-CD1 3.95Å; C207-I211 PolarHBondContact O-N 3.12Å; Y208-I211 HydrophobicContact CD1-CD1 4.23Å; Y208-I211 VanDerWaalsContact O-CG1 3.24Å; Y208-I211 WeakPolarHBondContact O-CG1 3.43Å; Y208-I211 PolarHBondContact O-N 3.01Å; S209-I211 VanDerWaalsContact C-N 3.28Å; S209-I211 PolarHBondContact O-N 2.82Å; I211-K213 VanDerWaalsContact C-N 3.34Å; I211-K213 HydrophobicContact CD1-CB 4.35Å; I211-K213 HydrophobicContact CD1-CD 4.04Å; I211-K213 HydrophobicContact CD1-CG 3.81Å; I211-K213 HydrophobicContact CG1-CB 4.17Å; I211-K213 HydrophobicContact CG1-CG 4Å; I211-K213 PolarHBondContact O-N 3.49Å
212	G	83.8	Confident	88.3	Confident	55 Å²	55	45.7 Å²	45.7	57%	0.567	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	79.1	9.4	178.4	0	0	0	0	0	115.4	Y208 S209 V214	Y208-G212 PolarHBondContact O-N 3.07Å; S209-G212 PolarHBondContact O-N 2.81Å; G212-V214 VanDerWaalsContact C-N 3.29Å; G212-V214 PolarHBondContact O-N 3.29Å
213	K	87.9	Confident	88.2	Confident	103 Å²	103	47.7 Å²	47.7	45%	0.448	24%	0.238	S	C	.	.			trans	-81.6	74.1	174.7	-75.1	-153.1	-177.8	-174.9	0	111.4	Y208 I211 Q215 D216 A217	Y208-K213 HydrophobicContact CD1-CD 4.37Å; Y208-K213 PolarHBondContact O-N 3.01Å; I211-K213 VanDerWaalsContact C-N 3.34Å; I211-K213 HydrophobicContact CD1-CB 4.35Å; I211-K213 HydrophobicContact CD1-CD 4.04Å; I211-K213 HydrophobicContact CD1-CG 3.81Å; I211-K213 HydrophobicContact CG1-CB 4.17Å; I211-K213 HydrophobicContact CG1-CG 4Å; I211-K213 PolarHBondContact O-N 3.49Å; K213-Q215 VanDerWaalsContact C-N 3.34Å; K213-Q215 PolarHBondContact O-N 2.84Å; K213-D216 HydrophobicContact CB-CB 4.19Å; K213-D216 HydrophobicContact CD-CB 4.28Å; K213-D216 WeakPolarHBondContact CD-OD2 3.22Å; K213-D216 IonicContact NZ-OD2 3.85Å; K213-D216 PolarHBondContact NZ-OD2 3.02Å; K213-D216 PolarHBondContact O-N 3.48Å; K213-A217 WeakPolarHBondContact O-CB 3.43Å; K213-A217 PolarHBondContact O-N 3.44Å
214	V	85.5	Confident	88.1	Confident	45 Å²	45	47 Å²	47	27%	0.273	24%	0.236	S	C	.	.	H	α-helix	trans	-54	-45.4	-175.4	178.4	0	0	0	0	112.8	G212 A217 F218 L241 Q245	G212-V214 VanDerWaalsContact C-N 3.29Å; G212-V214 PolarHBondContact O-N 3.29Å; V214-A217 WeakPolarHBondContact O-CB 3.3Å; V214-A217 PolarHBondContact O-N 2.7Å; V214-F218 PolarHBondContact O-N 3.42Å; V214-L241 HydrophobicContact CG1-CD1 4.1Å; V214-L241 HydrophobicContact CG1-CD2 4.27Å; V214-L241 HydrophobicContact CG1-CG 4.08Å; V214-L241 HydrophobicContact CG2-CD1 4.38Å; V214-Q245 HydrophobicContact CG1-CG 4.03Å
215	Q	85	Confident	87.9	Confident	124 Å²	124	49.3 Å²	49.3	58%	0.579	25%	0.247	S	C	*	.	H	α-helix	trans	-67.6	-48.3	-177.5	-168.2	66.4	10.9	0	0	112.7	K213 A217 F218 I219	K213-Q215 VanDerWaalsContact C-N 3.34Å; K213-Q215 PolarHBondContact O-N 2.84Å; Q215-A217 PolarHBondContact O-N 3.02Å; Q215-F218 PolarHBondContact O-N 3.36Å; Q215-I219 HydrophobicContact CG-CD1 4.13Å; Q215-I219 WeakPolarHBondContact O-CG1 3.34Å; Q215-I219 PolarHBondContact O-N 3.23Å
216	D	87.3	Confident	87.6	Confident	52 Å²	52	53.5 Å²	53.5	28%	0.278	27%	0.27	S	S	.	.	H	α-helix	trans	-62.1	-35.8	177.4	-63.2	1.3	0	0	0	110.7	Y208 K213 S220	Y208-D216 HydrophobicContact CD1-CB 4.12Å; Y208-D216 HydrophobicContact CD2-CB 3.57Å; Y208-D216 WeakPolarHBondContact CD2-O 3.43Å; Y208-D216 HydrophobicContact CE1-CB 4.39Å; Y208-D216 HydrophobicContact CE2-CB 3.85Å; Y208-D216 HydrophobicContact CG-CB 3.7Å; K213-D216 HydrophobicContact CB-CB 4.19Å; K213-D216 HydrophobicContact CD-CB 4.28Å; K213-D216 WeakPolarHBondContact CD-OD2 3.22Å; K213-D216 IonicContact NZ-OD2 3.85Å; K213-D216 PolarHBondContact NZ-OD2 3.02Å; K213-D216 PolarHBondContact O-N 3.48Å; D216-S220 WeakPolarHBondContact O-CB 3.45Å; D216-S220 PolarHBondContact O-N 3.19Å; D216-S220 PolarHBondContact O-OG 3.43Å
217	A	88.9	Confident	87.3	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-64.6	-47.5	174.1	0	0	0	0	0	112.2	G205 K213 V214 Q215 S220 Y221 L241	G205-A217 WeakPolarHBondContact O-CB 3.36Å; K213-A217 WeakPolarHBondContact O-CB 3.43Å; K213-A217 PolarHBondContact O-N 3.44Å; V214-A217 WeakPolarHBondContact O-CB 3.3Å; V214-A217 PolarHBondContact O-N 2.7Å; Q215-A217 PolarHBondContact O-N 3.02Å; A217-S220 PolarHBondContact O-N 3.23Å; A217-Y221 HydrophobicContact CB-CE2 4.29Å; A217-Y221 VanDerWaalsContact O-CD2 3.28Å; A217-Y221 WeakPolarHBondContact O-CD2 3.41Å; A217-Y221 PolarHBondContact O-N 3.45Å; A217-L241 HydrophobicContact CB-CD2 4.2Å
218	F	85.8	Confident	86.5	Confident	58 Å²	58	55.8 Å²	55.8	25%	0.254	29%	0.288	S	S	.	.	H	α-helix	trans	-62.4	-44	178.7	-172.5	-98.7	0	0	0	112.2	V214 Q215 S220 Y221 R222 L241 Y242	V214-F218 PolarHBondContact O-N 3.42Å; Q215-F218 PolarHBondContact O-N 3.36Å; F218-S220 VanDerWaalsContact C-N 3.31Å; F218-S220 PolarHBondContact O-N 3.44Å; F218-Y221 PolarHBondContact O-N 2.9Å; F218-R222 WeakPolarHBondContact O-CB 3.48Å; F218-R222 PolarHBondContact O-N 3.23Å; F218-L241 HydrophobicContact CB-CD2 4.01Å; F218-L241 HydrophobicContact CD2-CD2 4.36Å; F218-Y242 HydrophobicContact CE2-CE1 4.17Å; F218-Y242 HydrophobicContact CE2-CE2 4.47Å; F218-Y242 AromaticContact CE2-CZ 3.77Å; F218-Y242 WeakPolarHBondContact CE2-OH 3.42Å
219	I	89.5	Confident	84.9	Confident	83 Å²	83	63.8 Å²	63.8	43%	0.426	33%	0.326	S	S	.	.	H	α-helix	trans	-60.2	-42.8	175	-66.8	166.3	0	0	0	110.6	Q215 R222 Q223	Q215-I219 HydrophobicContact CG-CD1 4.13Å; Q215-I219 WeakPolarHBondContact O-CG1 3.34Å; Q215-I219 PolarHBondContact O-N 3.23Å; I219-R222 PolarHBondContact O-N 3.03Å; I219-Q223 PolarHBondContact O-N 3.29Å
220	S	89.8	Confident	83.7	Confident	4 Å²	4	65.6 Å²	65.6	3%	0.028	34%	0.343	C	S	.	.	H	α-helix	trans	-68.9	-40.5	179.6	-57	0	0	0	0	112.6	Y208 D216 A217 F218 R222 Q223 S224	Y208-S220 WeakPolarHBondContact CD2-OG 3.42Å; Y208-S220 WeakPolarHBondContact CE2-OG 3.4Å; D216-S220 WeakPolarHBondContact O-CB 3.45Å; D216-S220 PolarHBondContact O-N 3.19Å; D216-S220 PolarHBondContact O-OG 3.43Å; A217-S220 PolarHBondContact O-N 3.23Å; F218-S220 VanDerWaalsContact C-N 3.31Å; F218-S220 PolarHBondContact O-N 3.44Å; S220-R222 VanDerWaalsContact C-N 3.35Å; S220-Q223 PolarHBondContact O-N 3.06Å; S220-S224 PolarHBondContact O-N 3.08Å
221	Y	90.9	Very high	83.5	Confident	2 Å²	2	65.2 Å²	65.2	1%	0.008	34%	0.34	C	S	.	.	H	α-helix	trans	-66.5	-35.7	173.2	-64.3	-41.1	0	0	0	112.2	Y202 G205 R206 A217 F218 S224 I225 T234 I238 L241	Y202-Y221 HydrophobicContact CD2-CD1 4.08Å; Y202-Y221 AromaticContact CD2-CE1 3.96Å; Y202-Y221 HydrophobicContact CD2-CE1 3.96Å; Y202-Y221 HydrophobicContact CE2-CE1 4.14Å; G205-Y221 VanDerWaalsContact C-CE1 3.48Å; G205-Y221 PolarHBondContact O-OH 3.2Å; R206-Y221 WeakPolarHBondContact CA-OH 3.18Å; R206-Y221 WeakPolarHBondContact CD-OH 3.28Å; R206-Y221 HydrophobicContact CG-CE1 4.24Å; R206-Y221 PolarHBondContact N-OH 3.42Å; A217-Y221 HydrophobicContact CB-CE2 4.29Å; A217-Y221 VanDerWaalsContact O-CD2 3.28Å; A217-Y221 WeakPolarHBondContact O-CD2 3.41Å; A217-Y221 PolarHBondContact O-N 3.45Å; F218-Y221 PolarHBondContact O-N 2.9Å; Y221-S224 VanDerWaalsContact O-CB 3.32Å; Y221-S224 WeakPolarHBondContact O-CB 3.43Å; Y221-S224 PolarHBondContact O-N 3.14Å; Y221-I225 PolarHBondContact O-N 3.04Å; Y221-I225 VanDerWaalsContact O-N 3.1Å; Y221-T234 HydrophobicContact CD1-CG2 4.38Å; Y221-I238 HydrophobicContact CD2-CG1 3.91Å; Y221-I238 HydrophobicContact CG-CG1 4.05Å; Y221-L241 HydrophobicContact CD2-CD2 4.24Å; Y221-L241 HydrophobicContact CE2-CD2 4.2Å
222	R	88.6	Confident	83.5	Confident	153 Å²	153	62.2 Å²	62.2	58%	0.577	33%	0.326	S	S	*	.	H	α-helix	trans	-63.1	-49.2	172.6	-173.9	176.4	-179.8	161.3	5.8	111.3	F218 I219 S220 S224 I225 D226	F218-R222 WeakPolarHBondContact O-CB 3.48Å; F218-R222 PolarHBondContact O-N 3.23Å; I219-R222 PolarHBondContact O-N 3.03Å; S220-R222 VanDerWaalsContact C-N 3.35Å; R222-S224 PolarHBondContact O-N 3.38Å; R222-I225 PolarHBondContact O-N 3.4Å; R222-D226 PolarHBondContact O-N 2.9Å
223	Q	88.4	Confident	83.6	Confident	57 Å²	57	63.3 Å²	63.3	27%	0.266	32%	0.319	S	S	.	.	H	α-helix	trans	-59.9	-31.6	173.1	-71.4	-53.6	-71.8	0	0	112.6	W201 I219 S220 I225 D226 K227	W201-Q223 HydrophobicContact CB-CB 4.3Å; W201-Q223 HydrophobicContact CD2-CB 3.57Å; W201-Q223 HydrophobicContact CD2-CG 4.35Å; W201-Q223 HydrophobicContact CE3-CB 3.78Å; W201-Q223 HydrophobicContact CE3-CG 4.28Å; W201-Q223 HydrophobicContact CG-CB 3.82Å; W201-Q223 HydrophobicContact CH2-CG 4.46Å; W201-Q223 HydrophobicContact CZ3-CB 4.34Å; W201-Q223 HydrophobicContact CZ3-CG 4.34Å; I219-Q223 PolarHBondContact O-N 3.29Å; S220-Q223 PolarHBondContact O-N 3.06Å; Q223-I225 VanDerWaalsContact C-N 3.31Å; Q223-I225 PolarHBondContact O-N 3.3Å; Q223-D226 PolarHBondContact NE2-OD2 3.31Å; Q223-D226 PolarHBondContact O-N 3.01Å; Q223-K227 VanDerWaalsContact O-CB 3.26Å; Q223-K227 WeakPolarHBondContact O-CB 3.22Å; Q223-K227 WeakPolarHBondContact O-CG 3.27Å; Q223-K227 PolarHBondContact O-N 3.36Å; Q223-K227 VanDerWaalsContact O-N 3.1Å
224	S	88.2	Confident	83.7	Confident	2 Å²	2	58.4 Å²	58.4	1%	0.014	30%	0.298	C	S	.	.	H	α-helix	trans	-65.3	-31.5	172.5	-174.1	0	0	0	0	113.6	G198 Y202 S220 Y221 R222 S228	G198-S224 PolarHBondContact O-OG 2.85Å; Y202-S224 WeakPolarHBondContact CB-OG 3.27Å; S220-S224 PolarHBondContact O-N 3.08Å; Y221-S224 VanDerWaalsContact O-CB 3.32Å; Y221-S224 WeakPolarHBondContact O-CB 3.43Å; Y221-S224 PolarHBondContact O-N 3.14Å; R222-S224 PolarHBondContact O-N 3.38Å; S224-S228 WeakPolarHBondContact O-CB 3.36Å; S224-S228 PolarHBondContact O-N 3.19Å
225	I	86.6	Confident	84	Confident	53 Å²	53	59.2 Å²	59.2	27%	0.272	30%	0.296	S	S	.	.	H	α-helix	trans	-78	-47.1	174.1	-67.2	166.9	0	0	0	109.6	Y221 R222 Q223 K227 S228 T234 W235 I238	Y221-I225 PolarHBondContact O-N 3.04Å; Y221-I225 VanDerWaalsContact O-N 3.1Å; R222-I225 PolarHBondContact O-N 3.4Å; Q223-I225 VanDerWaalsContact C-N 3.31Å; Q223-I225 PolarHBondContact O-N 3.3Å; I225-K227 PolarHBondContact O-N 3.14Å; I225-S228 PolarHBondContact O-N 3.39Å; I225-T234 HydrophobicContact CD1-CG2 4.29Å; I225-T234 HydrophobicContact CG1-CG2 3.93Å; I225-W235 HydrophobicContact CD1-CD2 4.23Å; I225-W235 HydrophobicContact CD1-CH2 4.24Å; I225-W235 HydrophobicContact CD1-CZ2 3.77Å; I225-I238 HydrophobicContact CD1-CD1 3.53Å
226	D	84.5	Confident	84.3	Confident	88 Å²	88	53.7 Å²	53.7	47%	0.471	27%	0.271	S	S	.	.	H	α-helix	trans	-60.6	-16.3	179.4	-58.9	-18.9	0	0	0	113.5	R222 Q223	R222-D226 PolarHBondContact O-N 2.9Å; Q223-D226 PolarHBondContact NE2-OD2 3.31Å; Q223-D226 PolarHBondContact O-N 3.01Å
227	K	80.9	Confident	84.5	Confident	89 Å²	89	51.5 Å²	51.5	39%	0.387	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.1	4.3	-176.3	-56.9	-62	177.5	-176.4	0	115.1	Q223 I225	Q223-K227 VanDerWaalsContact O-CB 3.26Å; Q223-K227 WeakPolarHBondContact O-CB 3.22Å; Q223-K227 WeakPolarHBondContact O-CG 3.27Å; Q223-K227 PolarHBondContact O-N 3.36Å; Q223-K227 VanDerWaalsContact O-N 3.1Å; I225-K227 PolarHBondContact O-N 3.14Å
228	S	73.8	Confident	84.6	Confident	49 Å²	49	51.9 Å²	51.9	34%	0.343	26%	0.261	S	S	.	.	S	Bend	trans	-138	138.9	-179.2	-168	0	0	0	0	111.8	S224 I225 A230	S224-S228 WeakPolarHBondContact O-CB 3.36Å; S224-S228 PolarHBondContact O-N 3.19Å; I225-S228 PolarHBondContact O-N 3.39Å; S228-A230 VanDerWaalsContact C-N 3.32Å; S228-A230 PolarHBondContact O-N 3.38Å
229	E	57	Low	84.8	Confident	196 Å²	196	49.1 Å²	49.1	92%	0.916	25%	0.249	S	C	*	.	S	Bend	trans	-66.2	93.6	165.5	-66.8	-173.5	145.9	0	0	109.5
230	A	62.3	Low	84.9	Confident	62 Å²	62	47.3 Å²	47.3	51%	0.512	24%	0.242	S	C	.	.			trans	43.4	89	164.6	0	0	0	0	0	118.2	S228 L261	S228-A230 VanDerWaalsContact C-N 3.32Å; S228-A230 PolarHBondContact O-N 3.38Å; A230-L261 HydrophobicContact CB-CD1 4.01Å; A230-L261 HydrophobicContact CB-CD2 3.7Å; A230-L261 HydrophobicContact CB-CG 4.49Å
231	S	82.2	Confident	84.9	Confident	23 Å²	23	47.2 Å²	47.2	16%	0.161	24%	0.241	C	C	.	.			trans	-94.2	119.3	172.6	168.7	0	0	0	0	113	T234 W235	S231-T234 VanDerWaalsContact CB-OG1 3.28Å; S231-T234 WeakPolarHBondContact CB-OG1 3.3Å; S231-T234 PolarHBondContact O-N 2.89Å; S231-T234 PolarHBondContact OG-N 3.03Å; S231-T234 PolarHBondContact OG-OG1 2.72Å; S231-W235 PolarHBondContact O-N 3.11Å
232	A	86.1	Confident	84.9	Confident	9 Å²	9	49 Å²	49	7%	0.074	25%	0.248	C	C	.	.	H	α-helix	trans	-63.1	-40.6	174.1	0	0	0	0	0	112.9	T234 W235 C236 L261 D262	A232-T234 PolarHBondContact O-N 2.93Å; A232-W235 PolarHBondContact O-N 3.1Å; A232-C236 VanDerWaalsContact O-CB 3.32Å; A232-C236 WeakPolarHBondContact O-CB 3.44Å; A232-C236 PolarHBondContact O-N 3Å; A232-L261 HydrophobicContact CB-CB 4.01Å; A232-D262 HydrophobicContact CB-CB 3.84Å
233	D	86.9	Confident	84.8	Confident	77 Å²	77	44.4 Å²	44.4	41%	0.412	23%	0.234	S	C	.	.	H	α-helix	trans	-58.4	-32.9	176.2	-59.4	-90.1	0	0	0	112.6	Y202 S237 H265	Y202-D233 HydrophobicContact CE1-CB 4.43Å; Y202-D233 HydrophobicContact CE2-CB 4.23Å; Y202-D233 WeakPolarHBondContact CE2-O 3.17Å; D233-S237 WeakPolarHBondContact O-CB 3.46Å; D233-S237 PolarHBondContact O-N 3.12Å; D233-S237 PolarHBondContact O-OG 3.15Å; D233-H265 IonicContact OD1-CE1 2.63Å; D233-H265 PolarHBondContact OD1-CE1 2.96Å; D233-H265 VanDerWaalsContact OD1-CE1 3.32Å
234	T	89.1	Confident	84.6	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-71.7	-49.4	178.6	-55.6	0	0	0	0	111.2	Y202 Y221 I225 S231 A232 C236 S237 I238	Y202-T234 HydrophobicContact CD2-CG2 4.24Å; Y202-T234 VanDerWaalsContact CD2-OG1 3.27Å; Y202-T234 WeakPolarHBondContact CD2-OG1 3.35Å; Y221-T234 HydrophobicContact CD1-CG2 4.38Å; I225-T234 HydrophobicContact CD1-CG2 4.29Å; I225-T234 HydrophobicContact CG1-CG2 3.93Å; S231-T234 VanDerWaalsContact CB-OG1 3.28Å; S231-T234 WeakPolarHBondContact CB-OG1 3.3Å; S231-T234 PolarHBondContact O-N 2.89Å; S231-T234 PolarHBondContact OG-N 3.03Å; S231-T234 PolarHBondContact OG-OG1 2.72Å; A232-T234 PolarHBondContact O-N 2.93Å; T234-C236 VanDerWaalsContact C-N 3.32Å; T234-C236 PolarHBondContact O-N 3.07Å; T234-S237 PolarHBondContact O-N 2.89Å; T234-I238 HydrophobicContact CG2-CD1 4.32Å; T234-I238 WeakPolarHBondContact O-CG1 3.42Å; T234-I238 PolarHBondContact O-N 3.44Å
235	W	91.4	Very high	84.5	Confident	63 Å²	63	51.2 Å²	51.2	24%	0.239	27%	0.265	C	S	.	.	H	α-helix	trans	-61.7	-39.1	175.2	-77.7	103.4	0	0	0	112.6	I225 S231 A232 I238 G239 A254 C257 A258 L261	I225-W235 HydrophobicContact CD1-CD2 4.23Å; I225-W235 HydrophobicContact CD1-CH2 4.24Å; I225-W235 HydrophobicContact CD1-CZ2 3.77Å; S231-W235 PolarHBondContact O-N 3.11Å; A232-W235 PolarHBondContact O-N 3.1Å; W235-I238 HydrophobicContact CE3-CD1 4.48Å; W235-I238 PolarHBondContact O-N 3.03Å; W235-G239 PolarHBondContact O-N 2.87Å; W235-A254 HydrophobicContact CE3-CB 4.23Å; W235-C257 HydrophobicContact CB-CB 4.43Å; W235-C257 HydrophobicContact CD2-CB 3.84Å; W235-C257 HydrophobicContact CE3-CB 3.92Å; W235-C257 HydrophobicContact CG-CB 4.08Å; W235-C257 HydrophobicContact CZ3-CB 4.49Å; W235-A258 HydrophobicContact CB-CB 3.84Å; W235-L261 VanDerWaalsContact CD1-CD1 3.43Å; W235-L261 HydrophobicContact CG-CD1 4.37Å
236	C	92.1	Very high	84.4	Confident	8 Å²	8	55.5 Å²	55.5	5%	0.054	29%	0.288	C	S	.	.	H	α-helix	trans	-58.2	-48.3	172.4	-175	0	0	0	0	111.3	A232 T234 I238 G239 V240 Y255 A258 A268	A232-C236 VanDerWaalsContact O-CB 3.32Å; A232-C236 WeakPolarHBondContact O-CB 3.44Å; A232-C236 PolarHBondContact O-N 3Å; T234-C236 VanDerWaalsContact C-N 3.32Å; T234-C236 PolarHBondContact O-N 3.07Å; C236-I238 VanDerWaalsContact C-N 3.32Å; C236-I238 PolarHBondContact O-N 3.3Å; C236-G239 PolarHBondContact O-N 3.32Å; C236-G239 VanDerWaalsContact O-N 3.13Å; C236-V240 PolarHBondContact O-N 3.34Å; C236-V240 VanDerWaalsContact O-N 3.1Å; C236-Y255 WeakPolarHBondContact O-CE1 3.48Å; C236-A258 HydrophobicContact CB-CB 4.03Å; C236-A268 HydrophobicContact CB-CB 4.13Å
237	S	91.3	Very high	84.5	Confident	5 Å²	5	55 Å²	55	4%	0.035	28%	0.283	C	S	.	.	H	α-helix	trans	-68.9	-26.5	179.7	-57.7	0	0	0	0	113.7	Y202 R206 D233 T234 L241	Y202-S237 WeakPolarHBondContact CE2-OG 3.34Å; Y202-S237 PolarHBondContact OH-OG 3.18Å; R206-S237 PolarHBondContact NH1-OG 3.07Å; D233-S237 WeakPolarHBondContact O-CB 3.46Å; D233-S237 PolarHBondContact O-N 3.12Å; D233-S237 PolarHBondContact O-OG 3.15Å; T234-S237 PolarHBondContact O-N 2.89Å; S237-L241 PolarHBondContact O-N 2.95Å
238	I	90.6	Very high	84.5	Confident	8 Å²	8	53.3 Å²	53.3	4%	0.041	28%	0.281	C	S	.	.	H	α-helix	trans	-69.9	-42.6	169.1	-69.2	167.2	0	0	0	110.7	Y221 I225 T234 W235 C236 V240 L241 Y242 A254	Y221-I238 HydrophobicContact CD2-CG1 3.91Å; Y221-I238 HydrophobicContact CG-CG1 4.05Å; I225-I238 HydrophobicContact CD1-CD1 3.53Å; T234-I238 HydrophobicContact CG2-CD1 4.32Å; T234-I238 WeakPolarHBondContact O-CG1 3.42Å; T234-I238 PolarHBondContact O-N 3.44Å; W235-I238 HydrophobicContact CE3-CD1 4.48Å; W235-I238 PolarHBondContact O-N 3.03Å; C236-I238 VanDerWaalsContact C-N 3.32Å; C236-I238 PolarHBondContact O-N 3.3Å; I238-V240 VanDerWaalsContact C-N 3.34Å; I238-V240 PolarHBondContact O-N 2.75Å; I238-L241 WeakPolarHBondContact O-CA 3.44Å; I238-L241 WeakPolarHBondContact O-CB 3.42Å; I238-L241 PolarHBondContact O-N 2.92Å; I238-Y242 HydrophobicContact CG2-CD2 3.7Å; I238-Y242 HydrophobicContact CG2-CE2 3.47Å; I238-Y242 VanDerWaalsContact CG2-CE2 3.47Å; I238-Y242 PolarHBondContact O-N 2.87Å; I238-A254 HydrophobicContact CB-CB 4.48Å; I238-A254 HydrophobicContact CG2-CB 4.06Å
239	G	91.1	Very high	84.8	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-57.9	-44.7	176.6	0	0	0	0	0	112.6	W235 C236 L241 Y242 Q243 A251 Y255	W235-G239 PolarHBondContact O-N 2.87Å; C236-G239 PolarHBondContact O-N 3.32Å; C236-G239 VanDerWaalsContact O-N 3.13Å; G239-L241 VanDerWaalsContact C-N 3.29Å; G239-L241 PolarHBondContact O-N 3.19Å; G239-Y242 PolarHBondContact O-N 2.82Å; G239-Q243 WeakPolarHBondContact O-CB 3.38Å; G239-Q243 PolarHBondContact O-N 2.97Å; G239-A251 WeakPolarHBondContact O-CB 3.49Å; G239-Y255 VanDerWaalsContact C-CZ 3.45Å
240	V	91.1	Very high	86.2	Confident	46 Å²	46	49.5 Å²	49.5	28%	0.279	26%	0.261	S	S	.	.	H	α-helix	trans	-59.5	-40.2	173.2	175.9	0	0	0	0	111.4	C236 I238 Q243 Q244 Y255	C236-V240 PolarHBondContact O-N 3.34Å; C236-V240 VanDerWaalsContact O-N 3.1Å; I238-V240 VanDerWaalsContact C-N 3.34Å; I238-V240 PolarHBondContact O-N 2.75Å; V240-Q243 PolarHBondContact O-N 3.43Å; V240-Q244 VanDerWaalsContact O-CG 3.3Å; V240-Q244 WeakPolarHBondContact O-CG 3.32Å; V240-Q244 PolarHBondContact O-N 3.13Å; V240-Y255 VanDerWaalsContact CA-OH 3.31Å; V240-Y255 WeakPolarHBondContact CA-OH 3.37Å; V240-Y255 HydrophobicContact CG2-CE1 4.08Å; V240-Y255 WeakPolarHBondContact CG2-OH 3.49Å; V240-Y255 PolarHBondContact N-OH 3.23Å
241	L	90	Very high	87.4	Confident	2 Å²	2	46.5 Å²	46.5	1%	0.01	24%	0.237	C	C	.	.	H	α-helix	trans	-69.5	-35.4	-179.8	-161.8	71.7	0	0	0	112.6	V214 A217 F218 Y221 S237 I238 G239 Q245	V214-L241 HydrophobicContact CG1-CD1 4.1Å; V214-L241 HydrophobicContact CG1-CD2 4.27Å; V214-L241 HydrophobicContact CG1-CG 4.08Å; V214-L241 HydrophobicContact CG2-CD1 4.38Å; A217-L241 HydrophobicContact CB-CD2 4.2Å; F218-L241 HydrophobicContact CB-CD2 4.01Å; F218-L241 HydrophobicContact CD2-CD2 4.36Å; Y221-L241 HydrophobicContact CD2-CD2 4.24Å; Y221-L241 HydrophobicContact CE2-CD2 4.2Å; S237-L241 PolarHBondContact O-N 2.95Å; I238-L241 WeakPolarHBondContact O-CA 3.44Å; I238-L241 WeakPolarHBondContact O-CB 3.42Å; I238-L241 PolarHBondContact O-N 2.92Å; G239-L241 VanDerWaalsContact C-N 3.29Å; G239-L241 PolarHBondContact O-N 3.19Å; L241-Q245 WeakPolarHBondContact O-CG 3.4Å; L241-Q245 PolarHBondContact O-N 3.28Å; L241-Q245 PolarHBondContact O-NE2 2.99Å
242	Y	90.1	Very high	87.7	Confident	38 Å²	38	47.1 Å²	47.1	15%	0.149	24%	0.238	C	C	.	.	H	α-helix	trans	-71	-38.8	171.6	-75.7	-49.6	0	0	0	112.1	F218 I238 G239 Q244 Q245 N246 Q247 D250 A254	F218-Y242 HydrophobicContact CE2-CE1 4.17Å; F218-Y242 HydrophobicContact CE2-CE2 4.47Å; F218-Y242 AromaticContact CE2-CZ 3.77Å; F218-Y242 WeakPolarHBondContact CE2-OH 3.42Å; I238-Y242 HydrophobicContact CG2-CD2 3.7Å; I238-Y242 HydrophobicContact CG2-CE2 3.47Å; I238-Y242 VanDerWaalsContact CG2-CE2 3.47Å; I238-Y242 PolarHBondContact O-N 2.87Å; G239-Y242 PolarHBondContact O-N 2.82Å; Y242-Q244 VanDerWaalsContact C-N 3.33Å; Y242-Q244 PolarHBondContact O-N 3.27Å; Y242-Q245 CarbonylContact O-C 3.05Å; Y242-Q245 WeakPolarHBondContact O-CA 3.16Å; Y242-Q245 PolarHBondContact O-N 2.83Å; Y242-N246 PolarHBondContact O-N 2.87Å; Y242-Q247 HydrophobicContact CD1-CB 4.41Å; Y242-Q247 PolarHBondContact O-N 3.37Å; Y242-D250 HydrophobicContact CD1-CB 3.97Å; Y242-D250 HydrophobicContact CD2-CB 3.72Å; Y242-D250 HydrophobicContact CE1-CB 4.12Å; Y242-D250 HydrophobicContact CE2-CB 3.86Å; Y242-D250 HydrophobicContact CG-CB 3.76Å; Y242-A254 HydrophobicContact CD2-CB 4.37Å
243	Q	86.4	Confident	87.7	Confident	58 Å²	58	48.1 Å²	48.1	27%	0.271	24%	0.241	S	C	.	.	H	α-helix	trans	-64.7	-37.6	176.3	-168.3	171.2	-2.4	0	0	111.7	G239 V240 Q245 N246 A251 Y255 L275	G239-Q243 WeakPolarHBondContact O-CB 3.38Å; G239-Q243 PolarHBondContact O-N 2.97Å; V240-Q243 PolarHBondContact O-N 3.43Å; Q243-Q245 VanDerWaalsContact C-N 3.26Å; Q243-Q245 PolarHBondContact O-N 2.93Å; Q243-N246 PolarHBondContact O-N 2.93Å; Q243-N246 VanDerWaalsContact O-N 3.11Å; Q243-A251 HydrophobicContact CB-CB 4.06Å; Q243-Y255 PolarHBondContact OE1-OH 3.38Å; Q243-L275 HydrophobicContact CG-CD1 4.24Å
244	Q	85.9	Confident	87.7	Confident	123 Å²	123	44.6 Å²	44.6	58%	0.575	22%	0.222	S	C	*	.	H	α-helix	trans	-63.8	-28.2	170.6	-74.4	173.5	7.5	0	0	113.5	V240 Y242 N246	V240-Q244 VanDerWaalsContact O-CG 3.3Å; V240-Q244 WeakPolarHBondContact O-CG 3.32Å; V240-Q244 PolarHBondContact O-N 3.13Å; Y242-Q244 VanDerWaalsContact C-N 3.33Å; Y242-Q244 PolarHBondContact O-N 3.27Å; Q244-N246 VanDerWaalsContact C-N 3.29Å
245	Q	85.7	Confident	87.8	Confident	78 Å²	78	44.6 Å²	44.6	36%	0.364	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.2	7	174.3	-70.5	171.7	96.6	0	0	113.3	V214 L241 Y242 Q243 Q247	V214-Q245 HydrophobicContact CG1-CG 4.03Å; L241-Q245 WeakPolarHBondContact O-CG 3.4Å; L241-Q245 PolarHBondContact O-N 3.28Å; L241-Q245 PolarHBondContact O-NE2 2.99Å; Y242-Q245 CarbonylContact O-C 3.05Å; Y242-Q245 WeakPolarHBondContact O-CA 3.16Å; Y242-Q245 PolarHBondContact O-N 2.83Å; Q243-Q245 VanDerWaalsContact C-N 3.26Å; Q243-Q245 PolarHBondContact O-N 2.93Å; Q245-Q247 VanDerWaalsContact C-N 3.27Å; Q245-Q247 HydrophobicContact CB-CG 4.43Å; Q245-Q247 PolarHBondContact O-N 3.43Å
246	N	84.2	Confident	87.6	Confident	143 Å²	143	43.4 Å²	43.4	77%	0.765	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.3	36.9	-175.8	-163.8	54.6	0	0	0	113.4	Y242 Q243 Q244 P248	Y242-N246 PolarHBondContact O-N 2.87Å; Q243-N246 PolarHBondContact O-N 2.93Å; Q243-N246 VanDerWaalsContact O-N 3.11Å; Q244-N246 VanDerWaalsContact C-N 3.29Å; N246-P248 VanDerWaalsContact C-CD 3.46Å; N246-P248 WeakPolarHBondContact O-CD 3.33Å
247	Q	85.4	Confident	87.3	Confident	78 Å²	78	44 Å²	44	36%	0.364	22%	0.224	S	C	.	.			trans	-109.1	78.3	175.8	-70.2	178.5	-9.4	0	0	110.1	Y242 Q245 M249 D250 A251	Y242-Q247 HydrophobicContact CD1-CB 4.41Å; Y242-Q247 PolarHBondContact O-N 3.37Å; Q245-Q247 VanDerWaalsContact C-N 3.27Å; Q245-Q247 HydrophobicContact CB-CG 4.43Å; Q245-Q247 PolarHBondContact O-N 3.43Å; Q247-M249 PolarHBondContact O-N 3.27Å; Q247-D250 HydrophobicContact CB-CB 4.4Å; Q247-A251 WeakPolarHBondContact O-CB 3.4Å; Q247-A251 PolarHBondContact O-N 3.05Å
248	P	81.6	Confident	87.2	Confident	53 Å²	53	43.7 Å²	43.7	34%	0.344	22%	0.223	S	C	.	.	H	α-helix	trans	-70.4	-26.3	-170.1	27.6	-36.2	0	0	0	114.1	N246 L252 L275	N246-P248 VanDerWaalsContact C-CD 3.46Å; N246-P248 WeakPolarHBondContact O-CD 3.33Å; P248-L252 WeakPolarHBondContact O-CB 3.5Å; P248-L252 PolarHBondContact O-N 3.37Å; P248-L275 HydrophobicContact CB-CD1 3.99Å
249	M	80.5	Confident	87.1	Confident	119 Å²	119	43.8 Å²	43.8	59%	0.586	22%	0.223	S	C	*	.	H	α-helix	trans	-72.7	-43.3	179	-67.8	-58.1	-58.4	0	0	111.8	Q247 L252 Q253	Q247-M249 PolarHBondContact O-N 3.27Å; M249-L252 WeakPolarHBondContact O-CB 3.48Å; M249-L252 PolarHBondContact O-N 3.18Å; M249-Q253 PolarHBondContact O-N 3.28Å
250	D	85.3	Confident	86.9	Confident	46 Å²	46	46.3 Å²	46.3	25%	0.246	24%	0.235	C	C	.	.	H	α-helix	trans	-71.3	-36.2	177.8	-49.3	-89	0	0	0	110.9	Y242 Q247 A254	Y242-D250 HydrophobicContact CD1-CB 3.97Å; Y242-D250 HydrophobicContact CD2-CB 3.72Å; Y242-D250 HydrophobicContact CE1-CB 4.12Å; Y242-D250 HydrophobicContact CE2-CB 3.86Å; Y242-D250 HydrophobicContact CG-CB 3.76Å; Q247-D250 HydrophobicContact CB-CB 4.4Å; D250-A254 WeakPolarHBondContact O-CB 3.49Å; D250-A254 PolarHBondContact O-N 3.43Å
251	A	88.7	Confident	86.5	Confident	0 Å²	0	48 Å²	48	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-61	-48.6	169.3	0	0	0	0	0	112.2	G239 Q243 Q247 Q253 A254 Y255 L275	G239-A251 WeakPolarHBondContact O-CB 3.49Å; Q243-A251 HydrophobicContact CB-CB 4.06Å; Q247-A251 WeakPolarHBondContact O-CB 3.4Å; Q247-A251 PolarHBondContact O-N 3.05Å; A251-Q253 VanDerWaalsContact C-N 3.33Å; A251-Q253 PolarHBondContact O-N 2.83Å; A251-A254 PolarHBondContact O-N 2.89Å; A251-Y255 HydrophobicContact CB-CE2 4.21Å; A251-Y255 WeakPolarHBondContact O-CD2 3.41Å; A251-Y255 PolarHBondContact O-N 2.95Å; A251-L275 HydrophobicContact CB-CD1 4.45Å; A251-L275 HydrophobicContact CB-CD2 4Å
252	L	88.6	Confident	86.2	Confident	36 Å²	36	50.9 Å²	50.9	19%	0.188	26%	0.257	C	S	.	.	H	α-helix	trans	-54.8	-49.2	177.2	171.4	60.9	0	0	0	110.9	P248 M249 Y255 I256 L272 L275 Y276	P248-L252 WeakPolarHBondContact O-CB 3.5Å; P248-L252 PolarHBondContact O-N 3.37Å; M249-L252 WeakPolarHBondContact O-CB 3.48Å; M249-L252 PolarHBondContact O-N 3.18Å; L252-Y255 PolarHBondContact O-N 2.94Å; L252-I256 HydrophobicContact CD1-CD1 3.71Å; L252-I256 HydrophobicContact CD1-CG1 4.22Å; L252-I256 HydrophobicContact CG-CD1 3.88Å; L252-I256 WeakPolarHBondContact O-CB 3.45Å; L252-I256 VanDerWaalsContact O-CG1 3.25Å; L252-I256 WeakPolarHBondContact O-CG1 3.31Å; L252-I256 PolarHBondContact O-N 3.17Å; L252-L272 HydrophobicContact CD1-CD1 3.51Å; L252-L275 VanDerWaalsContact CA-CD2 3.43Å; L252-L275 HydrophobicContact CB-CD2 3.7Å; L252-L275 HydrophobicContact CD1-CD2 4.5Å; L252-L275 VanDerWaalsContact N-CD2 3.32Å; L252-Y276 HydrophobicContact CD1-CE1 4.18Å; L252-Y276 HydrophobicContact CD1-CE2 4.35Å
253	Q	85.4	Confident	86	Confident	29 Å²	29	55.4 Å²	55.4	14%	0.136	28%	0.28	C	S	.	.	H	α-helix	trans	-66.7	-40	-179.1	-176.9	58.5	53.2	0	0	112.5	M249 A251 I256 C257 N486 T488	M249-Q253 PolarHBondContact O-N 3.28Å; A251-Q253 VanDerWaalsContact C-N 3.33Å; A251-Q253 PolarHBondContact O-N 2.83Å; Q253-I256 PolarHBondContact O-N 2.87Å; Q253-C257 PolarHBondContact NE2-SG 2.97Å; Q253-C257 VanDerWaalsContact NE2-SG 3.4Å; Q253-C257 PolarHBondContact O-N 3.38Å; Q253-C257 PolarHBondContact O-SG 3.24Å; Q253-C257 VanDerWaalsContact O-SG 3.39Å; Q253-N486 PolarHBondContact NE2-O 2.93Å; Q253-T488 HydrophobicContact CB-CG2 4.27Å; Q253-T488 HydrophobicContact CG-CG2 3.67Å; Q253-T488 WeakPolarHBondContact CG-OG1 3.26Å
254	A	86.9	Confident	85.9	Confident	3 Å²	3	54.1 Å²	54.1	3%	0.025	28%	0.282	C	S	.	.	H	α-helix	trans	-64.7	-41.4	175.8	0	0	0	0	0	112.4	W235 I238 Y242 D250 A251 C257 A258	W235-A254 HydrophobicContact CE3-CB 4.23Å; I238-A254 HydrophobicContact CB-CB 4.48Å; I238-A254 HydrophobicContact CG2-CB 4.06Å; Y242-A254 HydrophobicContact CD2-CB 4.37Å; D250-A254 WeakPolarHBondContact O-CB 3.49Å; D250-A254 PolarHBondContact O-N 3.43Å; A251-A254 PolarHBondContact O-N 2.89Å; A254-C257 PolarHBondContact O-N 3.33Å; A254-A258 PolarHBondContact O-N 3.48Å
255	Y	91.4	Very high	85.8	Confident	1 Å²	1	49.4 Å²	49.4	0%	0.004	26%	0.26	C	S	.	.	H	α-helix	trans	-66	-38.3	173.7	-65.9	-45.7	0	0	0	112.6	C236 G239 V240 Q243 A251 L252 C257 A258 V259 D271 L272 L275	C236-Y255 WeakPolarHBondContact O-CE1 3.48Å; G239-Y255 VanDerWaalsContact C-CZ 3.45Å; V240-Y255 VanDerWaalsContact CA-OH 3.31Å; V240-Y255 WeakPolarHBondContact CA-OH 3.37Å; V240-Y255 HydrophobicContact CG2-CE1 4.08Å; V240-Y255 WeakPolarHBondContact CG2-OH 3.49Å; V240-Y255 PolarHBondContact N-OH 3.23Å; Q243-Y255 PolarHBondContact OE1-OH 3.38Å; A251-Y255 HydrophobicContact CB-CE2 4.21Å; A251-Y255 WeakPolarHBondContact O-CD2 3.41Å; A251-Y255 PolarHBondContact O-N 2.95Å; L252-Y255 PolarHBondContact O-N 2.94Å; Y255-C257 VanDerWaalsContact C-N 3.34Å; Y255-C257 PolarHBondContact O-N 3.4Å; Y255-A258 WeakPolarHBondContact O-CB 3.28Å; Y255-A258 PolarHBondContact O-N 2.93Å; Y255-A258 VanDerWaalsContact O-N 3.16Å; Y255-V259 PolarHBondContact O-N 2.96Å; Y255-D271 HydrophobicContact CD1-CB 4.21Å; Y255-D271 HydrophobicContact CE1-CB 3.57Å; Y255-D271 HydrophobicContact CE2-CB 4.3Å; Y255-L272 HydrophobicContact CD2-CB 4.47Å; Y255-L272 HydrophobicContact CD2-CD1 4.5Å; Y255-L272 HydrophobicContact CG-CB 4.41Å; Y255-L275 HydrophobicContact CD2-CB 4.47Å; Y255-L275 HydrophobicContact CD2-CD2 3.8Å; Y255-L275 HydrophobicContact CE2-CB 4.23Å; Y255-L275 HydrophobicContact CE2-CD2 3.96Å
256	I	87.8	Confident	85.9	Confident	37 Å²	37	46.6 Å²	46.6	19%	0.19	25%	0.25	C	S	.	.	H	α-helix	trans	-59.4	-44.7	173.5	-76.2	169.5	0	0	0	110.7	L252 Q253 A258 V259 Q260	L252-I256 HydrophobicContact CD1-CD1 3.71Å; L252-I256 HydrophobicContact CD1-CG1 4.22Å; L252-I256 HydrophobicContact CG-CD1 3.88Å; L252-I256 WeakPolarHBondContact O-CB 3.45Å; L252-I256 VanDerWaalsContact O-CG1 3.25Å; L252-I256 WeakPolarHBondContact O-CG1 3.31Å; L252-I256 PolarHBondContact O-N 3.17Å; Q253-I256 PolarHBondContact O-N 2.87Å; I256-A258 VanDerWaalsContact C-N 3.35Å; I256-A258 PolarHBondContact O-N 3.06Å; I256-V259 WeakPolarHBondContact O-CG2 3.24Å; I256-Q260 WeakPolarHBondContact O-CB 3.36Å; I256-Q260 VanDerWaalsContact O-CG 3.25Å; I256-Q260 WeakPolarHBondContact O-CG 3.21Å; I256-Q260 PolarHBondContact O-N 3.17Å
257	C	85.8	Confident	86	Confident	20 Å²	20	42 Å²	42	14%	0.135	23%	0.232	C	C	.	.	H	α-helix	trans	-61.5	-41	173.4	-68.9	0	0	0	0	112.1	W235 Q253 A254 Y255 Q260 L261	W235-C257 HydrophobicContact CB-CB 4.43Å; W235-C257 HydrophobicContact CD2-CB 3.84Å; W235-C257 HydrophobicContact CE3-CB 3.92Å; W235-C257 HydrophobicContact CG-CB 4.08Å; W235-C257 HydrophobicContact CZ3-CB 4.49Å; Q253-C257 PolarHBondContact NE2-SG 2.97Å; Q253-C257 VanDerWaalsContact NE2-SG 3.4Å; Q253-C257 PolarHBondContact O-N 3.38Å; Q253-C257 PolarHBondContact O-SG 3.24Å; Q253-C257 VanDerWaalsContact O-SG 3.39Å; A254-C257 PolarHBondContact O-N 3.33Å; Y255-C257 VanDerWaalsContact C-N 3.34Å; Y255-C257 PolarHBondContact O-N 3.4Å; C257-Q260 PolarHBondContact O-N 3.37Å; C257-L261 WeakPolarHBondContact O-CG 3.14Å; C257-L261 PolarHBondContact O-N 3.29Å; C257-L261 VanDerWaalsContact O-N 3.13Å
258	A	88.9	Confident	86.2	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-61.5	-48	178	0	0	0	0	0	113.1	W235 C236 A254 Y255 I256 Q260 L261 D262 A268	W235-A258 HydrophobicContact CB-CB 3.84Å; C236-A258 HydrophobicContact CB-CB 4.03Å; A254-A258 PolarHBondContact O-N 3.48Å; Y255-A258 WeakPolarHBondContact O-CB 3.28Å; Y255-A258 PolarHBondContact O-N 2.93Å; Y255-A258 VanDerWaalsContact O-N 3.16Å; I256-A258 VanDerWaalsContact C-N 3.35Å; I256-A258 PolarHBondContact O-N 3.06Å; A258-Q260 VanDerWaalsContact C-N 3.34Å; A258-Q260 PolarHBondContact O-N 3.19Å; A258-L261 PolarHBondContact O-N 3.06Å; A258-D262 PolarHBondContact O-N 3.21Å; A258-D262 VanDerWaalsContact O-N 3.09Å; A258-A268 HydrophobicContact CB-CB 3.69Å
259	V	88.9	Confident	86.7	Confident	9 Å²	9	37.6 Å²	37.6	6%	0.055	21%	0.205	C	C	.	.	H	α-helix	trans	-73.9	-23.2	-180	-58.6	0	0	0	0	113.3	Y255 I256 D262 H263 A268 W269 L272	Y255-V259 PolarHBondContact O-N 2.96Å; I256-V259 WeakPolarHBondContact O-CG2 3.24Å; V259-D262 CarbonylContact O-C 3.6Å; V259-H263 VanDerWaalsContact O-CA 3.25Å; V259-H263 WeakPolarHBondContact O-CA 3.2Å; V259-H263 PolarHBondContact O-N 3.1Å; V259-H263 PolarHBondContact O-ND1 3.08Å; V259-H263 VanDerWaalsContact O-ND1 3.15Å; V259-A268 HydrophobicContact CG1-CB 3.71Å; V259-W269 HydrophobicContact CB-CD2 4.18Å; V259-W269 HydrophobicContact CB-CH2 4.36Å; V259-W269 HydrophobicContact CB-CZ2 3.85Å; V259-W269 HydrophobicContact CG1-CD2 3.68Å; V259-W269 HydrophobicContact CG1-CE3 4.18Å; V259-W269 HydrophobicContact CG1-CG 3.84Å; V259-W269 HydrophobicContact CG1-CZ2 4.3Å; V259-W269 HydrophobicContact CG2-CH2 4.1Å; V259-W269 HydrophobicContact CG2-CZ2 4.06Å; V259-W269 HydrophobicContact CG2-CZ3 4.45Å; V259-L272 HydrophobicContact CG2-CD2 4.46Å
260	Q	86.8	Confident	87.2	Confident	53 Å²	53	34.8 Å²	34.8	25%	0.248	19%	0.192	C	C	.	.	H	α-helix	trans	-71.1	-35	170.9	-75.2	173.2	16	0	0	112	I256 C257 A258 H263 H485	I256-Q260 WeakPolarHBondContact O-CB 3.36Å; I256-Q260 VanDerWaalsContact O-CG 3.25Å; I256-Q260 WeakPolarHBondContact O-CG 3.21Å; I256-Q260 PolarHBondContact O-N 3.17Å; C257-Q260 PolarHBondContact O-N 3.37Å; A258-Q260 VanDerWaalsContact C-N 3.34Å; A258-Q260 PolarHBondContact O-N 3.19Å; Q260-H263 PolarHBondContact O-CE1 3.35Å; Q260-H263 PolarHBondContact O-ND1 3.45Å; Q260-H485 PolarHBondContact OE1-ND1 2.91Å
261	L	82.8	Confident	87.5	Confident	83 Å²	83	34.8 Å²	34.8	44%	0.435	19%	0.191	S	C	.	.	H	α-helix	trans	-76	-42.6	178.2	-69.7	174.9	0	0	0	113.2	A230 A232 W235 C257 A258	A230-L261 HydrophobicContact CB-CD1 4.01Å; A230-L261 HydrophobicContact CB-CD2 3.7Å; A230-L261 HydrophobicContact CB-CG 4.49Å; A232-L261 HydrophobicContact CB-CB 4.01Å; W235-L261 VanDerWaalsContact CD1-CD1 3.43Å; W235-L261 HydrophobicContact CG-CD1 4.37Å; C257-L261 WeakPolarHBondContact O-CG 3.14Å; C257-L261 PolarHBondContact O-N 3.29Å; C257-L261 VanDerWaalsContact O-N 3.13Å; A258-L261 PolarHBondContact O-N 3.06Å
262	D	83.4	Confident	87.6	Confident	61 Å²	61	35 Å²	35	33%	0.326	19%	0.193	S	C	.	.			trans	-131.2	100.3	167.8	176.6	14.2	0	0	0	110.2	A232 A258 V259 G264 H265	A232-D262 HydrophobicContact CB-CB 3.84Å; A258-D262 PolarHBondContact O-N 3.21Å; A258-D262 VanDerWaalsContact O-N 3.09Å; V259-D262 CarbonylContact O-C 3.6Å; D262-G264 PolarHBondContact O-N 2.83Å; D262-G264 VanDerWaalsContact O-N 3.13Å; D262-G264 WeakPolarHBondContact OD1-CA 3.15Å; D262-G264 PolarHBondContact OD1-N 3.26Å; D262-H265 HydrophobicContact CB-CB 3.9Å; D262-H265 WeakPolarHBondContact O-CB 3.43Å; D262-H265 PolarHBondContact O-N 3.13Å; D262-H265 PolarHBondContact OD1-N 3.15Å
263	H	84.9	Confident	87.8	Confident	133 Å²	133	33.3 Å²	33.3	62%	0.616	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-18.5	177.6	-71.8	57.3	0	0	0	112.7	V259 Q260 W269	V259-H263 VanDerWaalsContact O-CA 3.25Å; V259-H263 WeakPolarHBondContact O-CA 3.2Å; V259-H263 PolarHBondContact O-N 3.1Å; V259-H263 PolarHBondContact O-ND1 3.08Å; V259-H263 VanDerWaalsContact O-ND1 3.15Å; Q260-H263 PolarHBondContact O-CE1 3.35Å; Q260-H263 PolarHBondContact O-ND1 3.45Å; H263-W269 PolarHBondContact O-NE1 3.1Å
264	G	84.1	Confident	88.1	Confident	32 Å²	32	34.5 Å²	34.5	33%	0.33	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-0.2	174.1	0	0	0	0	0	114.6	D262 A266 S295	D262-G264 PolarHBondContact O-N 2.83Å; D262-G264 VanDerWaalsContact O-N 3.13Å; D262-G264 WeakPolarHBondContact OD1-CA 3.15Å; D262-G264 PolarHBondContact OD1-N 3.26Å; G264-A266 PolarHBondContact O-N 3.18Å; G264-S295 VanDerWaalsContact O-CB 3.3Å; G264-S295 WeakPolarHBondContact O-CB 3.39Å; G264-S295 PolarHBondContact O-OG 3.25Å
265	H	85.6	Confident	88.3	Confident	24 Å²	24	34.6 Å²	34.6	11%	0.111	19%	0.193	C	C	.	.			trans	-75.1	91.1	-175	-168.9	70.7	0	0	0	111.9	D233 D262 A267 A268 W269	D233-H265 IonicContact OD1-CE1 2.63Å; D233-H265 PolarHBondContact OD1-CE1 2.96Å; D233-H265 VanDerWaalsContact OD1-CE1 3.32Å; D262-H265 HydrophobicContact CB-CB 3.9Å; D262-H265 WeakPolarHBondContact O-CB 3.43Å; D262-H265 PolarHBondContact O-N 3.13Å; D262-H265 PolarHBondContact OD1-N 3.15Å; H265-A267 PolarHBondContact O-N 3.15Å; H265-A267 VanDerWaalsContact O-N 3.16Å; H265-A268 PolarHBondContact CD2-N 3.27Å; H265-A268 PolarHBondContact O-N 2.92Å; H265-W269 PolarHBondContact O-N 3.4Å
266	A	86.6	Confident	88.2	Confident	19 Å²	19	36.6 Å²	36.6	16%	0.157	20%	0.201	C	C	.	.	H	α-helix	trans	-59.4	-28.1	-173.1	0	0	0	0	0	114.5	G264 M270 C298	G264-A266 PolarHBondContact O-N 3.18Å; A266-M270 WeakPolarHBondContact O-CB 3.29Å; A266-M270 PolarHBondContact O-N 3.25Å; A266-M270 VanDerWaalsContact O-N 3.11Å; A266-C298 HydrophobicContact CB-CB 4.1Å
267	A	86.7	Confident	88.1	Confident	46 Å²	46	36.8 Å²	36.8	38%	0.38	20%	0.201	S	C	.	.	H	α-helix	trans	-67.1	-59.7	179.2	0	0	0	0	0	111.3	H265 W269 M270 D271	H265-A267 PolarHBondContact O-N 3.15Å; H265-A267 VanDerWaalsContact O-N 3.16Å; A267-W269 PolarHBondContact O-N 3.34Å; A267-W269 VanDerWaalsContact O-N 3.16Å; A267-M270 CarbonylContact O-C 3.59Å; A267-M270 WeakPolarHBondContact O-CA 3.1Å; A267-M270 WeakPolarHBondContact O-CB 3.31Å; A267-M270 PolarHBondContact O-N 3.14Å; A267-D271 PolarHBondContact O-N 3.45Å
268	A	88.9	Confident	88.1	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-59.4	-32	178.6	0	0	0	0	0	113.2	C236 A258 V259 H265 M270 L272	C236-A268 HydrophobicContact CB-CB 4.13Å; A258-A268 HydrophobicContact CB-CB 3.69Å; V259-A268 HydrophobicContact CG1-CB 3.71Å; H265-A268 PolarHBondContact CD2-N 3.27Å; H265-A268 PolarHBondContact O-N 2.92Å; A268-M270 VanDerWaalsContact C-N 3.35Å; A268-L272 WeakPolarHBondContact O-CB 3.45Å; A268-L272 PolarHBondContact O-N 3.07Å
269	W	92.5	Very high	87.9	Confident	38 Å²	38	42.6 Å²	42.6	14%	0.144	24%	0.241	C	C	.	.	H	α-helix	trans	-66.4	-33.4	171.7	-80.1	119.3	0	0	0	113.3	V259 H263 H265 A267 L272 G273 C288 N291 A292	V259-W269 HydrophobicContact CB-CD2 4.18Å; V259-W269 HydrophobicContact CB-CH2 4.36Å; V259-W269 HydrophobicContact CB-CZ2 3.85Å; V259-W269 HydrophobicContact CG1-CD2 3.68Å; V259-W269 HydrophobicContact CG1-CE3 4.18Å; V259-W269 HydrophobicContact CG1-CG 3.84Å; V259-W269 HydrophobicContact CG1-CZ2 4.3Å; V259-W269 HydrophobicContact CG2-CH2 4.1Å; V259-W269 HydrophobicContact CG2-CZ2 4.06Å; V259-W269 HydrophobicContact CG2-CZ3 4.45Å; H263-W269 PolarHBondContact O-NE1 3.1Å; H265-W269 PolarHBondContact O-N 3.4Å; A267-W269 PolarHBondContact O-N 3.34Å; A267-W269 VanDerWaalsContact O-N 3.16Å; W269-L272 HydrophobicContact CE3-CD2 4.19Å; W269-L272 HydrophobicContact CZ3-CD2 4.14Å; W269-G273 PolarHBondContact O-N 3.49Å; W269-G273 VanDerWaalsContact O-N 3.13Å; W269-C288 HydrophobicContact CE3-CB 3.98Å; W269-C288 HydrophobicContact CZ3-CB 4.48Å; W269-C288 WeakPolarHBondContact O-CB 3.49Å; W269-N291 HydrophobicContact CD2-CB 3.64Å; W269-N291 HydrophobicContact CE3-CB 3.95Å; W269-N291 HydrophobicContact CG-CB 4.01Å; W269-N291 HydrophobicContact CH2-CB 4.47Å; W269-N291 VanDerWaalsContact CH2-ND2 3.34Å; W269-N291 WeakPolarHBondContact CH2-ND2 3.42Å; W269-N291 HydrophobicContact CZ2-CB 4.18Å; W269-N291 HydrophobicContact CZ3-CB 4.35Å; W269-A292 HydrophobicContact CB-CB 3.71Å
270	M	91.3	Very high	87.7	Confident	61 Å²	61	48.6 Å²	48.6	30%	0.3	27%	0.273	S	S	.	.	H	α-helix	trans	-75.9	-40.8	174.5	-179.5	169.5	175.5	0	0	111.9	A266 A267 A268 G273 T274 Y289 A292 L304	A266-M270 WeakPolarHBondContact O-CB 3.29Å; A266-M270 PolarHBondContact O-N 3.25Å; A266-M270 VanDerWaalsContact O-N 3.11Å; A267-M270 CarbonylContact O-C 3.59Å; A267-M270 WeakPolarHBondContact O-CA 3.1Å; A267-M270 WeakPolarHBondContact O-CB 3.31Å; A267-M270 PolarHBondContact O-N 3.14Å; A268-M270 VanDerWaalsContact C-N 3.35Å; M270-G273 PolarHBondContact O-N 3.44Å; M270-T274 WeakPolarHBondContact O-CB 3.37Å; M270-T274 PolarHBondContact O-N 3.47Å; M270-T274 PolarHBondContact O-OG1 3.18Å; M270-Y289 HydrophobicContact CG-CE1 4.2Å; M270-Y289 WeakPolarHBondContact O-CE1 3.38Å; M270-A292 HydrophobicContact CB-CB 4.47Å; M270-L304 HydrophobicContact CE-CD2 4.35Å; M270-L304 HydrophobicContact CG-CD2 4.08Å; M270-L304 HydrophobicContact SD-CD2 3.94Å
271	D	91.9	Very high	87.6	Confident	45 Å²	45	47.8 Å²	47.8	24%	0.241	27%	0.269	C	S	.	.	H	α-helix	trans	-70.8	-40.1	179.3	-60.4	-40.1	0	0	0	111.2	Y255 A267 T274 L275	Y255-D271 HydrophobicContact CD1-CB 4.21Å; Y255-D271 HydrophobicContact CE1-CB 3.57Å; Y255-D271 HydrophobicContact CE2-CB 4.3Å; A267-D271 PolarHBondContact O-N 3.45Å; D271-T274 WeakPolarHBondContact O-CB 3.41Å; D271-T274 PolarHBondContact O-N 2.95Å; D271-L275 PolarHBondContact O-N 3.46Å
272	L	91.4	Very high	87.6	Confident	5 Å²	5	45.8 Å²	45.8	3%	0.026	26%	0.261	C	S	.	.	H	α-helix	trans	-61.7	-41.2	169.5	-179	58	0	0	0	112.1	L252 Y255 V259 A268 W269 T274 L275 Y276	L252-L272 HydrophobicContact CD1-CD1 3.51Å; Y255-L272 HydrophobicContact CD2-CB 4.47Å; Y255-L272 HydrophobicContact CD2-CD1 4.5Å; Y255-L272 HydrophobicContact CG-CB 4.41Å; V259-L272 HydrophobicContact CG2-CD2 4.46Å; A268-L272 WeakPolarHBondContact O-CB 3.45Å; A268-L272 PolarHBondContact O-N 3.07Å; W269-L272 HydrophobicContact CE3-CD2 4.19Å; W269-L272 HydrophobicContact CZ3-CD2 4.14Å; L272-T274 VanDerWaalsContact C-N 3.33Å; L272-L275 PolarHBondContact O-N 3.41Å; L272-Y276 HydrophobicContact CD1-CD2 3.92Å; L272-Y276 HydrophobicContact CD1-CE2 3.52Å; L272-Y276 HydrophobicContact CD2-CE2 4.24Å; L272-Y276 HydrophobicContact CG-CD2 3.92Å; L272-Y276 HydrophobicContact CG-CE2 3.68Å; L272-Y276 VanDerWaalsContact O-CD2 3.24Å; L272-Y276 WeakPolarHBondContact O-CD2 3.44Å; L272-Y276 PolarHBondContact O-N 2.97Å
273	G	91.5	Very high	87.6	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-61.5	-42.4	173.3	0	0	0	0	0	112.2	W269 M270 L275 Y276 E277 A285	W269-G273 PolarHBondContact O-N 3.49Å; W269-G273 VanDerWaalsContact O-N 3.13Å; M270-G273 PolarHBondContact O-N 3.44Å; G273-L275 VanDerWaalsContact C-N 3.34Å; G273-Y276 PolarHBondContact O-N 3.45Å; G273-E277 PolarHBondContact O-N 3.24Å; G273-A285 VanDerWaalsContact O-CB 3.3Å; G273-A285 WeakPolarHBondContact O-CB 3.38Å
274	T	91.1	Very high	87.6	Confident	55 Å²	55	43.5 Å²	43.5	34%	0.337	25%	0.25	S	S	.	.	H	α-helix	trans	-65	-38.3	176.4	-54.6	0	0	0	0	111.6	M270 D271 L272 E277 S278 Y289	M270-T274 WeakPolarHBondContact O-CB 3.37Å; M270-T274 PolarHBondContact O-N 3.47Å; M270-T274 PolarHBondContact O-OG1 3.18Å; D271-T274 WeakPolarHBondContact O-CB 3.41Å; D271-T274 PolarHBondContact O-N 2.95Å; L272-T274 VanDerWaalsContact C-N 3.33Å; T274-E277 PolarHBondContact O-N 3.07Å; T274-S278 PolarHBondContact O-N 3.5Å; T274-Y289 WeakPolarHBondContact CA-OH 3.36Å; T274-Y289 PolarHBondContact N-OH 3.46Å; T274-Y289 PolarHBondContact OG1-OH 3.12Å
275	L	91.2	Very high	87.8	Confident	4 Å²	4	42 Å²	42	2%	0.021	23%	0.234	C	C	.	.	H	α-helix	trans	-64.5	-47.9	174	-175.1	66.6	0	0	0	111.2	Q243 P248 A251 L252 Y255 D271 L272 G273 E277 S278 C279	Q243-L275 HydrophobicContact CG-CD1 4.24Å; P248-L275 HydrophobicContact CB-CD1 3.99Å; A251-L275 HydrophobicContact CB-CD1 4.45Å; A251-L275 HydrophobicContact CB-CD2 4Å; L252-L275 VanDerWaalsContact CA-CD2 3.43Å; L252-L275 HydrophobicContact CB-CD2 3.7Å; L252-L275 HydrophobicContact CD1-CD2 4.5Å; L252-L275 VanDerWaalsContact N-CD2 3.32Å; Y255-L275 HydrophobicContact CD2-CB 4.47Å; Y255-L275 HydrophobicContact CD2-CD2 3.8Å; Y255-L275 HydrophobicContact CE2-CB 4.23Å; Y255-L275 HydrophobicContact CE2-CD2 3.96Å; D271-L275 PolarHBondContact O-N 3.46Å; L272-L275 PolarHBondContact O-N 3.41Å; G273-L275 VanDerWaalsContact C-N 3.34Å; L275-E277 VanDerWaalsContact C-N 3.32Å; L275-E277 PolarHBondContact O-N 3.45Å; L275-S278 PolarHBondContact O-N 2.92Å; L275-S278 PolarHBondContact O-OG 2.91Å; L275-C279 PolarHBondContact O-N 2.67Å; L275-C279 PolarHBondContact O-SG 2.84Å
276	Y	89.2	Confident	87.9	Confident	44 Å²	44	41.3 Å²	41.3	17%	0.173	23%	0.232	C	C	.	.	H	α-helix	trans	-60.6	-37.4	174.9	-79.5	-57.3	0	0	0	112.9	L252 L272 G273 C279 N280 Q281 D284	L252-Y276 HydrophobicContact CD1-CE1 4.18Å; L252-Y276 HydrophobicContact CD1-CE2 4.35Å; L272-Y276 HydrophobicContact CD1-CD2 3.92Å; L272-Y276 HydrophobicContact CD1-CE2 3.52Å; L272-Y276 HydrophobicContact CD2-CE2 4.24Å; L272-Y276 HydrophobicContact CG-CD2 3.92Å; L272-Y276 HydrophobicContact CG-CE2 3.68Å; L272-Y276 VanDerWaalsContact O-CD2 3.24Å; L272-Y276 WeakPolarHBondContact O-CD2 3.44Å; L272-Y276 PolarHBondContact O-N 2.97Å; G273-Y276 PolarHBondContact O-N 3.45Å; Y276-C279 CarbonylContact O-C 3.56Å; Y276-C279 PolarHBondContact O-N 3.02Å; Y276-N280 PolarHBondContact O-N 2.91Å; Y276-Q281 HydrophobicContact CD1-CB 4.17Å; Y276-Q281 VanDerWaalsContact CD1-OE1 3.23Å; Y276-Q281 WeakPolarHBondContact O-CA 3.41Å; Y276-Q281 PolarHBondContact O-N 3.29Å; Y276-D284 HydrophobicContact CD1-CB 4.19Å; Y276-D284 HydrophobicContact CD2-CB 4.31Å; Y276-D284 HydrophobicContact CE1-CB 4.34Å; Y276-D284 HydrophobicContact CE2-CB 4.44Å; Y276-D284 HydrophobicContact CG-CB 4.17Å
277	E	87	Confident	88	Confident	41 Å²	41	45.6 Å²	45.6	19%	0.192	25%	0.247	C	C	.	.	H	α-helix	trans	-59.2	-47.5	169.5	-77.1	-158.3	-129.7	0	0	111.9	G273 T274 L275 C279 N280 A285 Y289 R307 L311	G273-E277 PolarHBondContact O-N 3.24Å; T274-E277 PolarHBondContact O-N 3.07Å; L275-E277 VanDerWaalsContact C-N 3.32Å; L275-E277 PolarHBondContact O-N 3.45Å; E277-C279 PolarHBondContact O-N 3.19Å; E277-N280 WeakPolarHBondContact O-CA 3.33Å; E277-N280 PolarHBondContact O-N 2.82Å; E277-A285 HydrophobicContact CG-CB 3.66Å; E277-Y289 HydrophobicContact CG-CE2 4.13Å; E277-Y289 WeakPolarHBondContact OE1-CE2 3.43Å; E277-Y289 VanDerWaalsContact OE1-CZ 3.29Å; E277-Y289 PolarHBondContact OE1-OH 3.04Å; E277-R307 WeakPolarHBondContact OE1-CG 3.4Å; E277-R307 IonicContact OE1-CZ 2.66Å; E277-R307 IonicContact OE1-NE 2.91Å; E277-R307 PolarHBondContact OE1-NE 2.99Å; E277-R307 IonicContact OE1-NH2 2.69Å; E277-R307 IonicContact OE2-CZ 2.75Å; E277-R307 VanDerWaalsContact OE2-CZ 3.23Å; E277-R307 IonicContact OE2-NE 3.97Å; E277-R307 PolarHBondContact OE2-NE 3.38Å; E277-R307 VanDerWaalsContact OE2-NE 3.11Å; E277-R307 IonicContact OE2-NH2 2.72Å; E277-R307 PolarHBondContact OE2-NH2 3.25Å; E277-L311 HydrophobicContact CG-CD1 4.07Å; E277-L311 HydrophobicContact CG-CD2 4.31Å
278	S	85.6	Confident	88.1	Confident	84 Å²	84	43.8 Å²	43.8	59%	0.587	23%	0.231	S	C	*	.	H	α-helix	trans	-64.9	-27.8	179.5	74.1	0	0	0	0	113.4	T274 L275 N280	T274-S278 PolarHBondContact O-N 3.5Å; L275-S278 PolarHBondContact O-N 2.92Å; L275-S278 PolarHBondContact O-OG 2.91Å; S278-N280 PolarHBondContact O-N 3.35Å
279	C	84.9	Confident	88.1	Confident	57 Å²	57	44.2 Å²	44.2	39%	0.385	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	9	171.3	-63.4	0	0	0	0	113.7	L275 Y276 E277 Q281	L275-C279 PolarHBondContact O-N 2.67Å; L275-C279 PolarHBondContact O-SG 2.84Å; Y276-C279 CarbonylContact O-C 3.56Å; Y276-C279 PolarHBondContact O-N 3.02Å; E277-C279 PolarHBondContact O-N 3.19Å; C279-Q281 VanDerWaalsContact C-N 3.35Å; C279-Q281 PolarHBondContact O-N 3.37Å
280	N	84.7	Confident	87.9	Confident	135 Å²	135	45.7 Å²	45.7	72%	0.722	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.1	38.6	-178.6	-160.4	42.9	0	0	0	114.2	Y276 E277 S278 P282	Y276-N280 PolarHBondContact O-N 2.91Å; E277-N280 WeakPolarHBondContact O-CA 3.33Å; E277-N280 PolarHBondContact O-N 2.82Å; S278-N280 PolarHBondContact O-N 3.35Å; N280-P282 VanDerWaalsContact O-CD 3.24Å; N280-P282 WeakPolarHBondContact O-CD 3.23Å
281	Q	84.7	Confident	87.7	Confident	37 Å²	37	45 Å²	45	17%	0.173	24%	0.241	C	C	.	.			trans	-115.6	67	178.4	-65.6	175.9	17.5	0	0	111	Y276 C279 Q283 D284 A285 P328	Y276-Q281 HydrophobicContact CD1-CB 4.17Å; Y276-Q281 VanDerWaalsContact CD1-OE1 3.23Å; Y276-Q281 WeakPolarHBondContact O-CA 3.41Å; Y276-Q281 PolarHBondContact O-N 3.29Å; C279-Q281 VanDerWaalsContact C-N 3.35Å; C279-Q281 PolarHBondContact O-N 3.37Å; Q281-Q283 VanDerWaalsContact C-N 3.27Å; Q281-Q283 PolarHBondContact O-N 3.24Å; Q281-D284 PolarHBondContact O-N 3.06Å; Q281-A285 PolarHBondContact O-N 3.22Å; Q281-A285 VanDerWaalsContact O-N 3.1Å; Q281-P328 HydrophobicContact CG-CG 4.48Å; Q281-P328 PolarHBondContact NE2-O 3.18Å
282	P	83.3	Confident	87.4	Confident	41 Å²	41	42.9 Å²	42.9	27%	0.266	23%	0.229	S	C	.	.	H	α-helix	trans	-62.4	-30.5	-171.5	25.2	-35.3	0	0	0	113.6	N280 A285 I286 L311	N280-P282 VanDerWaalsContact O-CD 3.24Å; N280-P282 WeakPolarHBondContact O-CD 3.23Å; P282-A285 PolarHBondContact O-N 2.77Å; P282-I286 WeakPolarHBondContact O-CB 3.48Å; P282-I286 WeakPolarHBondContact O-CD1 3.34Å; P282-I286 VanDerWaalsContact O-CG1 3.22Å; P282-I286 WeakPolarHBondContact O-CG1 3.5Å; P282-I286 PolarHBondContact O-N 2.8Å; P282-L311 HydrophobicContact CB-CD2 4.33Å
283	Q	82.9	Confident	86.9	Confident	100 Å²	100	44 Å²	44	47%	0.467	24%	0.24	S	C	.	.	H	α-helix	trans	-68.5	-34.5	-179.3	-66.2	-63.9	-20.2	0	0	112.8	Q281 K287	Q281-Q283 VanDerWaalsContact C-N 3.27Å; Q281-Q283 PolarHBondContact O-N 3.24Å; Q283-K287 WeakPolarHBondContact O-CE 3.31Å; Q283-K287 WeakPolarHBondContact O-CG 3.21Å
284	D	83.6	Confident	86.5	Confident	45 Å²	45	52.8 Å²	52.8	24%	0.241	27%	0.273	C	S	.	.	H	α-helix	trans	-84.8	-31.4	176.5	-68.1	-68.4	0	0	0	111.8	Y276 Q281 I286 K287 C288	Y276-D284 HydrophobicContact CD1-CB 4.19Å; Y276-D284 HydrophobicContact CD2-CB 4.31Å; Y276-D284 HydrophobicContact CE1-CB 4.34Å; Y276-D284 HydrophobicContact CE2-CB 4.44Å; Y276-D284 HydrophobicContact CG-CB 4.17Å; Q281-D284 PolarHBondContact O-N 3.06Å; D284-I286 PolarHBondContact O-N 2.72Å; D284-K287 PolarHBondContact O-N 3.08Å; D284-K287 WeakPolarHBondContact OD1-CE 3.3Å; D284-K287 IonicContact OD1-NZ 3.16Å; D284-K287 PolarHBondContact OD1-NZ 2.86Å; D284-K287 IonicContact OD2-NZ 3.91Å; D284-C288 PolarHBondContact O-N 3.2Å; D284-C288 VanDerWaalsContact O-N 3.1Å; D284-C288 PolarHBondContact O-SG 3.36Å
285	A	88.7	Confident	85.9	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-57.3	-46.7	166.6	0	0	0	0	0	112.4	G273 E277 Q281 P282 K287 C288 Y289 L311	G273-A285 VanDerWaalsContact O-CB 3.3Å; G273-A285 WeakPolarHBondContact O-CB 3.38Å; E277-A285 HydrophobicContact CG-CB 3.66Å; Q281-A285 PolarHBondContact O-N 3.22Å; Q281-A285 VanDerWaalsContact O-N 3.1Å; P282-A285 PolarHBondContact O-N 2.77Å; A285-K287 VanDerWaalsContact C-N 3.32Å; A285-K287 PolarHBondContact O-N 3.17Å; A285-C288 PolarHBondContact O-N 2.86Å; A285-C288 VanDerWaalsContact O-N 3.13Å; A285-Y289 HydrophobicContact CB-CD2 4.48Å; A285-Y289 HydrophobicContact CB-CE2 4.08Å; A285-Y289 WeakPolarHBondContact O-CD2 3.35Å; A285-Y289 PolarHBondContact O-N 3.41Å; A285-L311 HydrophobicContact CB-CD1 4.44Å
286	I	87.9	Confident	84.4	Confident	11 Å²	11	61.4 Å²	61.4	6%	0.056	31%	0.308	C	S	.	.	H	α-helix	trans	-56.8	-43.5	176.4	-74.1	161.9	0	0	0	111.4	P282 D284 C288 Y289 L290 I308 L311 Q312	P282-I286 WeakPolarHBondContact O-CB 3.48Å; P282-I286 WeakPolarHBondContact O-CD1 3.34Å; P282-I286 VanDerWaalsContact O-CG1 3.22Å; P282-I286 WeakPolarHBondContact O-CG1 3.5Å; P282-I286 PolarHBondContact O-N 2.8Å; D284-I286 PolarHBondContact O-N 2.72Å; I286-C288 VanDerWaalsContact C-N 3.34Å; I286-C288 PolarHBondContact O-N 3.32Å; I286-Y289 PolarHBondContact O-N 2.99Å; I286-L290 HydrophobicContact CG2-CD1 3.81Å; I286-L290 HydrophobicContact CG2-CG 4.4Å; I286-L290 WeakPolarHBondContact O-CB 3.34Å; I286-L290 VanDerWaalsContact O-CG 3.26Å; I286-L290 WeakPolarHBondContact O-CG 3.18Å; I286-L290 PolarHBondContact O-N 3.4Å; I286-I308 HydrophobicContact CG2-CG2 4.27Å; I286-L311 HydrophobicContact CD1-CB 3.85Å; I286-L311 HydrophobicContact CG1-CB 3.89Å; I286-L311 HydrophobicContact CG1-CD1 4.06Å; I286-Q312 HydrophobicContact CD1-CG 3.93Å
287	K	88.8	Confident	82.9	Confident	109 Å²	109	69.7 Å²	69.7	47%	0.474	34%	0.339	S	S	.	.	H	α-helix	trans	-61	-43.2	176.7	-64	166.2	-159	166.7	0	111.5	Q283 D284 A285 L290 N291	Q283-K287 WeakPolarHBondContact O-CE 3.31Å; Q283-K287 WeakPolarHBondContact O-CG 3.21Å; D284-K287 PolarHBondContact O-N 3.08Å; D284-K287 WeakPolarHBondContact OD1-CE 3.3Å; D284-K287 IonicContact OD1-NZ 3.16Å; D284-K287 PolarHBondContact OD1-NZ 2.86Å; D284-K287 IonicContact OD2-NZ 3.91Å; A285-K287 VanDerWaalsContact C-N 3.32Å; A285-K287 PolarHBondContact O-N 3.17Å; K287-L290 PolarHBondContact O-N 3.22Å; K287-N291 PolarHBondContact O-N 3.42Å; K287-N291 VanDerWaalsContact O-N 3.1Å
288	C	88.7	Confident	81.9	Confident	7 Å²	7	68.8 Å²	68.8	5%	0.047	34%	0.337	C	S	.	.	H	α-helix	trans	-65.2	-46.1	179.3	-63.2	0	0	0	0	111.7	W269 D284 A285 I286 L290 N291 A292	W269-C288 HydrophobicContact CE3-CB 3.98Å; W269-C288 HydrophobicContact CZ3-CB 4.48Å; W269-C288 WeakPolarHBondContact O-CB 3.49Å; D284-C288 PolarHBondContact O-N 3.2Å; D284-C288 VanDerWaalsContact O-N 3.1Å; D284-C288 PolarHBondContact O-SG 3.36Å; A285-C288 PolarHBondContact O-N 2.86Å; A285-C288 VanDerWaalsContact O-N 3.13Å; I286-C288 VanDerWaalsContact C-N 3.34Å; I286-C288 PolarHBondContact O-N 3.32Å; C288-L290 VanDerWaalsContact C-N 3.35Å; C288-L290 PolarHBondContact O-N 2.99Å; C288-N291 PolarHBondContact O-N 3.43Å; C288-N291 VanDerWaalsContact O-N 3.13Å; C288-A292 PolarHBondContact O-N 3.22Å
289	Y	89.5	Confident	80.8	Confident	9 Å²	9	69.6 Å²	69.6	4%	0.035	34%	0.343	C	S	.	.	H	α-helix	trans	-65.3	-34.2	175.7	-62	-47.3	0	0	0	113.6	M270 T274 E277 A285 I286 N291 A292 A293 L304 R307 I308 L311	M270-Y289 HydrophobicContact CG-CE1 4.2Å; M270-Y289 WeakPolarHBondContact O-CE1 3.38Å; T274-Y289 WeakPolarHBondContact CA-OH 3.36Å; T274-Y289 PolarHBondContact N-OH 3.46Å; T274-Y289 PolarHBondContact OG1-OH 3.12Å; E277-Y289 HydrophobicContact CG-CE2 4.13Å; E277-Y289 WeakPolarHBondContact OE1-CE2 3.43Å; E277-Y289 VanDerWaalsContact OE1-CZ 3.29Å; E277-Y289 PolarHBondContact OE1-OH 3.04Å; A285-Y289 HydrophobicContact CB-CD2 4.48Å; A285-Y289 HydrophobicContact CB-CE2 4.08Å; A285-Y289 WeakPolarHBondContact O-CD2 3.35Å; A285-Y289 PolarHBondContact O-N 3.41Å; I286-Y289 PolarHBondContact O-N 2.99Å; Y289-N291 VanDerWaalsContact C-N 3.3Å; Y289-N291 PolarHBondContact O-N 3.23Å; Y289-A292 PolarHBondContact O-N 3.25Å; Y289-A293 VanDerWaalsContact O-CB 3.32Å; Y289-A293 WeakPolarHBondContact O-CB 3.41Å; Y289-A293 PolarHBondContact O-N 3.1Å; Y289-L304 HydrophobicContact CD1-CD2 3.65Å; Y289-L304 HydrophobicContact CE1-CD2 4.23Å; Y289-L304 HydrophobicContact CG-CD2 4.24Å; Y289-R307 HydrophobicContact CE2-CG 4.15Å; Y289-I308 HydrophobicContact CD2-CG1 4.47Å; Y289-L311 HydrophobicContact CD2-CD1 4.14Å; Y289-L311 HydrophobicContact CE2-CD1 3.8Å
290	L	88	Confident	80	Confident	69 Å²	69	70.5 Å²	70.5	36%	0.361	34%	0.344	S	S	.	.	H	α-helix	trans	-63.8	-36.2	172.6	-76.1	167.5	0	0	0	111.7	I286 K287 C288 R294 I308	I286-L290 HydrophobicContact CG2-CD1 3.81Å; I286-L290 HydrophobicContact CG2-CG 4.4Å; I286-L290 WeakPolarHBondContact O-CB 3.34Å; I286-L290 VanDerWaalsContact O-CG 3.26Å; I286-L290 WeakPolarHBondContact O-CG 3.18Å; I286-L290 PolarHBondContact O-N 3.4Å; K287-L290 PolarHBondContact O-N 3.22Å; C288-L290 VanDerWaalsContact C-N 3.35Å; C288-L290 PolarHBondContact O-N 2.99Å; L290-R294 VanDerWaalsContact O-CD 3.3Å; L290-R294 WeakPolarHBondContact O-CD 3.41Å; L290-R294 WeakPolarHBondContact O-CG 3.43Å; L290-R294 PolarHBondContact O-N 2.9Å; L290-I308 HydrophobicContact CD2-CD1 3.96Å; L290-I308 HydrophobicContact CG-CD1 4.06Å
291	N	86.4	Confident	79.5	Confident	47 Å²	47	66.9 Å²	66.9	25%	0.251	33%	0.326	S	S	.	.	H	α-helix	trans	-71.8	-40.9	173.4	-71.5	-16	0	0	0	112.2	W269 K287 C288 Y289 A293 R294	W269-N291 HydrophobicContact CD2-CB 3.64Å; W269-N291 HydrophobicContact CE3-CB 3.95Å; W269-N291 HydrophobicContact CG-CB 4.01Å; W269-N291 HydrophobicContact CH2-CB 4.47Å; W269-N291 VanDerWaalsContact CH2-ND2 3.34Å; W269-N291 WeakPolarHBondContact CH2-ND2 3.42Å; W269-N291 HydrophobicContact CZ2-CB 4.18Å; W269-N291 HydrophobicContact CZ3-CB 4.35Å; K287-N291 PolarHBondContact O-N 3.42Å; K287-N291 VanDerWaalsContact O-N 3.1Å; C288-N291 PolarHBondContact O-N 3.43Å; C288-N291 VanDerWaalsContact O-N 3.13Å; Y289-N291 VanDerWaalsContact C-N 3.3Å; Y289-N291 PolarHBondContact O-N 3.23Å; N291-A293 VanDerWaalsContact C-N 3.34Å; N291-A293 PolarHBondContact O-N 3.37Å; N291-R294 PolarHBondContact O-N 3.36Å; N291-R294 PolarHBondContact OD1-NH1 2.94Å
292	A	85.8	Confident	79.1	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-56.5	-46.9	172.1	0	0	0	0	0	111.9	W269 M270 C288 Y289 R294 S295 C298 L304	W269-A292 HydrophobicContact CB-CB 3.71Å; M270-A292 HydrophobicContact CB-CB 4.47Å; C288-A292 PolarHBondContact O-N 3.22Å; Y289-A292 PolarHBondContact O-N 3.25Å; A292-R294 VanDerWaalsContact C-N 3.26Å; A292-R294 PolarHBondContact O-N 3.47Å; A292-S295 WeakPolarHBondContact O-CB 3.43Å; A292-S295 PolarHBondContact O-N 3.45Å; A292-C298 WeakPolarHBondContact O-CB 3.49Å; A292-L304 HydrophobicContact CB-CD1 3.83Å
293	A	82.4	Confident	78.9	Confident	30 Å²	30	71.9 Å²	71.9	25%	0.248	36%	0.363	C	S	.	.	H	α-helix	trans	-68.4	-18.6	179.9	0	0	0	0	0	114.4	Y289 N291 T301 L304	Y289-A293 VanDerWaalsContact O-CB 3.32Å; Y289-A293 WeakPolarHBondContact O-CB 3.41Å; Y289-A293 PolarHBondContact O-N 3.1Å; N291-A293 VanDerWaalsContact C-N 3.34Å; N291-A293 PolarHBondContact O-N 3.37Å; A293-T301 HydrophobicContact CB-CG2 4.3Å; A293-L304 HydrophobicContact CB-CD1 4.38Å
294	R	81.3	Confident	78.9	Confident	183 Å²	183	67.3 Å²	67.3	69%	0.691	34%	0.341	S	S	*	.	H	α-helix	trans	-80.2	-13.8	174.1	-76.2	162.5	174.1	171.6	-6.8	113.3	L290 N291 A292	L290-R294 VanDerWaalsContact O-CD 3.3Å; L290-R294 WeakPolarHBondContact O-CD 3.41Å; L290-R294 WeakPolarHBondContact O-CG 3.43Å; L290-R294 PolarHBondContact O-N 2.9Å; N291-R294 PolarHBondContact O-N 3.36Å; N291-R294 PolarHBondContact OD1-NH1 2.94Å; A292-R294 VanDerWaalsContact C-N 3.26Å; A292-R294 PolarHBondContact O-N 3.47Å
295	S	78.4	Confident	78.7	Confident	21 Å²	21	67.4 Å²	67.4	15%	0.147	35%	0.349	C	S	.	.	S	Bend	trans	-75.4	131.2	-179	-178.2	0	0	0	0	112.4	G264 A292 R297 C298	G264-S295 VanDerWaalsContact O-CB 3.3Å; G264-S295 WeakPolarHBondContact O-CB 3.39Å; G264-S295 PolarHBondContact O-OG 3.25Å; A292-S295 WeakPolarHBondContact O-CB 3.43Å; A292-S295 PolarHBondContact O-N 3.45Å; S295-R297 PolarHBondContact O-N 3.3Å; S295-R297 PolarHBondContact OG-N 3.02Å; S295-C298 WeakPolarHBondContact O-CB 3.39Å; S295-C298 PolarHBondContact O-N 3.2Å; S295-C298 VanDerWaalsContact O-N 3.07Å
296	K	61	Low	78.4	Confident	219 Å²	219	70.3 Å²	70.3	95%	0.952	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-4.3	175.9	-65.4	-177.4	179.1	178	0	114.5
297	R	57	Low	78.3	Confident	218 Å²	218	74.4 Å²	74.4	82%	0.823	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.5	5.4	175.8	-67.6	-175.7	178.5	161.7	1.6	113.7	S295 S299	S295-R297 PolarHBondContact O-N 3.3Å; S295-R297 PolarHBondContact OG-N 3.02Å; R297-S299 PolarHBondContact O-N 2.97Å
298	C	66.4	Low	78.2	Confident	23 Å²	23	69.8 Å²	69.8	16%	0.155	37%	0.368	C	S	.	.			trans	-79.4	112.5	-179.5	-177.2	0	0	0	0	111.8	A266 A292 S295 T301	A266-C298 HydrophobicContact CB-CB 4.1Å; A292-C298 WeakPolarHBondContact O-CB 3.49Å; S295-C298 WeakPolarHBondContact O-CB 3.39Å; S295-C298 PolarHBondContact O-N 3.2Å; S295-C298 VanDerWaalsContact O-N 3.07Å; C298-T301 PolarHBondContact O-OG1 2.9Å; C298-T301 VanDerWaalsContact O-OG1 3.09Å; C298-T301 PolarHBondContact SG-OG1 2.88Å; C298-T301 VanDerWaalsContact SG-OG1 3.32Å
299	S	63	Low	78	Confident	100 Å²	100	76 Å²	76	70%	0.699	39%	0.394	S	S	*	.	S	Bend	trans	-80.9	-21.7	173.5	52	0	0	0	0	113.7	R297	R297-S299 PolarHBondContact O-N 2.97Å
300	N	68	Low	77.8	Confident	77 Å²	77	81.8 Å²	81.8	41%	0.412	42%	0.42	S	S	.	.			trans	-97.7	17.6	-170.6	-66.6	-16	0	0	0	113.9	S302 T303 L304	N300-S302 VanDerWaalsContact C-N 3.27Å; N300-S302 PolarHBondContact O-N 3.1Å; N300-S302 VanDerWaalsContact O-N 3.16Å; N300-T303 WeakPolarHBondContact O-CB 3.33Å; N300-T303 PolarHBondContact O-N 3.09Å; N300-L304 PolarHBondContact O-N 2.96Å
301	T	73.6	Confident	77.5	Confident	58 Å²	58	79.4 Å²	79.4	36%	0.356	41%	0.407	S	S	.	.	H	α-helix	trans	-57.4	-34.2	-168.9	-53.8	0	0	0	0	113.9	A293 C298 A305	A293-T301 HydrophobicContact CB-CG2 4.3Å; C298-T301 PolarHBondContact O-OG1 2.9Å; C298-T301 VanDerWaalsContact O-OG1 3.09Å; C298-T301 PolarHBondContact SG-OG1 2.88Å; C298-T301 VanDerWaalsContact SG-OG1 3.32Å; T301-A305 VanDerWaalsContact O-CB 3.31Å; T301-A305 WeakPolarHBondContact O-CB 3.49Å; T301-A305 PolarHBondContact O-N 3.47Å
302	S	75.8	Confident	77.3	Confident	92 Å²	92	81.5 Å²	81.5	64%	0.643	42%	0.415	S	S	*	.	H	α-helix	trans	-67.7	-43.1	174.3	49.6	0	0	0	0	112.7	N300 A305 A306	N300-S302 VanDerWaalsContact C-N 3.27Å; N300-S302 PolarHBondContact O-N 3.1Å; N300-S302 VanDerWaalsContact O-N 3.16Å; S302-A305 PolarHBondContact O-N 2.97Å; S302-A306 PolarHBondContact O-N 2.85Å
303	T	80	Confident	76.9	Confident	91 Å²	91	86.9 Å²	86.9	56%	0.558	44%	0.444	S	S	*	.	H	α-helix	trans	-67.6	-40.6	176.9	-52.6	0	0	0	0	111.5	N300 A306 R307	N300-T303 WeakPolarHBondContact O-CB 3.33Å; N300-T303 PolarHBondContact O-N 3.09Å; T303-A306 PolarHBondContact O-N 3.33Å; T303-R307 PolarHBondContact O-N 3.44Å
304	L	81.6	Confident	75.9	Confident	4 Å²	4	87.1 Å²	87.1	2%	0.021	45%	0.449	C	S	.	.	H	α-helix	trans	-62.8	-44.8	173.1	-70.3	176	0	0	0	111.6	M270 Y289 A292 A293 N300 A306 R307 I308	M270-L304 HydrophobicContact CE-CD2 4.35Å; M270-L304 HydrophobicContact CG-CD2 4.08Å; M270-L304 HydrophobicContact SD-CD2 3.94Å; Y289-L304 HydrophobicContact CD1-CD2 3.65Å; Y289-L304 HydrophobicContact CE1-CD2 4.23Å; Y289-L304 HydrophobicContact CG-CD2 4.24Å; A292-L304 HydrophobicContact CB-CD1 3.83Å; A293-L304 HydrophobicContact CB-CD1 4.38Å; N300-L304 PolarHBondContact O-N 2.96Å; L304-A306 VanDerWaalsContact C-N 3.28Å; L304-A306 PolarHBondContact O-N 3.03Å; L304-R307 PolarHBondContact O-N 2.86Å; L304-R307 VanDerWaalsContact O-N 3.15Å; L304-I308 WeakPolarHBondContact O-CB 3.42Å; L304-I308 WeakPolarHBondContact O-CD1 3.4Å; L304-I308 VanDerWaalsContact O-CG1 3.28Å; L304-I308 WeakPolarHBondContact O-CG1 3.34Å; L304-I308 PolarHBondContact O-N 3.22Å
305	A	81	Confident	74.6	Confident	47 Å²	47	80.4 Å²	80.4	39%	0.388	43%	0.43	S	S	.	.	H	α-helix	trans	-61.3	-36	175.6	0	0	0	0	0	112.6	T301 S302 K309	T301-A305 VanDerWaalsContact O-CB 3.31Å; T301-A305 WeakPolarHBondContact O-CB 3.49Å; T301-A305 PolarHBondContact O-N 3.47Å; S302-A305 PolarHBondContact O-N 2.97Å; A305-K309 WeakPolarHBondContact O-CG 3.38Å; A305-K309 PolarHBondContact O-N 2.75Å; A305-K309 VanDerWaalsContact O-N 3.15Å
306	A	82.4	Confident	73.1	Confident	61 Å²	61	84.8 Å²	84.8	50%	0.504	45%	0.453	S	S	.	.	H	α-helix	trans	-67.4	-41.9	172.6	0	0	0	0	0	112.3	S302 T303 L304 K309 F310	S302-A306 PolarHBondContact O-N 2.85Å; T303-A306 PolarHBondContact O-N 3.33Å; L304-A306 VanDerWaalsContact C-N 3.28Å; L304-A306 PolarHBondContact O-N 3.03Å; A306-K309 PolarHBondContact O-N 2.78Å; A306-F310 WeakPolarHBondContact O-CB 3.47Å; A306-F310 PolarHBondContact O-N 2.85Å
307	R	84.6	Confident	72.1	Confident	97 Å²	97	81.5 Å²	81.5	37%	0.366	45%	0.445	S	S	.	.	H	α-helix	trans	-67.2	-41.3	177.2	-170.9	53.5	168.7	-170.5	-2.1	112.3	E277 Y289 T303 L304 K309 F310 L311	E277-R307 WeakPolarHBondContact OE1-CG 3.4Å; E277-R307 IonicContact OE1-CZ 2.66Å; E277-R307 IonicContact OE1-NE 2.91Å; E277-R307 PolarHBondContact OE1-NE 2.99Å; E277-R307 IonicContact OE1-NH2 2.69Å; E277-R307 IonicContact OE2-CZ 2.75Å; E277-R307 VanDerWaalsContact OE2-CZ 3.23Å; E277-R307 IonicContact OE2-NE 3.97Å; E277-R307 PolarHBondContact OE2-NE 3.38Å; E277-R307 VanDerWaalsContact OE2-NE 3.11Å; E277-R307 IonicContact OE2-NH2 2.72Å; E277-R307 PolarHBondContact OE2-NH2 3.25Å; Y289-R307 HydrophobicContact CE2-CG 4.15Å; T303-R307 PolarHBondContact O-N 3.44Å; L304-R307 PolarHBondContact O-N 2.86Å; L304-R307 VanDerWaalsContact O-N 3.15Å; R307-K309 PolarHBondContact O-N 2.98Å; R307-F310 VanDerWaalsContact NH1-CD1 3.3Å; R307-F310 WeakPolarHBondContact O-CB 3.38Å; R307-F310 PolarHBondContact O-N 2.66Å; R307-L311 HydrophobicContact CG-CD1 4.25Å; R307-L311 WeakPolarHBondContact O-CG 2.77Å; R307-L311 PolarHBondContact O-N 2.75Å
308	I	86.7	Confident	71.3	Confident	12 Å²	12	81.7 Å²	81.7	6%	0.062	45%	0.446	C	S	.	.	H	α-helix	trans	-57.5	-49.3	174.2	-69.7	160.7	0	0	0	110.3	I286 Y289 L290 L304 F310 L311 Q312	I286-I308 HydrophobicContact CG2-CG2 4.27Å; Y289-I308 HydrophobicContact CD2-CG1 4.47Å; L290-I308 HydrophobicContact CD2-CD1 3.96Å; L290-I308 HydrophobicContact CG-CD1 4.06Å; L304-I308 WeakPolarHBondContact O-CB 3.42Å; L304-I308 WeakPolarHBondContact O-CD1 3.4Å; L304-I308 VanDerWaalsContact O-CG1 3.28Å; L304-I308 WeakPolarHBondContact O-CG1 3.34Å; L304-I308 PolarHBondContact O-N 3.22Å; I308-F310 VanDerWaalsContact C-N 3.34Å; I308-F310 PolarHBondContact O-N 2.91Å; I308-L311 PolarHBondContact O-N 2.83Å; I308-Q312 HydrophobicContact CG2-CG 4.43Å; I308-Q312 WeakPolarHBondContact O-CB 3.48Å; I308-Q312 VanDerWaalsContact O-CG 3.27Å; I308-Q312 WeakPolarHBondContact O-CG 3.29Å; I308-Q312 PolarHBondContact O-N 2.84Å
309	K	84.9	Confident	69.9	Low	139 Å²	139	87.1 Å²	87.1	60%	0.604	47%	0.474	S	S	*	.	H	α-helix	trans	-61.3	-39.5	176	-76.6	-175	174.8	-171.8	0	113.1	A305 A306 R307 Q312 N313	A305-K309 WeakPolarHBondContact O-CG 3.38Å; A305-K309 PolarHBondContact O-N 2.75Å; A305-K309 VanDerWaalsContact O-N 3.15Å; A306-K309 PolarHBondContact O-N 2.78Å; R307-K309 PolarHBondContact O-N 2.98Å; K309-Q312 PolarHBondContact O-N 3.35Å; K309-N313 WeakPolarHBondContact O-CB 3.41Å; K309-N313 VanDerWaalsContact O-CG 3.27Å; K309-N313 PolarHBondContact O-N 3.2Å; K309-N313 PolarHBondContact O-OD1 2.93Å
310	F	86.4	Confident	68.6	Low	130 Å²	130	86.2 Å²	86.2	57%	0.57	48%	0.481	S	S	*	.	H	α-helix	trans	-62.2	-44.7	176.3	179	-89.7	0	0	0	112	A306 R307 I308 G314	A306-F310 WeakPolarHBondContact O-CB 3.47Å; A306-F310 PolarHBondContact O-N 2.85Å; R307-F310 VanDerWaalsContact NH1-CD1 3.3Å; R307-F310 WeakPolarHBondContact O-CB 3.38Å; R307-F310 PolarHBondContact O-N 2.66Å; I308-F310 VanDerWaalsContact C-N 3.34Å; I308-F310 PolarHBondContact O-N 2.91Å; F310-G314 PolarHBondContact O-N 3.29Å
311	L	81.8	Confident	67	Low	19 Å²	19	85.2 Å²	85.2	10%	0.099	49%	0.488	C	S	.	.	H	α-helix	trans	-68.5	-35.9	177.9	-67.1	172	0	0	0	112.7	E277 P282 A285 I286 Y289 R307 I308 S315	E277-L311 HydrophobicContact CG-CD1 4.07Å; E277-L311 HydrophobicContact CG-CD2 4.31Å; P282-L311 HydrophobicContact CB-CD2 4.33Å; A285-L311 HydrophobicContact CB-CD1 4.44Å; I286-L311 HydrophobicContact CD1-CB 3.85Å; I286-L311 HydrophobicContact CG1-CB 3.89Å; I286-L311 HydrophobicContact CG1-CD1 4.06Å; Y289-L311 HydrophobicContact CD2-CD1 4.14Å; Y289-L311 HydrophobicContact CE2-CD1 3.8Å; R307-L311 HydrophobicContact CG-CD1 4.25Å; R307-L311 WeakPolarHBondContact O-CG 2.77Å; R307-L311 PolarHBondContact O-N 2.75Å; I308-L311 PolarHBondContact O-N 2.83Å; L311-S315 PolarHBondContact O-N 3.04Å
312	Q	81.6	Confident	65.1	Low	90 Å²	90	91.2 Å²	91.2	42%	0.421	51%	0.512	S	S	.	.	H	α-helix	trans	-62.8	-57.5	173.9	-73.9	170.2	-31	0	0	110.8	I286 I308 K309 G314 S315	I286-Q312 HydrophobicContact CD1-CG 3.93Å; I308-Q312 HydrophobicContact CG2-CG 4.43Å; I308-Q312 WeakPolarHBondContact O-CB 3.48Å; I308-Q312 VanDerWaalsContact O-CG 3.27Å; I308-Q312 WeakPolarHBondContact O-CG 3.29Å; I308-Q312 PolarHBondContact O-N 2.84Å; K309-Q312 PolarHBondContact O-N 3.35Å; Q312-G314 PolarHBondContact O-N 2.95Å; Q312-S315 VanDerWaalsContact O-CB 3.31Å; Q312-S315 WeakPolarHBondContact O-CB 3.25Å; Q312-S315 PolarHBondContact O-N 3.45Å
313	N	77	Confident	62.7	Low	113 Å²	113	93 Å²	93	60%	0.604	53%	0.525	S	S	*	.	H	α-helix	trans	-60.7	-29.4	178.7	-66.1	18.3	0	0	0	112.8	K309 S315	K309-N313 WeakPolarHBondContact O-CB 3.41Å; K309-N313 VanDerWaalsContact O-CG 3.27Å; K309-N313 PolarHBondContact O-N 3.2Å; K309-N313 PolarHBondContact O-OD1 2.93Å; N313-S315 VanDerWaalsContact C-N 3.29Å; N313-S315 PolarHBondContact O-N 2.99Å
314	G	62.3	Low	60.2	Low	35 Å²	35	94.6 Å²	94.6	36%	0.361	53%	0.529	S	S	.	.	H	α-helix	trans	-67.6	-26.1	174.2	0	0	0	0	0	113.7	F310 Q312 W318	F310-G314 PolarHBondContact O-N 3.29Å; Q312-G314 PolarHBondContact O-N 2.95Å; G314-W318 VanDerWaalsContact O-CD1 3.32Å
315	S	53.8	Low	57.9	Low	42 Å²	42	99.9 Å²	99.9	29%	0.294	57%	0.566	S	S	.	*	H	α-helix	trans	-75.5	-22.5	-178.1	-163.9	0	0	0	0	113.6	L311 Q312 N313	L311-S315 PolarHBondContact O-N 3.04Å; Q312-S315 VanDerWaalsContact O-CB 3.31Å; Q312-S315 WeakPolarHBondContact O-CB 3.25Å; Q312-S315 PolarHBondContact O-N 3.45Å; N313-S315 VanDerWaalsContact C-N 3.29Å; N313-S315 PolarHBondContact O-N 2.99Å
316	D	46.3	Very low	55.4	Low	114 Å²	114	103.3 Å²	103.3	61%	0.61	57%	0.574	S	S	*	*	H	α-helix	trans	-80.5	-35.8	-174.7	-63.5	-39.3	0	0	0	112.5	W318	D316-W318 VanDerWaalsContact C-N 3.28Å; D316-W318 PolarHBondContact O-N 2.93Å
317	N	40.8	Very low	53	Low	150 Å²	150	108.3 Å²	108.3	80%	0.802	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.6	-10	-178.2	-93.7	-14	0	0	0	114.8
318	W	40.2	Very low	50.7	Low	221 Å²	221	107.5 Å²	107.5	84%	0.837	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.9	-5.6	-179.9	-81.6	74.9	0	0	0	114.2	G314 D316 G320	G314-W318 VanDerWaalsContact O-CD1 3.32Å; D316-W318 VanDerWaalsContact C-N 3.28Å; D316-W318 PolarHBondContact O-N 2.93Å; W318-G320 PolarHBondContact O-N 2.8Å; W318-G320 VanDerWaalsContact O-N 3.16Å
319	N	36.4	Very low	47.9	Very low	137 Å²	137	111.4 Å²	111.4	73%	0.733	62%	0.618	S	S	*	*			trans	-80	12	-179.4	-66.1	-50.1	0	0	0	114.2	G321	N319-G321 PolarHBondContact O-N 2.89Å
320	G	35	Very low	45.6	Very low	82 Å²	82	112.8 Å²	112.8	85%	0.845	63%	0.627	S	S	*	*	S	Bend	trans	-88.1	31.7	-173.4	0	0	0	0	0	116.6	W318	W318-G320 PolarHBondContact O-N 2.8Å; W318-G320 VanDerWaalsContact O-N 3.16Å
321	G	34.2	Very low	43	Very low	56 Å²	56	111 Å²	111	58%	0.577	62%	0.621	S	S	*	*	S	Bend	trans	136.5	145.3	174.3	0	0	0	0	0	114.5	N319	N319-G321 PolarHBondContact O-N 2.89Å
322	Q	34.6	Very low	40.8	Very low	183 Å²	183	116.1 Å²	116.1	86%	0.855	65%	0.652	S	S	*	*			trans	58.6	74.1	-175.6	-60.7	-170.1	2.3	0	0	115.6	L324	Q322-L324 VanDerWaalsContact C-N 3.28Å; Q322-L324 PolarHBondContact O-N 2.91Å
323	S	25	Very low	38.6	Very low	131 Å²	131	120.5 Å²	120.5	92%	0.916	67%	0.666	S	S	*	*			trans	-77.8	76.7	163.3	-166.5	0	0	0	0	111.1
324	L	28.4	Very low	36.9	Very low	124 Å²	124	117.8 Å²	117.8	65%	0.649	66%	0.656	S	S	*	*			trans	-79.1	127.8	160.6	-104	80.2	0	0	0	109	Q322 H326	Q322-L324 VanDerWaalsContact C-N 3.28Å; Q322-L324 PolarHBondContact O-N 2.91Å; L324-H326 PolarHBondContact O-N 3.31Å; L324-H326 VanDerWaalsContact O-N 3.13Å
325	S	32.1	Very low	36	Very low	114 Å²	114	121.8 Å²	121.8	80%	0.797	67%	0.669	S	S	*	*			trans	-73.1	103.4	-177.3	45.4	0	0	0	0	112.8
326	H	28.7	Very low	35.9	Very low	120 Å²	120	124 Å²	124	56%	0.556	68%	0.683	S	S	*	*			trans	-126.7	117.9	174.6	-80.7	-72.6	0	0	0	113	L324 P328 Q331	L324-H326 PolarHBondContact O-N 3.31Å; L324-H326 VanDerWaalsContact O-N 3.13Å; H326-P328 WeakPolarHBondContact O-CD 3.2Å; H326-Q331 PolarHBondContact ND1-OE1 3.01Å
327	H	33.1	Very low	36	Very low	166 Å²	166	119.4 Å²	119.4	77%	0.769	66%	0.658	S	S	*	*			trans	-95.3	104.7	162.4	-76.1	-83	0	0	0	109.2	V329	H327-V329 PolarHBondContact O-N 3.1Å
328	P	35.1	Very low	37	Very low	79 Å²	79	115.1 Å²	115.1	51%	0.513	64%	0.638	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.8	60.1	-171.9	36.9	-36.8	0	0	0	113.5	Q281 H326	Q281-P328 HydrophobicContact CG-CG 4.48Å; Q281-P328 PolarHBondContact NE2-O 3.18Å; H326-P328 WeakPolarHBondContact O-CD 3.2Å
329	V	29.2	Very low	37.5	Very low	95 Å²	95	109.8 Å²	109.8	58%	0.576	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133	-41.8	160.1	-175.1	0	0	0	0	111.4	H327	H327-V329 PolarHBondContact O-N 3.1Å
330	Q	35.5	Very low	38.2	Very low	167 Å²	167	110.6 Å²	110.6	78%	0.78	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	-15.2	179.9	-75.9	-176.3	-29.6	0	0	114.6
331	Q	31.6	Very low	39.5	Very low	94 Å²	94	110.5 Å²	110.5	44%	0.439	61%	0.607	S	S	.	*	S	Bend	trans	-88.7	-21.2	-165.8	-118.6	167.4	-9.2	0	0	115.9	H326 Y333 S334	H326-Q331 PolarHBondContact ND1-OE1 3.01Å; Q331-Y333 PolarHBondContact O-N 3.12Å; Q331-S334 VanDerWaalsContact O-CB 3.3Å; Q331-S334 WeakPolarHBondContact O-CB 3.49Å; Q331-S334 PolarHBondContact O-N 3.26Å; Q331-S334 VanDerWaalsContact O-N 3.12Å
332	V	35.7	Very low	41	Very low	125 Å²	125	110.6 Å²	110.6	76%	0.758	59%	0.594	S	S	*	*	G	3₁₀ helix	trans	-64.9	-32.5	173.2	-178.6	0	0	0	0	111.1	S334 L335	V332-S334 PolarHBondContact O-N 2.91Å; V332-L335 PolarHBondContact O-N 3.38Å
333	Y	36.2	Very low	42.5	Very low	182 Å²	182	108.2 Å²	108.2	71%	0.714	58%	0.583	S	S	*	*	G	3₁₀ helix	trans	-62.9	-3.9	172.9	-71.5	-81.3	0	0	0	114.9	Q331	Q331-Y333 PolarHBondContact O-N 3.12Å
334	S	40.4	Very low	44.6	Very low	57 Å²	57	106.3 Å²	106.3	40%	0.399	56%	0.559	S	S	.	*	G	3₁₀ helix	trans	-97.6	-15.4	-175.7	-153	0	0	0	0	114.8	Q331 V332	Q331-S334 VanDerWaalsContact O-CB 3.3Å; Q331-S334 WeakPolarHBondContact O-CB 3.49Å; Q331-S334 PolarHBondContact O-N 3.26Å; Q331-S334 VanDerWaalsContact O-N 3.12Å; V332-S334 PolarHBondContact O-N 2.91Å
335	L	43.8	Very low	46.9	Very low	119 Å²	119	100.4 Å²	100.4	62%	0.623	53%	0.528	S	S	*	.	S	Bend	trans	-93	-15.9	-176.2	-85.8	162.1	0	0	0	114.7	V332 L372	V332-L335 PolarHBondContact O-N 3.38Å; L335-L372 HydrophobicContact CD2-CD2 4.19Å
336	C	51.4	Low	49	Very low	88 Å²	88	100.3 Å²	100.3	60%	0.595	52%	0.515	S	S	*	.	S	Bend	trans	-94.7	123.9	165.6	-77.7	0	0	0	0	110.2	T338	C336-T338 PolarHBondContact O-N 3.09Å
337	L	49.3	Very low	51.4	Low	18 Å²	18	100.7 Å²	100.7	9%	0.094	52%	0.517	C	S	.	.	P	Polyproline II helix	trans	-65.4	119.5	163.4	-68	169.5	0	0	0	108.4	K341 L345 L366 Q369 F370 M373	L337-K341 HydrophobicContact CB-CB 4.3Å; L337-K341 HydrophobicContact CD2-CB 3.94Å; L337-K341 HydrophobicContact CD2-CD 3.82Å; L337-L345 HydrophobicContact CD1-CD2 4.48Å; L337-L366 HydrophobicContact CD2-CD2 3.89Å; L337-Q369 HydrophobicContact CD2-CB 4.17Å; L337-Q369 HydrophobicContact CG-CB 4.49Å; L337-F370 HydrophobicContact CD1-CB 3.72Å; L337-F370 HydrophobicContact CD1-CD2 3.96Å; L337-F370 HydrophobicContact CD1-CG 4.35Å; L337-M373 HydrophobicContact CB-CE 3.72Å; L337-M373 HydrophobicContact CD1-CE 4.02Å; L337-M373 HydrophobicContact CG-CE 4.03Å
338	T	60.7	Low	53.6	Low	60 Å²	60	93.2 Å²	93.2	37%	0.368	48%	0.483	S	S	.	.	P	Polyproline II helix	trans	-63.1	157.4	173	60.9	0	0	0	0	110.4	C336 Q340 K341 L342	C336-T338 PolarHBondContact O-N 3.09Å; T338-Q340 PolarHBondContact O-N 2.91Å; T338-Q340 VanDerWaalsContact O-N 3.1Å; T338-K341 PolarHBondContact O-N 2.99Å; T338-K341 PolarHBondContact OG1-N 3.01Å; T338-L342 PolarHBondContact O-N 2.96Å
339	P	52.1	Low	55.9	Low	108 Å²	108	93.7 Å²	93.7	70%	0.701	48%	0.475	S	S	*	.	H	α-helix	trans	-52.6	-35.6	176.7	-28.3	35.9	0	0	0	113.1	L342 Q343	P339-L342 PolarHBondContact O-N 3.25Å; P339-Q343 WeakPolarHBondContact O-CB 3.45Å; P339-Q343 PolarHBondContact O-N 3.35Å
340	Q	50.4	Low	58.1	Low	154 Å²	154	93.5 Å²	93.5	72%	0.72	48%	0.483	S	S	*	.	H	α-helix	trans	-64.9	-42.7	174.5	-66.2	166.5	-18.4	0	0	112.9	T338 L342 H344	T338-Q340 PolarHBondContact O-N 2.91Å; T338-Q340 VanDerWaalsContact O-N 3.1Å; Q340-L342 VanDerWaalsContact C-N 3.32Å; Q340-H344 VanDerWaalsContact O-CB 3.31Å; Q340-H344 WeakPolarHBondContact O-CB 3.47Å; Q340-H344 PolarHBondContact O-N 3.19Å
341	K	62.8	Low	60.3	Low	81 Å²	81	89.4 Å²	89.4	35%	0.352	47%	0.467	S	S	.	.	H	α-helix	trans	-67.7	-33.4	174	-75.5	-173.5	177.6	-177.7	0	112	L337 T338 L345	L337-K341 HydrophobicContact CB-CB 4.3Å; L337-K341 HydrophobicContact CD2-CB 3.94Å; L337-K341 HydrophobicContact CD2-CD 3.82Å; T338-K341 PolarHBondContact O-N 2.99Å; T338-K341 PolarHBondContact OG1-N 3.01Å; K341-L345 WeakPolarHBondContact O-CB 3.45Å; K341-L345 PolarHBondContact O-N 3.3Å
342	L	64.1	Low	62.5	Low	58 Å²	58	91.5 Å²	91.5	30%	0.304	47%	0.471	S	S	.	.	H	α-helix	trans	-67.6	-47.9	176.6	-164.3	72.3	0	0	0	111	T338 P339 Q340 H344 L345 E346 F370	T338-L342 PolarHBondContact O-N 2.96Å; P339-L342 PolarHBondContact O-N 3.25Å; Q340-L342 VanDerWaalsContact C-N 3.32Å; L342-H344 VanDerWaalsContact C-N 3.31Å; L342-H344 PolarHBondContact O-N 2.83Å; L342-L345 WeakPolarHBondContact O-CB 3.48Å; L342-L345 PolarHBondContact O-N 2.96Å; L342-E346 WeakPolarHBondContact O-CG 3.32Å; L342-E346 PolarHBondContact O-N 3.49Å; L342-F370 HydrophobicContact CD1-CD2 3.76Å; L342-F370 HydrophobicContact CD1-CE2 3.62Å
343	Q	65.9	Low	64.4	Low	133 Å²	133	92.2 Å²	92.2	62%	0.621	47%	0.47	S	S	*	.	H	α-helix	trans	-60.3	-39.2	174.2	-170.9	177.1	18.8	0	0	112	P339 E346 Q347	P339-Q343 WeakPolarHBondContact O-CB 3.45Å; P339-Q343 PolarHBondContact O-N 3.35Å; Q343-E346 PolarHBondContact O-N 3.17Å; Q343-Q347 WeakPolarHBondContact O-CB 3.4Å; Q343-Q347 PolarHBondContact O-N 3.27Å
344	H	69.8	Low	66.5	Low	90 Å²	90	89.8 Å²	89.8	42%	0.417	47%	0.47	S	S	.	.	H	α-helix	trans	-68.6	-37	175.3	-168.9	72.5	0	0	0	112.7	Q340 L342 Q347 L348	Q340-H344 VanDerWaalsContact O-CB 3.31Å; Q340-H344 WeakPolarHBondContact O-CB 3.47Å; Q340-H344 PolarHBondContact O-N 3.19Å; L342-H344 VanDerWaalsContact C-N 3.31Å; L342-H344 PolarHBondContact O-N 2.83Å; H344-Q347 PolarHBondContact CE1-OE1 2.88Å; H344-Q347 PolarHBondContact O-N 3.21Å; H344-L348 WeakPolarHBondContact O-CG 3.4Å; H344-L348 PolarHBondContact O-N 3.45Å
345	L	78	Confident	68.6	Low	0 Å²	0	87.6 Å²	87.6	0%	0	45%	0.453	C	S	.	.	H	α-helix	trans	-63.1	-44.1	172.4	168.1	59.5	0	0	0	111.4	L337 K341 L342 L348 R349 L363 L366 E367 F370	L337-L345 HydrophobicContact CD1-CD2 4.48Å; K341-L345 WeakPolarHBondContact O-CB 3.45Å; K341-L345 PolarHBondContact O-N 3.3Å; L342-L345 WeakPolarHBondContact O-CB 3.48Å; L342-L345 PolarHBondContact O-N 2.96Å; L345-L348 PolarHBondContact O-N 2.86Å; L345-R349 HydrophobicContact CD1-CG 4.26Å; L345-R349 WeakPolarHBondContact O-CB 3.37Å; L345-R349 WeakPolarHBondContact O-CG 3.18Å; L345-R349 PolarHBondContact O-N 2.62Å; L345-L363 HydrophobicContact CD1-CD1 3.64Å; L345-L366 HydrophobicContact CB-CB 4.4Å; L345-L366 HydrophobicContact CD1-CB 3.98Å; L345-E367 HydrophobicContact CD1-CG 3.62Å; L345-F370 HydrophobicContact CD2-CB 3.75Å; L345-F370 HydrophobicContact CD2-CD2 4.09Å; L345-F370 HydrophobicContact CD2-CG 3.91Å
346	E	75.3	Confident	70.4	Confident	112 Å²	112	85.7 Å²	85.7	52%	0.523	44%	0.443	S	S	.	.	H	α-helix	trans	-63.3	-40.7	174.5	-70.5	174.2	166.2	0	0	111.9	L342 Q343 R349 A350	L342-E346 WeakPolarHBondContact O-CG 3.32Å; L342-E346 PolarHBondContact O-N 3.49Å; Q343-E346 PolarHBondContact O-N 3.17Å; E346-R349 PolarHBondContact O-N 2.81Å; E346-A350 WeakPolarHBondContact O-CB 3.42Å; E346-A350 PolarHBondContact O-N 3.45Å
347	Q	78.2	Confident	71.6	Confident	128 Å²	128	87 Å²	87	60%	0.598	45%	0.451	S	S	*	.	H	α-helix	trans	-65.5	-37.2	176.7	-168.9	175.9	14	0	0	112.9	Q343 H344	Q343-Q347 WeakPolarHBondContact O-CB 3.4Å; Q343-Q347 PolarHBondContact O-N 3.27Å; H344-Q347 PolarHBondContact CE1-OE1 2.88Å; H344-Q347 PolarHBondContact O-N 3.21Å
348	L	79.2	Confident	72.5	Confident	9 Å²	9	89.4 Å²	89.4	5%	0.047	47%	0.473	C	S	.	.	H	α-helix	trans	-70.3	-41.4	173.2	-72.9	172.8	0	0	0	111.7	H344 L345 A350 N351 R352 L355 Q359 Q362 L363 L366	H344-L348 WeakPolarHBondContact O-CG 3.4Å; H344-L348 PolarHBondContact O-N 3.45Å; L345-L348 PolarHBondContact O-N 2.86Å; L348-A350 VanDerWaalsContact C-N 3.32Å; L348-A350 PolarHBondContact O-N 3.38Å; L348-N351 PolarHBondContact O-N 2.83Å; L348-R352 PolarHBondContact O-N 3.45Å; L348-L355 HydrophobicContact CB-CD1 4.29Å; L348-L355 HydrophobicContact CD2-CD1 4.09Å; L348-L355 HydrophobicContact CD2-CD2 3.81Å; L348-Q359 HydrophobicContact CD2-CB 4.43Å; L348-Q362 HydrophobicContact CD1-CG 4.39Å; L348-L363 HydrophobicContact CB-CB 4.38Å; L348-L363 HydrophobicContact CB-CD1 3.97Å; L348-L363 HydrophobicContact CD1-CB 4.43Å; L348-L366 HydrophobicContact CD1-CD1 4.09Å
349	R	83.8	Confident	72.9	Confident	89 Å²	89	89.9 Å²	89.9	34%	0.336	47%	0.471	S	S	.	.	H	α-helix	trans	-58.6	-42.5	173.8	-77.3	172.8	167.8	157.5	-0.6	112.3	L345 E346 N351 R352 L363 E367	L345-R349 HydrophobicContact CD1-CG 4.26Å; L345-R349 WeakPolarHBondContact O-CB 3.37Å; L345-R349 WeakPolarHBondContact O-CG 3.18Å; L345-R349 PolarHBondContact O-N 2.62Å; E346-R349 PolarHBondContact O-N 2.81Å; R349-N351 PolarHBondContact O-N 3.41Å; R349-R352 PolarHBondContact O-N 3.48Å; R349-L363 HydrophobicContact CG-CD1 3.87Å; R349-E367 IonicContact CZ-OE1 2.69Å; R349-E367 IonicContact NE-OE1 2.72Å; R349-E367 PolarHBondContact NE-OE1 3.23Å; R349-E367 IonicContact NH2-OE1 3.07Å; R349-E367 PolarHBondContact NH2-OE1 3.28Å
350	A	76.3	Confident	74.2	Confident	92 Å²	92	88.9 Å²	88.9	76%	0.76	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-13.4	-178.9	0	0	0	0	0	114.5	E346 L348	E346-A350 WeakPolarHBondContact O-CB 3.42Å; E346-A350 PolarHBondContact O-N 3.45Å; L348-A350 VanDerWaalsContact C-N 3.32Å; L348-A350 PolarHBondContact O-N 3.38Å
351	N	81.9	Confident	75.5	Confident	80 Å²	80	87.3 Å²	87.3	43%	0.428	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.9	22.2	-179.2	-159.4	18.7	0	0	0	112.9	L348 R349 D353 N354 L355	L348-N351 PolarHBondContact O-N 2.83Å; R349-N351 PolarHBondContact O-N 3.41Å; N351-D353 VanDerWaalsContact C-N 3.26Å; N351-D353 PolarHBondContact O-N 3.13Å; N351-D353 VanDerWaalsContact O-N 3.07Å; N351-N354 PolarHBondContact O-N 2.94Å; N351-N354 VanDerWaalsContact O-N 3.1Å; N351-N354 WeakPolarHBondContact OD1-CB 3.47Å; N351-N354 PolarHBondContact OD1-ND2 3.32Å; N351-L355 HydrophobicContact CB-CD2 4.41Å; N351-L355 WeakPolarHBondContact O-CG 3.48Å; N351-L355 PolarHBondContact O-N 3.19Å
352	R	77.1	Confident	76	Confident	139 Å²	139	87.2 Å²	87.2	53%	0.525	45%	0.449	S	S	.	.	G	3₁₀ helix	trans	-46.8	-41.7	-167.9	-174.7	177.5	-172.7	155.3	8.1	114.8	L348 R349 L355 K360 L363	L348-R352 PolarHBondContact O-N 3.45Å; R349-R352 PolarHBondContact O-N 3.48Å; R352-L355 PolarHBondContact O-N 2.92Å; R352-K360 WeakPolarHBondContact O-CE 3.3Å; R352-L363 HydrophobicContact CG-CD2 4.09Å
353	D	75.1	Confident	76.8	Confident	140 Å²	140	84.6 Å²	84.6	75%	0.749	44%	0.436	S	S	*	.	G	3₁₀ helix	trans	-71.5	-35.4	-172.9	-56.8	-48.1	0	0	0	112.2	N351 K360	N351-D353 VanDerWaalsContact C-N 3.26Å; N351-D353 PolarHBondContact O-N 3.13Å; N351-D353 VanDerWaalsContact O-N 3.07Å; D353-K360 PolarHBondContact O-NZ 2.83Å
354	N	80.8	Confident	77.6	Confident	131 Å²	131	84 Å²	84	70%	0.701	43%	0.433	S	S	*	.	G	3₁₀ helix	trans	-87.4	-0.2	-179.1	-58.3	-54.4	0	0	0	114.1	N351	N351-N354 PolarHBondContact O-N 2.94Å; N351-N354 VanDerWaalsContact O-N 3.1Å; N351-N354 WeakPolarHBondContact OD1-CB 3.47Å; N351-N354 PolarHBondContact OD1-ND2 3.32Å
355	L	84.4	Confident	77.8	Confident	11 Å²	11	85.1 Å²	85.1	6%	0.058	44%	0.438	C	S	.	.			trans	-69.4	138.1	-178.6	-62.5	-174	0	0	0	112.2	L348 N351 R352 Q359 K360 L363	L348-L355 HydrophobicContact CB-CD1 4.29Å; L348-L355 HydrophobicContact CD2-CD1 4.09Å; L348-L355 HydrophobicContact CD2-CD2 3.81Å; N351-L355 HydrophobicContact CB-CD2 4.41Å; N351-L355 WeakPolarHBondContact O-CG 3.48Å; N351-L355 PolarHBondContact O-N 3.19Å; R352-L355 PolarHBondContact O-N 2.92Å; L355-Q359 HydrophobicContact CB-CB 3.91Å; L355-Q359 HydrophobicContact CD1-CB 4.38Å; L355-Q359 HydrophobicContact CD2-CB 4.15Å; L355-Q359 HydrophobicContact CG-CB 4.36Å; L355-K360 HydrophobicContact CB-CD 4.37Å; L355-K360 HydrophobicContact CB-CG 3.64Å; L355-K360 HydrophobicContact CD1-CG 4.42Å; L355-K360 WeakPolarHBondContact O-CE 3.44Å; L355-K360 PolarHBondContact O-NZ 3.34Å; L355-L363 HydrophobicContact CD1-CB 4.25Å; L355-L363 HydrophobicContact CD1-CD2 3.79Å
356	N	82.3	Confident	77.6	Confident	78 Å²	78	85.9 Å²	85.9	42%	0.417	44%	0.442	S	S	.	.			trans	-72	166.4	171.4	77.7	39.1	0	0	0	111.5	A358 Q359 K360	N356-A358 VanDerWaalsContact C-N 3.32Å; N356-A358 PolarHBondContact O-N 3.1Å; N356-A358 PolarHBondContact OD1-N 2.9Å; N356-A358 VanDerWaalsContact OD1-N 3.1Å; N356-Q359 VanDerWaalsContact CG-OE1 3.32Å; N356-Q359 PolarHBondContact ND2-OE1 3Å; N356-Q359 WeakPolarHBondContact O-CB 3.39Å; N356-Q359 PolarHBondContact O-N 2.83Å; N356-Q359 VanDerWaalsContact O-N 3.09Å; N356-Q359 WeakPolarHBondContact OD1-CG 3.42Å; N356-Q359 PolarHBondContact OD1-N 2.81Å; N356-K360 PolarHBondContact O-N 2.88Å
357	P	76.8	Confident	77.8	Confident	115 Å²	115	82.5 Å²	82.5	75%	0.747	43%	0.427	S	S	*	.	H	α-helix	trans	-57.9	-38	-174.6	-27.7	36.4	0	0	0	114.7	K360 H361	P357-K360 PolarHBondContact O-N 3.18Å; P357-H361 PolarHBondContact O-N 3.24Å
358	A	66.4	Low	77.4	Confident	69 Å²	69	80.2 Å²	80.2	57%	0.57	42%	0.424	S	S	*	.	H	α-helix	trans	-69.2	-38.3	177.2	0	0	0	0	0	111.9	N356 H361 Q362	N356-A358 VanDerWaalsContact C-N 3.32Å; N356-A358 PolarHBondContact O-N 3.1Å; N356-A358 PolarHBondContact OD1-N 2.9Å; N356-A358 VanDerWaalsContact OD1-N 3.1Å; A358-H361 PolarHBondContact O-N 2.8Å; A358-Q362 WeakPolarHBondContact O-CB 3.29Å; A358-Q362 PolarHBondContact O-N 2.74Å
359	Q	70.3	Confident	76.8	Confident	70 Å²	70	82.8 Å²	82.8	33%	0.327	44%	0.436	S	S	.	.	H	α-helix	trans	-68.2	-33.2	173.8	-71	170	-32.8	0	0	112.5	L348 L355 N356 Q362 L363	L348-Q359 HydrophobicContact CD2-CB 4.43Å; L355-Q359 HydrophobicContact CB-CB 3.91Å; L355-Q359 HydrophobicContact CD1-CB 4.38Å; L355-Q359 HydrophobicContact CD2-CB 4.15Å; L355-Q359 HydrophobicContact CG-CB 4.36Å; N356-Q359 VanDerWaalsContact CG-OE1 3.32Å; N356-Q359 PolarHBondContact ND2-OE1 3Å; N356-Q359 WeakPolarHBondContact O-CB 3.39Å; N356-Q359 PolarHBondContact O-N 2.83Å; N356-Q359 VanDerWaalsContact O-N 3.09Å; N356-Q359 WeakPolarHBondContact OD1-CG 3.42Å; N356-Q359 PolarHBondContact OD1-N 2.81Å; Q359-Q362 PolarHBondContact O-N 3.18Å; Q359-L363 WeakPolarHBondContact O-CB 3.45Å; Q359-L363 PolarHBondContact O-N 3.4Å
360	K	79.6	Confident	76.4	Confident	88 Å²	88	80.3 Å²	80.3	38%	0.383	43%	0.428	S	S	.	.	H	α-helix	trans	-67.1	-45.2	173.2	-73	-179	172.5	163.3	0	111.2	R352 D353 L355 N356 P357 Q362 L363 E364	R352-K360 WeakPolarHBondContact O-CE 3.3Å; D353-K360 PolarHBondContact O-NZ 2.83Å; L355-K360 HydrophobicContact CB-CD 4.37Å; L355-K360 HydrophobicContact CB-CG 3.64Å; L355-K360 HydrophobicContact CD1-CG 4.42Å; L355-K360 WeakPolarHBondContact O-CE 3.44Å; L355-K360 PolarHBondContact O-NZ 3.34Å; N356-K360 PolarHBondContact O-N 2.88Å; P357-K360 PolarHBondContact O-N 3.18Å; K360-Q362 VanDerWaalsContact C-N 3.33Å; K360-Q362 PolarHBondContact O-N 2.93Å; K360-L363 WeakPolarHBondContact O-CB 3.33Å; K360-L363 PolarHBondContact O-N 2.96Å; K360-E364 WeakPolarHBondContact O-CG 3.3Å; K360-E364 PolarHBondContact O-N 3.13Å
361	H	76.7	Confident	76.3	Confident	121 Å²	121	79.1 Å²	79.1	56%	0.56	41%	0.411	S	S	*	.	H	α-helix	trans	-61.8	-38.8	172	-173.1	-64.3	0	0	0	112.4	P357 A358 E364 Q365	P357-H361 PolarHBondContact O-N 3.24Å; A358-H361 PolarHBondContact O-N 2.8Å; H361-E364 PolarHBondContact O-N 2.92Å; H361-Q365 WeakPolarHBondContact O-CB 3.47Å; H361-Q365 PolarHBondContact O-N 3.02Å
362	Q	73.6	Confident	75.4	Confident	78 Å²	78	79.6 Å²	79.6	36%	0.364	41%	0.413	S	S	.	.	H	α-helix	trans	-67.3	-36.9	175.8	-172.3	-179.9	-11.1	0	0	112.2	L348 A358 Q359 K360 L366	L348-Q362 HydrophobicContact CD1-CG 4.39Å; A358-Q362 WeakPolarHBondContact O-CB 3.29Å; A358-Q362 PolarHBondContact O-N 2.74Å; Q359-Q362 PolarHBondContact O-N 3.18Å; K360-Q362 VanDerWaalsContact C-N 3.33Å; K360-Q362 PolarHBondContact O-N 2.93Å; Q362-L366 HydrophobicContact CG-CD1 4.25Å; Q362-L366 WeakPolarHBondContact O-CB 3.38Å; Q362-L366 WeakPolarHBondContact O-CG 3Å; Q362-L366 PolarHBondContact O-N 2.97Å
363	L	82.1	Confident	75	Confident	4 Å²	4	74.3 Å²	74.3	2%	0.021	40%	0.395	C	S	.	.	H	α-helix	trans	-62.8	-52.9	171.7	173.5	60	0	0	0	110.5	L345 L348 R349 R352 L355 Q359 K360 Q365 L366 E367	L345-L363 HydrophobicContact CD1-CD1 3.64Å; L348-L363 HydrophobicContact CB-CB 4.38Å; L348-L363 HydrophobicContact CB-CD1 3.97Å; L348-L363 HydrophobicContact CD1-CB 4.43Å; R349-L363 HydrophobicContact CG-CD1 3.87Å; R352-L363 HydrophobicContact CG-CD2 4.09Å; L355-L363 HydrophobicContact CD1-CB 4.25Å; L355-L363 HydrophobicContact CD1-CD2 3.79Å; Q359-L363 WeakPolarHBondContact O-CB 3.45Å; Q359-L363 PolarHBondContact O-N 3.4Å; K360-L363 WeakPolarHBondContact O-CB 3.33Å; K360-L363 PolarHBondContact O-N 2.96Å; L363-Q365 VanDerWaalsContact C-N 3.28Å; L363-Q365 PolarHBondContact O-N 3.31Å; L363-L366 PolarHBondContact O-N 3.46Å; L363-L366 VanDerWaalsContact O-N 3.12Å; L363-E367 HydrophobicContact CD1-CG 3.83Å; L363-E367 HydrophobicContact CG-CG 4.37Å; L363-E367 WeakPolarHBondContact O-CG 3.44Å; L363-E367 PolarHBondContact O-N 2.77Å
364	E	80.8	Confident	74.3	Confident	119 Å²	119	71.4 Å²	71.4	56%	0.556	38%	0.377	S	S	*	.	H	α-helix	trans	-57.7	-39	178.4	-71.8	176.2	148.2	0	0	112.6	K360 H361 S368	K360-E364 WeakPolarHBondContact O-CG 3.3Å; K360-E364 PolarHBondContact O-N 3.13Å; H361-E364 PolarHBondContact O-N 2.92Å; E364-S368 VanDerWaalsContact O-CB 3.31Å; E364-S368 WeakPolarHBondContact O-CB 3.44Å; E364-S368 PolarHBondContact O-N 3.11Å; E364-S368 PolarHBondContact O-OG 3.38Å
365	Q	74	Confident	73	Confident	114 Å²	114	70.7 Å²	70.7	53%	0.533	37%	0.369	S	S	.	.	H	α-helix	trans	-66.6	-41.8	176.3	-169	176.9	24.3	0	0	112.3	H361 L363 S368 Q369	H361-Q365 WeakPolarHBondContact O-CB 3.47Å; H361-Q365 PolarHBondContact O-N 3.02Å; L363-Q365 VanDerWaalsContact C-N 3.28Å; L363-Q365 PolarHBondContact O-N 3.31Å; Q365-S368 PolarHBondContact O-N 3.2Å; Q365-Q369 PolarHBondContact O-N 2.67Å
366	L	75.1	Confident	71.6	Confident	16 Å²	16	75.4 Å²	75.4	8%	0.084	39%	0.392	C	S	.	.	H	α-helix	trans	-72	-35.6	176.5	-73.6	168.9	0	0	0	112.4	L337 L345 L348 Q362 L363 Q369 F370	L337-L366 HydrophobicContact CD2-CD2 3.89Å; L345-L366 HydrophobicContact CB-CB 4.4Å; L345-L366 HydrophobicContact CD1-CB 3.98Å; L348-L366 HydrophobicContact CD1-CD1 4.09Å; Q362-L366 HydrophobicContact CG-CD1 4.25Å; Q362-L366 WeakPolarHBondContact O-CB 3.38Å; Q362-L366 WeakPolarHBondContact O-CG 3Å; Q362-L366 PolarHBondContact O-N 2.97Å; L363-L366 PolarHBondContact O-N 3.46Å; L363-L366 VanDerWaalsContact O-N 3.12Å; L366-Q369 PolarHBondContact O-N 3.25Å; L366-F370 WeakPolarHBondContact O-CB 3.44Å; L366-F370 PolarHBondContact O-N 3.09Å
367	E	79.3	Confident	69.9	Low	42 Å²	42	78.7 Å²	78.7	20%	0.196	40%	0.399	C	S	.	.	H	α-helix	trans	-65.1	-41	172.3	-69.7	-158.2	118.4	0	0	111.3	L345 R349 L363 F370 V371	L345-E367 HydrophobicContact CD1-CG 3.62Å; R349-E367 IonicContact CZ-OE1 2.69Å; R349-E367 IonicContact NE-OE1 2.72Å; R349-E367 PolarHBondContact NE-OE1 3.23Å; R349-E367 IonicContact NH2-OE1 3.07Å; R349-E367 PolarHBondContact NH2-OE1 3.28Å; L363-E367 HydrophobicContact CD1-CG 3.83Å; L363-E367 HydrophobicContact CG-CG 4.37Å; L363-E367 WeakPolarHBondContact O-CG 3.44Å; L363-E367 PolarHBondContact O-N 2.77Å; E367-F370 PolarHBondContact O-N 3.42Å; E367-V371 WeakPolarHBondContact O-CG2 3.38Å; E367-V371 PolarHBondContact O-N 3.03Å
368	S	69.7	Low	68.4	Low	79 Å²	79	79.3 Å²	79.3	55%	0.552	39%	0.392	S	S	*	.	H	α-helix	trans	-61.3	-44.4	174.3	-60.1	0	0	0	0	112.1	E364 Q365 L372	E364-S368 VanDerWaalsContact O-CB 3.31Å; E364-S368 WeakPolarHBondContact O-CB 3.44Å; E364-S368 PolarHBondContact O-N 3.11Å; E364-S368 PolarHBondContact O-OG 3.38Å; Q365-S368 PolarHBondContact O-N 3.2Å; S368-L372 WeakPolarHBondContact O-CB 3.39Å; S368-L372 PolarHBondContact O-N 3.22Å
369	Q	66.3	Low	67.3	Low	64 Å²	64	83.2 Å²	83.2	30%	0.299	40%	0.396	S	S	.	.	H	α-helix	trans	-64.7	-38.4	173.9	-72.3	-160.4	-44.8	0	0	112.5	L337 Q365 L366 L372 M373	L337-Q369 HydrophobicContact CD2-CB 4.17Å; L337-Q369 HydrophobicContact CG-CB 4.49Å; Q365-Q369 PolarHBondContact O-N 2.67Å; L366-Q369 PolarHBondContact O-N 3.25Å; Q369-L372 PolarHBondContact O-N 2.9Å; Q369-M373 WeakPolarHBondContact O-CB 3.34Å; Q369-M373 PolarHBondContact O-N 2.83Å
370	F	75.9	Confident	65.9	Low	37 Å²	37	85.8 Å²	85.8	16%	0.162	41%	0.408	C	S	.	.	H	α-helix	trans	-65.9	-44.2	178.2	-178	-101.8	0	0	0	112	L337 L342 L345 L366 E367 M373 Q374	L337-F370 HydrophobicContact CD1-CB 3.72Å; L337-F370 HydrophobicContact CD1-CD2 3.96Å; L337-F370 HydrophobicContact CD1-CG 4.35Å; L342-F370 HydrophobicContact CD1-CD2 3.76Å; L342-F370 HydrophobicContact CD1-CE2 3.62Å; L345-F370 HydrophobicContact CD2-CB 3.75Å; L345-F370 HydrophobicContact CD2-CD2 4.09Å; L345-F370 HydrophobicContact CD2-CG 3.91Å; L366-F370 WeakPolarHBondContact O-CB 3.44Å; L366-F370 PolarHBondContact O-N 3.09Å; E367-F370 PolarHBondContact O-N 3.42Å; F370-M373 PolarHBondContact O-N 3.4Å; F370-Q374 VanDerWaalsContact CE1-CD 3.41Å; F370-Q374 HydrophobicContact CE1-CG 4.17Å; F370-Q374 HydrophobicContact CZ-CG 4.23Å; F370-Q374 WeakPolarHBondContact O-CG 3.16Å; F370-Q374 PolarHBondContact O-N 2.91Å
371	V	73.4	Confident	64	Low	67 Å²	67	86.1 Å²	86.1	41%	0.406	42%	0.417	S	S	.	.	H	α-helix	trans	-63.2	-43.4	175.4	170.7	0	0	0	0	111.1	E367 M373 Q374 Q375	E367-V371 WeakPolarHBondContact O-CG2 3.38Å; E367-V371 PolarHBondContact O-N 3.03Å; V371-M373 PolarHBondContact O-N 3.5Å; V371-Q374 PolarHBondContact O-N 3.03Å; V371-Q375 HydrophobicContact CG1-CG 4.42Å; V371-Q375 WeakPolarHBondContact O-CG 3.26Å; V371-Q375 PolarHBondContact O-N 2.89Å
372	L	63.4	Low	61.9	Low	89 Å²	89	83.9 Å²	83.9	47%	0.466	42%	0.419	S	S	.	.	H	α-helix	trans	-61.2	-44	177	-170.6	69.6	0	0	0	111.7	L335 S368 Q369 Q375 M376	L335-L372 HydrophobicContact CD2-CD2 4.19Å; S368-L372 WeakPolarHBondContact O-CB 3.39Å; S368-L372 PolarHBondContact O-N 3.22Å; Q369-L372 PolarHBondContact O-N 2.9Å; L372-Q375 PolarHBondContact O-N 3.34Å; L372-M376 WeakPolarHBondContact O-CG 3.43Å; L372-M376 PolarHBondContact O-N 2.83Å
373	M	69.5	Low	60	Low	29 Å²	29	87.7 Å²	87.7	14%	0.143	44%	0.437	C	S	.	.	H	α-helix	trans	-66.5	-36.8	176.9	-173.6	-118.1	-71.6	0	0	112.4	L337 Q369 F370 V371 R377	L337-M373 HydrophobicContact CB-CE 3.72Å; L337-M373 HydrophobicContact CD1-CE 4.02Å; L337-M373 HydrophobicContact CG-CE 4.03Å; Q369-M373 WeakPolarHBondContact O-CB 3.34Å; Q369-M373 PolarHBondContact O-N 2.83Å; F370-M373 PolarHBondContact O-N 3.4Å; V371-M373 PolarHBondContact O-N 3.5Å; M373-R377 PolarHBondContact O-N 3.34Å; M373-R377 VanDerWaalsContact O-N 3.13Å; M373-R377 PolarHBondContact SD-NH2 3.27Å
374	Q	60.2	Low	57.8	Low	79 Å²	79	93.4 Å²	93.4	37%	0.369	47%	0.472	S	S	.	.	H	α-helix	trans	-65.7	-42.3	171.4	-76.8	-170.5	-38.3	0	0	112.1	F370 V371 M376 R377 H378	F370-Q374 VanDerWaalsContact CE1-CD 3.41Å; F370-Q374 HydrophobicContact CE1-CG 4.17Å; F370-Q374 HydrophobicContact CZ-CG 4.23Å; F370-Q374 WeakPolarHBondContact O-CG 3.16Å; F370-Q374 PolarHBondContact O-N 2.91Å; V371-Q374 PolarHBondContact O-N 3.03Å; Q374-M376 VanDerWaalsContact C-N 3.33Å; Q374-M376 PolarHBondContact O-N 3.31Å; Q374-R377 PolarHBondContact O-N 3.49Å; Q374-H378 WeakPolarHBondContact O-CB 3.43Å; Q374-H378 PolarHBondContact O-CD2 2.66Å; Q374-H378 VanDerWaalsContact O-CD2 3.27Å; Q374-H378 PolarHBondContact O-N 2.95Å
375	Q	53.6	Low	55.3	Low	115 Å²	115	98.3 Å²	98.3	54%	0.537	49%	0.485	S	S	.	.	H	α-helix	trans	-62.7	-37.6	178	-75.6	-179.1	1.8	0	0	112.7	V371 L372 K379	V371-Q375 HydrophobicContact CG1-CG 4.42Å; V371-Q375 WeakPolarHBondContact O-CG 3.26Å; V371-Q375 PolarHBondContact O-N 2.89Å; L372-Q375 PolarHBondContact O-N 3.34Å; Q375-K379 PolarHBondContact O-N 3.44Å
376	M	53.6	Low	53.4	Low	111 Å²	111	98.2 Å²	98.2	55%	0.547	49%	0.493	S	S	.	.	H	α-helix	trans	-63.1	-51.7	172	-69	-63.6	-70.7	0	0	111	L372 Q374 H378 K379 E380	L372-M376 WeakPolarHBondContact O-CG 3.43Å; L372-M376 PolarHBondContact O-N 2.83Å; Q374-M376 VanDerWaalsContact C-N 3.33Å; Q374-M376 PolarHBondContact O-N 3.31Å; M376-H378 VanDerWaalsContact C-N 3.27Å; M376-H378 PolarHBondContact O-N 2.61Å; M376-K379 WeakPolarHBondContact O-CB 3.48Å; M376-K379 PolarHBondContact O-N 3.33Å; M376-E380 PolarHBondContact O-N 2.88Å
377	R	47.8	Very low	51.2	Low	146 Å²	146	103.6 Å²	103.6	55%	0.551	53%	0.526	S	S	*	.	H	α-helix	trans	-59.9	-35.4	179.8	-155.2	-169.6	-57.5	-167	2.1	112.9	M373 Q374 E380 V381	M373-R377 PolarHBondContact O-N 3.34Å; M373-R377 VanDerWaalsContact O-N 3.13Å; M373-R377 PolarHBondContact SD-NH2 3.27Å; Q374-R377 PolarHBondContact O-N 3.49Å; R377-E380 PolarHBondContact O-N 3.28Å; R377-V381 WeakPolarHBondContact O-CG2 3.36Å; R377-V381 PolarHBondContact O-N 3.29Å; R377-V381 VanDerWaalsContact O-N 3.17Å
378	H	44.6	Very low	48.6	Very low	129 Å²	129	105.6 Å²	105.6	60%	0.597	56%	0.558	S	S	*	*	H	α-helix	trans	-72.7	-27.7	175.9	-86.6	-75.5	0	0	0	113.7	Q374 M376 A382	Q374-H378 WeakPolarHBondContact O-CB 3.43Å; Q374-H378 PolarHBondContact O-CD2 2.66Å; Q374-H378 VanDerWaalsContact O-CD2 3.27Å; Q374-H378 PolarHBondContact O-N 2.95Å; M376-H378 VanDerWaalsContact C-N 3.27Å; M376-H378 PolarHBondContact O-N 2.61Å; H378-A382 WeakPolarHBondContact O-CB 3.45Å; H378-A382 PolarHBondContact O-N 3.18Å
379	K	42.8	Very low	46.5	Very low	151 Å²	151	109.3 Å²	109.3	66%	0.657	57%	0.57	S	S	*	*	H	α-helix	trans	-68.6	-39.4	171.5	-78	178.2	175.4	178.6	0	111.9	Q375 M376 A382 Q383	Q375-K379 PolarHBondContact O-N 3.44Å; M376-K379 WeakPolarHBondContact O-CB 3.48Å; M376-K379 PolarHBondContact O-N 3.33Å; K379-A382 PolarHBondContact O-N 3.44Å; K379-Q383 PolarHBondContact O-N 2.85Å
380	E	42.3	Very low	44.6	Very low	124 Å²	124	114.7 Å²	114.7	58%	0.579	60%	0.595	S	S	*	*	H	α-helix	trans	-66.6	-46.7	177.5	-65.2	171.5	140.1	0	0	111.6	M376 R377 A382 Q383 V384	M376-E380 PolarHBondContact O-N 2.88Å; R377-E380 PolarHBondContact O-N 3.28Å; E380-A382 PolarHBondContact O-N 3.06Å; E380-Q383 PolarHBondContact O-N 3.4Å; E380-Q383 VanDerWaalsContact O-N 3.11Å; E380-V384 PolarHBondContact O-N 3.19Å
381	V	38.6	Very low	42.3	Very low	94 Å²	94	121 Å²	121	57%	0.57	63%	0.63	S	S	*	*	H	α-helix	trans	-62.7	-29.4	177.1	173	0	0	0	0	112.5	R377 Q383	R377-V381 WeakPolarHBondContact O-CG2 3.36Å; R377-V381 PolarHBondContact O-N 3.29Å; R377-V381 VanDerWaalsContact O-N 3.17Å; V381-Q383 VanDerWaalsContact C-N 3.34Å
382	A	33.2	Very low	40	Very low	74 Å²	74	121 Å²	121	61%	0.612	64%	0.644	S	S	*	*	H	α-helix	trans	-69.7	-28.2	176.1	0	0	0	0	0	113.4	H378 K379 E380	H378-A382 WeakPolarHBondContact O-CB 3.45Å; H378-A382 PolarHBondContact O-N 3.18Å; K379-A382 PolarHBondContact O-N 3.44Å; E380-A382 PolarHBondContact O-N 3.06Å
383	Q	33.8	Very low	38.2	Very low	158 Å²	158	121.8 Å²	121.8	74%	0.738	66%	0.663	S	S	*	*	H	α-helix	trans	-95.3	-25.4	-174.1	-154.5	166.7	11.5	0	0	113.3	K379 E380 V381 R385	K379-Q383 PolarHBondContact O-N 2.85Å; E380-Q383 PolarHBondContact O-N 3.4Å; E380-Q383 VanDerWaalsContact O-N 3.11Å; V381-Q383 VanDerWaalsContact C-N 3.34Å; Q383-R385 VanDerWaalsContact C-N 3.29Å; Q383-R385 PolarHBondContact O-N 3.22Å
384	V	35.3	Very low	36.2	Very low	124 Å²	124	127.7 Å²	127.7	75%	0.752	69%	0.694	S	S	*	*	H	α-helix	trans	-76.1	-13.4	177.5	176	0	0	0	0	112.9	E380 T386	E380-V384 PolarHBondContact O-N 3.19Å; V384-T386 VanDerWaalsContact C-N 3.3Å; V384-T386 PolarHBondContact O-N 3.05Å
385	R	29.4	Very low	34.7	Very low	223 Å²	223	129.7 Å²	129.7	84%	0.842	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.6	6.9	-176.6	-129.3	176.7	-170.7	-178.5	2.7	115.6	Q383	Q383-R385 VanDerWaalsContact C-N 3.29Å; Q383-R385 PolarHBondContact O-N 3.22Å
386	T	32.5	Very low	33.3	Very low	112 Å²	112	130.9 Å²	130.9	69%	0.687	72%	0.722	S	S	*	*	S	Bend	trans	-135.6	57	-176.9	53	0	0	0	0	114.7	V384	V384-T386 VanDerWaalsContact C-N 3.3Å; V384-T386 PolarHBondContact O-N 3.05Å
387	T	29	Very low	31.9	Very low	129 Å²	129	130.4 Å²	130.4	79%	0.791	73%	0.729	S	S	*	*			trans	-156.4	31.2	154.4	17.2	0	0	0	0	113.6	I389	T387-I389 PolarHBondContact O-N 2.81Å
388	G	25.3	Very low	30.8	Very low	83 Å²	83	129.1 Å²	129.1	86%	0.856	74%	0.742	S	S	*	*			trans	-77.5	98.3	169.3	0	0	0	0	0	111.4
389	I	26.6	Very low	30	Very low	158 Å²	158	131 Å²	131	81%	0.81	76%	0.756	S	S	*	*			trans	-113.9	128.1	169.4	-64.2	-178.8	0	0	0	108.8	T387	T387-I389 PolarHBondContact O-N 2.81Å
390	H	25.8	Very low	30.2	Very low	177 Å²	177	128.6 Å²	128.6	82%	0.819	76%	0.756	S	S	*	*			trans	-70.5	142.5	177.6	-85.8	-92.8	0	0	0	112.2	G392	H390-G392 PolarHBondContact O-N 2.83Å
391	N	27.1	Very low	29.4	Very low	169 Å²	169	128.4 Å²	128.4	90%	0.904	76%	0.763	S	S	*	*			trans	-70.3	114.9	145.8	-82.9	-19.8	0	0	0	107.9
392	G	25.9	Very low	28.7	Very low	68 Å²	68	131 Å²	131	70%	0.701	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-91.3	137.3	172.3	0	0	0	0	0	111.6	H390	H390-G392 PolarHBondContact O-N 2.83Å
393	A	25.1	Very low	28.3	Very low	104 Å²	104	132.2 Å²	132.2	86%	0.86	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-76.4	162.9	154.8	0	0	0	0	0	109.6
394	I	28.3	Very low	27.9	Very low	154 Å²	154	130.8 Å²	130.8	79%	0.79	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-95.9	154.1	-177.2	-49.1	178.2	0	0	0	109.2
395	T	27.2	Very low	27.4	Very low	121 Å²	121	129.7 Å²	129.7	74%	0.742	78%	0.777	S	S	*	*			trans	71	139.5	-178.9	71.5	0	0	0	0	115.7
396	D	24.9	Very low	27.2	Very low	140 Å²	140	125.8 Å²	125.8	75%	0.749	77%	0.773	S	S	*	*			cis	-154.7	158	-2.1	-126.3	-31.2	0	0	0	115.4
397	S	24.6	Very low	26.9	Very low	101 Å²	101	131.2 Å²	131.2	71%	0.706	78%	0.781	S	S	*	*			trans	70.3	139.4	152.5	77	0	0	0	0	124
398	S	25	Very low	26.7	Very low	118 Å²	118	131.9 Å²	131.9	83%	0.825	78%	0.775	S	S	*	*			trans	90.3	144.9	150.1	76.6	0	0	0	0	122
399	L	27.6	Very low	27.3	Very low	168 Å²	168	133.8 Å²	133.8	88%	0.88	77%	0.772	S	S	*	*			trans	-118.2	-174.2	-168.4	-70.2	157.7	0	0	0	109.6
400	P	46.8	Very low	27.3	Very low	102 Å²	102	134 Å²	134	66%	0.662	77%	0.77	S	S	*	*				-133.4	-176.2	-58.5	40	-25	0	0	0	111.8
401	T	24.7	Very low	27.3	Very low	119 Å²	119	129.3 Å²	129.3	73%	0.73	77%	0.769	S	S	*	*				171.7	142.2	127.9	29.7	0	0	0	0	114.6
402	N	25.5	Very low	27.1	Very low	149 Å²	149	126.3 Å²	126.3	80%	0.797	77%	0.768	S	S	*	*			trans	43	145.3	136	-58.6	-7.7	0	0	0	122.5
403	S	24.1	Very low	27.1	Very low	100 Å²	100	130.9 Å²	130.9	70%	0.699	78%	0.775	S	S	*	*			cis	-176.3	145.9	-5.9	48.4	0	0	0	0	114.8
404	V	24.4	Very low	27.1	Very low	128 Å²	128	132 Å²	132	78%	0.776	77%	0.771	S	S	*	*			trans	77.4	103.7	134.7	170.7	0	0	0	0	122.8
405	S	25.9	Very low	26.9	Very low	100 Å²	100	135.2 Å²	135.2	70%	0.699	77%	0.774	S	S	*	*				78.1	156	123.9	-63	0	0	0	0	126.8
406	N	24.9	Very low	26.7	Very low	141 Å²	141	135.2 Å²	135.2	75%	0.754	77%	0.773	S	S	*	*			trans	81.8	137.8	158.3	-73.1	-27.6	0	0	0	118.8
407	R	26.5	Very low	26.6	Very low	227 Å²	227	133.8 Å²	133.8	86%	0.857	77%	0.774	S	S	*	*			cis	-160.9	156.6	-8.8	-138.3	175.1	-169.3	-152	2.1	111.7
408	Q	24.6	Very low	26.6	Very low	143 Å²	143	134.6 Å²	134.6	67%	0.668	78%	0.78	S	S	*	*			trans	-89.8	162.8	161.9	-68.9	-173.9	-49.7	0	0	111.4	H410	Q408-H410 PolarHBondContact OE1-CE1 2.7Å
409	P	37.7	Very low	26.5	Very low	122 Å²	122	135.8 Å²	135.8	79%	0.792	78%	0.782	S	S	*	*				-132.5	158.4	90.9	33.1	-19.7	0	0	0	112.6
410	H	26.5	Very low	26.4	Very low	164 Å²	164	132.3 Å²	132.3	76%	0.759	77%	0.772	S	S	*	*			cis	109.7	125.2	19.1	-82.5	-35.7	0	0	0	114.3	Q408	Q408-H410 PolarHBondContact OE1-CE1 2.7Å
411	G	25.4	Very low	25.5	Very low	78 Å²	78	135.6 Å²	135.6	80%	0.804	78%	0.778	S	S	*	*			trans	115	140.4	162.4	0	0	0	0	0	115.8
412	A	23.9	Very low	26.2	Very low	105 Å²	105	135 Å²	135	87%	0.868	78%	0.776	S	S	*	*			cis	-157.4	154.8	-15.1	0	0	0	0	0	112.9
413	L	25.3	Very low	26.2	Very low	164 Å²	164	131.3 Å²	131.3	86%	0.859	77%	0.774	S	S	*	*			trans	-57.9	155	176.9	-65.1	133.4	0	0	0	114.2
414	T	25	Very low	26.2	Very low	127 Å²	127	133.9 Å²	133.9	78%	0.779	79%	0.785	S	S	*	*				-176.6	170.4	79.5	35.6	0	0	0	0	109.6
415	R	23.9	Very low	26.3	Very low	223 Å²	223	138.9 Å²	138.9	84%	0.842	79%	0.789	S	S	*	*			cis	-160	139.2	22.3	-147.2	168.7	-171.1	-179.7	3.4	112.4
416	V	23.6	Very low	26.9	Very low	120 Å²	120	139.9 Å²	139.9	73%	0.727	79%	0.794	S	S	*	*			trans	38.8	128.3	143.7	-179.2	0	0	0	0	120
417	S	23	Very low	26.8	Very low	111 Å²	111	137.8 Å²	137.8	78%	0.776	80%	0.796	S	S	*	*			cis	94.8	101.5	12.3	-45.1	0	0	0	0	119.1
418	S	23.9	Very low	26.6	Very low	118 Å²	118	132.6 Å²	132.6	83%	0.825	79%	0.793	S	S	*	*			trans	-176.3	151.2	158.1	54.1	0	0	0	0	111.1
419	V	24.1	Very low	26.7	Very low	143 Å²	143	131.6 Å²	131.6	87%	0.867	80%	0.797	S	S	*	*			cis	-153.3	159.8	-14.4	126.6	0	0	0	0	108.4
420	S	24.9	Very low	26	Very low	95 Å²	95	132.5 Å²	132.5	66%	0.664	79%	0.79	S	S	*	*			trans	-96.5	167.9	-167.5	51.7	0	0	0	0	116.7
421	Q	28	Very low	26	Very low	171 Å²	171	131.7 Å²	131.7	80%	0.799	79%	0.785	S	S	*	*			trans	118	162.9	144.7	-63.6	-130.6	17.1	0	0	117.4
422	P	39.9	Very low	25.9	Very low	106 Å²	106	134.5 Å²	134.5	69%	0.688	78%	0.78	S	S	*	*			cis	-143.1	160.3	-49.8	40.1	-24.3	0	0	0	116.7
423	G	24.8	Very low	26	Very low	72 Å²	72	136.8 Å²	136.8	74%	0.742	78%	0.777	S	S	*	*				80.3	155.4	129.3	0	0	0	0	0	124.5
424	V	24.7	Very low	25.9	Very low	154 Å²	154	133.5 Å²	133.5	93%	0.933	77%	0.768	S	S	*	*			trans	88.1	136.7	153.3	-175	0	0	0	0	120.3
425	R	26.6	Very low	25.9	Very low	232 Å²	232	133.1 Å²	133.1	88%	0.875	77%	0.771	S	S	*	*			trans	-106.1	160.7	170.7	-58.6	171.8	163.8	177.2	-5.5	109.6
426	P	37.5	Very low	25.9	Very low	121 Å²	121	126.2 Å²	126.2	79%	0.786	77%	0.769	S	S	*	*				-163.8	173.2	89.2	42.8	-22.1	0	0	0	119.7
427	A	23.6	Very low	25.8	Very low	98 Å²	98	125.6 Å²	125.6	81%	0.81	78%	0.776	S	S	*	*			trans	61.6	-177.2	143	0	0	0	0	0	122.7
428	C	22.5	Very low	26.2	Very low	118 Å²	118	130.5 Å²	130.5	80%	0.797	78%	0.784	S	S	*	*				-167	169.9	-73	-146.4	0	0	0	0	113
429	V	25	Very low	26.6	Very low	121 Å²	121	130.6 Å²	130.6	73%	0.733	78%	0.784	S	S	*	*			trans	78.2	111.6	155	175.4	0	0	0	0	122.7
430	E	24.3	Very low	26.7	Very low	141 Å²	141	128.8 Å²	128.8	66%	0.659	78%	0.784	S	S	*	*			trans	58.8	134.1	132.4	-64.7	-154	123.4	0	0	129.8
431	K	25.9	Very low	26.7	Very low	148 Å²	148	127.7 Å²	127.7	64%	0.643	79%	0.789	S	S	*	*				88.6	117.2	125.3	-81.1	174	177	142.5	0	126.8
432	L	23.1	Very low	26.5	Very low	136 Å²	136	126.1 Å²	126.1	71%	0.712	80%	0.795	S	S	*	*				80.9	136.5	120.9	-74.7	169.8	0	0	0	126.4
433	L	25.5	Very low	25.9	Very low	153 Å²	153	128.7 Å²	128.7	80%	0.801	80%	0.801	S	S	*	*			trans	72.7	151.6	148.7	-67.7	165.1	0	0	0	119.3
434	S	23.4	Very low	26.8	Very low	96 Å²	96	131.1 Å²	131.1	67%	0.671	80%	0.804	S	S	*	*			cis	-163.6	161.7	-2.6	41.4	0	0	0	0	113.8
435	S	24.8	Very low	27	Very low	119 Å²	119	129.9 Å²	129.9	83%	0.832	80%	0.801	S	S	*	*			trans	21.5	151.3	151.8	58.1	0	0	0	0	123.5
436	G	24	Very low	26.9	Very low	78 Å²	78	121.6 Å²	121.6	80%	0.804	79%	0.788	S	S	*	*			cis	140.4	140.2	1.4	0	0	0	0	0	113.5
437	A	23.1	Very low	26.6	Very low	106 Å²	106	122.9 Å²	122.9	88%	0.876	79%	0.793	S	S	*	*			trans	-164.2	173.2	176.9	0	0	0	0	0	115.1
438	F	29.8	Very low	26.8	Very low	214 Å²	214	122.4 Å²	122.4	94%	0.939	78%	0.784	S	S	*	*			trans	-142.5	141.8	-170.4	-98.5	-85.2	0	0	0	117.9
439	S	34	Very low	27.1	Very low	120 Å²	120	125.7 Å²	125.7	84%	0.839	79%	0.785	S	S	*	*			trans	68.9	127.8	136.5	-152.8	0	0	0	0	127.3
440	A	25.7	Very low	27.2	Very low	105 Å²	105	126.1 Å²	126.1	87%	0.868	78%	0.782	S	S	*	*			trans	-170.7	168.3	152.5	0	0	0	0	0	110.4
441	G	23.9	Very low	27.3	Very low	73 Å²	73	127.5 Å²	127.5	75%	0.753	79%	0.793	S	S	*	*			cis	168.9	151.2	-12.5	0	0	0	0	0	115.5
442	C	24.1	Very low	27.1	Very low	138 Å²	138	123.2 Å²	123.2	93%	0.932	79%	0.79	S	S	*	*			trans	77.4	170.7	157.9	-65	0	0	0	0	124.1
443	I	27.7	Very low	27.2	Very low	159 Å²	159	122.4 Å²	122.4	82%	0.815	80%	0.796	S	S	*	*			trans	-151.9	143.9	-146.3	-80.7	168.3	0	0	0	113
444	P	44.5	Very low	27.2	Very low	124 Å²	124	120.5 Å²	120.5	81%	0.805	79%	0.791	S	S	*	*				-148.6	158.9	108.1	32.1	-11.8	0	0	0	114.8
445	C	27.3	Very low	27.2	Very low	128 Å²	128	122.5 Å²	122.5	87%	0.865	79%	0.794	S	S	*	*			cis	107.7	132	24.9	-163.1	0	0	0	0	112.8
446	G	25.2	Very low	27.1	Very low	58 Å²	58	122.6 Å²	122.6	60%	0.598	79%	0.789	S	S	*	*			cis	174.1	-167.6	-4.1	0	0	0	0	0	115.5
447	T	30.6	Very low	27.1	Very low	147 Å²	147	126.1 Å²	126.1	90%	0.902	79%	0.788	S	S	*	*			trans	70.5	149.2	163.9	51.8	0	0	0	0	121.5
448	S	28.4	Very low	27.1	Very low	88 Å²	88	128 Å²	128	62%	0.615	78%	0.783	S	S	*	*			cis	-174.8	135.9	-6.4	153	0	0	0	0	116.6
449	K	29.1	Very low	26.8	Very low	188 Å²	188	125.4 Å²	125.4	82%	0.817	78%	0.778	S	S	*	*			trans	67.6	159.2	148.3	-69.2	176	178	179.4	0	120.4
450	I	28.1	Very low	26.3	Very low	130 Å²	130	123.2 Å²	123.2	67%	0.667	77%	0.774	S	S	*	*			cis	-165	154.8	-9.8	-113.3	171.4	0	0	0	113.3
451	L	24.6	Very low	26.2	Very low	170 Å²	170	123.1 Å²	123.1	89%	0.89	77%	0.767	S	S	*	*			trans	51.6	158.7	163.4	-96.3	52.6	0	0	0	121.6
452	G	23.3	Very low	26.3	Very low	57 Å²	57	126.6 Å²	126.6	59%	0.588	77%	0.769	S	S	*	*			cis	160.9	141	-14.5	0	0	0	0	0	116.7
453	S	24.8	Very low	26.2	Very low	119 Å²	119	124.9 Å²	124.9	83%	0.832	76%	0.757	S	S	*	*			trans	63.2	160.9	163.5	71.1	0	0	0	0	119
454	T	24.3	Very low	26	Very low	114 Å²	114	125.2 Å²	125.2	70%	0.699	76%	0.759	S	S	*	*			cis	-157.5	156.2	-12.7	3.6	0	0	0	0	111.2
455	D	24	Very low	25	Very low	138 Å²	138	124 Å²	124	74%	0.738	76%	0.759	S	S	*	*			trans	56.7	148.1	143.9	-62.6	-27.2	0	0	0	126.9
456	T	22.9	Very low	24.8	Very low	120 Å²	120	121.5 Å²	121.5	74%	0.736	76%	0.756	S	S	*	*			trans	77	105.6	145.3	40	0	0	0	0	124.8
457	I	24.4	Very low	24.6	Very low	152 Å²	152	123.7 Å²	123.7	78%	0.779	76%	0.761	S	S	*	*				76.4	150.9	113.5	-75.3	-179.3	0	0	0	122.4
458	L	22.5	Very low	24.2	Very low	146 Å²	146	125 Å²	125	76%	0.764	76%	0.757	S	S	*	*			trans	83.7	112.5	165.6	-80.8	164.5	0	0	0	121.6
459	L	22.9	Very low	24	Very low	159 Å²	159	125.3 Å²	125.3	83%	0.832	76%	0.76	S	S	*	*				39.3	126.6	121.6	-109.4	151.9	0	0	0	121.5
460	G	24	Very low	23.7	Very low	74 Å²	74	124.2 Å²	124.2	76%	0.763	76%	0.763	S	S	*	*			trans	-179	136.1	161.4	0	0	0	0	0	112.8
461	S	23.6	Very low	23.6	Very low	103 Å²	103	121.6 Å²	121.6	72%	0.72	77%	0.768	S	S	*	*			trans	-123.7	159.6	-176.3	-58.7	0	0	0	0	112.7
462	N	25.3	Very low	23.6	Very low	146 Å²	146	121.2 Å²	121.2	78%	0.781	77%	0.767	S	S	*	*			trans	81.7	104.9	157.8	-58.5	-15.2	0	0	0	120.7
463	C	23.5	Very low	23.5	Very low	102 Å²	102	124.9 Å²	124.9	69%	0.689	78%	0.778	S	S	*	*				72.7	121.3	116.6	-61.6	0	0	0	0	123.5
464	I	23.4	Very low	23.7	Very low	166 Å²	166	125.1 Å²	125.1	85%	0.851	78%	0.776	S	S	*	*			trans	73.7	133.5	135.9	-62.1	168.6	0	0	0	117.2
465	A	23.3	Very low	23.6	Very low	98 Å²	98	130.8 Å²	130.8	81%	0.81	79%	0.786	S	S	*	*			cis	-170.4	164.5	-18.4	0	0	0	0	0	109.5
466	G	22	Very low	23.6	Very low	77 Å²	77	132.5 Å²	132.5	79%	0.794	79%	0.794	S	S	*	*			trans	160	104.1	163.5	0	0	0	0	0	118.9
467	S	22.2	Very low	23.5	Very low	103 Å²	103	134.5 Å²	134.5	72%	0.72	80%	0.796	S	S	*	*			trans	44.7	146.6	153.6	-136.4	0	0	0	0	124.2
468	E	22.1	Very low	23.5	Very low	174 Å²	174	134.3 Å²	134.3	81%	0.813	79%	0.791	S	S	*	*			trans	61.9	148.1	155.3	-73.9	152.5	-114.1	0	0	120.6
469	S	23.9	Very low	23.6	Very low	96 Å²	96	133.2 Å²	133.2	67%	0.671	79%	0.786	S	S	*	*			cis	-158.2	158.4	-23.2	63.5	0	0	0	0	112.1
470	N	23.2	Very low	23.8	Very low	164 Å²	164	132.2 Å²	132.2	88%	0.877	79%	0.787	S	S	*	*			trans	33.4	127.2	157.3	-61.3	-20.4	0	0	0	122.3
471	G	25	Very low	23.8	Very low	75 Å²	75	137.4 Å²	137.4	77%	0.773	79%	0.791	S	S	*	*			trans	-166.9	49.2	177.1	0	0	0	0	0	117.5
472	N	24.3	Very low	24.1	Very low	163 Å²	163	138.8 Å²	138.8	87%	0.872	80%	0.795	S	S	*	*			trans	-6.9	126.2	173.7	-62.9	-21.9	0	0	0	121.2
473	V	22.9	Very low	24.1	Very low	134 Å²	134	139.7 Å²	139.7	81%	0.812	80%	0.799	S	S	*	*			trans	-136.9	139.9	154.3	178.7	0	0	0	0	106.9
474	P	28.1	Very low	24.2	Very low	123 Å²	123	140 Å²	140	80%	0.799	80%	0.8	S	S	*	*			trans	-83.7	152.6	-151.7	31.1	-37.1	0	0	0	116.6
475	Y	22	Very low	24.2	Very low	233 Å²	233	138 Å²	138	91%	0.914	79%	0.787	S	S	*	*			trans	-76.9	152.9	166.1	-88.5	-102.2	0	0	0	112.1
476	L	24.6	Very low	24.5	Very low	174 Å²	174	138.5 Å²	138.5	91%	0.911	78%	0.776	S	S	*	*			trans	-132.1	153.4	151.9	-146.3	140.1	0	0	0	108.9
477	Q	20.8	Very low	24.6	Very low	163 Å²	163	140 Å²	140	76%	0.762	76%	0.762	S	S	*	*			trans	-113	170.5	-151.6	-149.6	-179.5	9.7	0	0	113.4
478	Q	24.6	Very low	24.7	Very low	148 Å²	148	138.5 Å²	138.5	69%	0.692	75%	0.749	S	S	*	*			trans	85.2	126.7	153.9	-73.5	-169.2	-12.6	0	0	121.8
479	N	23.3	Very low	24.7	Very low	123 Å²	123	137.5 Å²	137.5	66%	0.658	75%	0.749	S	S	*	*				70.9	90.9	128.4	-55.6	-2	0	0	0	119.9
480	T	28.2	Very low	24.7	Very low	138 Å²	138	138.7 Å²	138.7	85%	0.847	75%	0.747	S	S	*	*			trans	-41.8	135.6	138.5	20	0	0	0	0	112.9
481	H	23.2	Very low	24.7	Very low	182 Å²	182	138.6 Å²	138.6	84%	0.843	75%	0.747	S	S	*	*			trans	-149.7	130.6	147.8	-104.7	-73.4	0	0	0	110.7
482	T	30.3	Very low	24.6	Very low	133 Å²	133	140.3 Å²	140.3	82%	0.816	75%	0.747	S	S	*	*			trans	-80.8	137.1	174.8	29.3	0	0	0	0	111.6
483	L	25	Very low	24.6	Very low	164 Å²	164	138.1 Å²	138.1	86%	0.859	74%	0.744	S	S	*	*			trans	-144.7	159.6	160.2	-82.5	-178.1	0	0	0	110.6
484	P	24.9	Very low	24.6	Very low	110 Å²	110	138.8 Å²	138.8	71%	0.714	75%	0.749	S	S	*	*			trans	-120.3	177	-157.2	40.6	-27.3	0	0	0	115.2
485	H	24.8	Very low	24.5	Very low	123 Å²	123	141.7 Å²	141.7	57%	0.569	75%	0.751	S	S	*	*			trans	-78.6	155	163.8	-66.6	-89.8	0	0	0	112.2	Q260	Q260-H485 PolarHBondContact OE1-ND1 2.91Å
486	N	28.8	Very low	24.6	Very low	109 Å²	109	139.6 Å²	139.6	58%	0.583	75%	0.75	S	S	*	*			trans	-154.1	168.4	137.4	-110.9	-23.8	0	0	0	111.5	Q253	Q253-N486 PolarHBondContact NE2-O 2.93Å
487	H	24.3	Very low	25.3	Very low	109 Å²	109	135.9 Å²	135.9	51%	0.505	74%	0.737	S	S	.	*			trans	-109	164.7	-176.6	-63.6	-124.1	0	0	0	111.3	Y808	H487-Y808 AromaticContact CE1-CE1 3.99Å
488	T	23.8	Very low	25.3	Very low	71 Å²	71	140.6 Å²	140.6	44%	0.436	75%	0.747	S	S	.	*			trans	-103.3	138.5	151.7	25	0	0	0	0	110.9	Q253	Q253-T488 HydrophobicContact CB-CG2 4.27Å; Q253-T488 HydrophobicContact CG-CG2 3.67Å; Q253-T488 WeakPolarHBondContact CG-OG1 3.26Å
489	D	22.5	Very low	25.3	Very low	152 Å²	152	143.8 Å²	143.8	81%	0.813	75%	0.753	S	S	*	*			trans	-104.3	151.9	147.1	-80.1	-56.3	0	0	0	108.5
490	L	23.5	Very low	25.5	Very low	121 Å²	121	146.4 Å²	146.4	63%	0.634	76%	0.759	S	S	*	*			trans	-144.6	113.9	171.2	-143.9	171.7	0	0	0	110.1
491	N	23	Very low	25.2	Very low	163 Å²	163	148.5 Å²	148.5	87%	0.872	76%	0.759	S	S	*	*			trans	-125.4	137.4	172.6	-105.1	-44	0	0	0	109.1
492	S	24.3	Very low	25.3	Very low	111 Å²	111	146.7 Å²	146.7	78%	0.776	76%	0.755	S	S	*	*			trans	-142.6	146.2	167.3	60	0	0	0	0	109.5
493	S	24.3	Very low	24.9	Very low	117 Å²	117	145.4 Å²	145.4	82%	0.818	75%	0.751	S	S	*	*			trans	-139	135.5	-175	55.5	0	0	0	0	109.7
494	T	22.6	Very low	24.9	Very low	147 Å²	147	145.3 Å²	145.3	90%	0.902	75%	0.751	S	S	*	*			trans	-75.2	149	174.6	33.4	0	0	0	0	112.5
495	E	25.1	Very low	24.9	Very low	184 Å²	184	145.3 Å²	145.3	86%	0.86	75%	0.754	S	S	*	*			trans	-84.5	163.2	172.8	-57.2	-171.6	129	0	0	112.1
496	E	24.7	Very low	24.9	Very low	190 Å²	190	143.4 Å²	143.4	89%	0.888	76%	0.76	S	S	*	*				-164.9	162.1	117.9	-93.7	-133.4	114	0	0	111.9
497	P	38.4	Very low	24.8	Very low	96 Å²	96	147.8 Å²	147.8	62%	0.623	78%	0.777	S	S	*	*			trans	-129.4	166.5	-158	41.5	-26.7	0	0	0	116.9
498	W	22	Very low	24.7	Very low	261 Å²	261	146.1 Å²	146.1	99%	0.989	79%	0.789	S	S	*	*			trans	-142.7	166.2	160.8	-91.5	94.9	0	0	0	113.6
499	R	25.2	Very low	24.7	Very low	215 Å²	215	150.5 Å²	150.5	81%	0.811	81%	0.809	S	S	*	*			trans	-115.6	143.9	-158.9	-91.4	-167.2	-178.9	-165.1	6.5	117.4
500	K	26.2	Very low	24.7	Very low	179 Å²	179	151.5 Å²	151.5	78%	0.778	81%	0.808	S	S	*	*			trans	30	123.1	135.5	-62.3	-170.7	175.7	-170	0	121.6
501	Q	22.8	Very low	24.7	Very low	181 Å²	181	154.5 Å²	154.5	85%	0.846	82%	0.816	S	S	*	*				-146.4	166	127.1	-74.6	-161.1	-2.5	0	0	107.3
502	L	24.7	Very low	24.7	Very low	145 Å²	145	151.3 Å²	151.3	76%	0.759	81%	0.807	S	S	*	*			cis	-165	154.9	-26.6	-98	172.5	0	0	0	104.4
503	S	22.9	Very low	24.7	Very low	105 Å²	105	154.5 Å²	154.5	73%	0.734	81%	0.809	S	S	*	*			cis	-153.7	-171.6	-9.4	-163	0	0	0	0	108
504	N	23.4	Very low	24.6	Very low	163 Å²	163	154.2 Å²	154.2	87%	0.872	81%	0.807	S	S	*	*			trans	-156.5	133.4	171	-146.5	1.3	0	0	0	113.3
505	S	25.3	Very low	24.7	Very low	110 Å²	110	152 Å²	152	77%	0.769	80%	0.797	S	S	*	*			trans	-174.7	144.2	176.4	54.7	0	0	0	0	112.2
506	A	25.3	Very low	24.5	Very low	83 Å²	83	148.6 Å²	148.6	69%	0.686	79%	0.793	S	S	*	*			cis	-165.2	158.1	-16.1	0	0	0	0	0	110.2
507	Q	25.4	Very low	24.4	Very low	201 Å²	201	147.3 Å²	147.3	94%	0.939	79%	0.791	S	S	*	*			trans	40.3	129.2	152.1	-65.2	173.3	-24.7	0	0	122.1
508	G	23.5	Very low	23.7	Very low	74 Å²	74	148.4 Å²	148.4	76%	0.763	80%	0.801	S	S	*	*			trans	138.1	112	134.8	0	0	0	0	0	120.9
509	L	23.1	Very low	23.6	Very low	163 Å²	163	139.4 Å²	139.4	85%	0.853	79%	0.789	S	S	*	*			trans	52.9	100.5	136.9	-71.7	154.9	0	0	0	123
510	H	23.8	Very low	24.6	Very low	172 Å²	172	134.5 Å²	134.5	80%	0.796	79%	0.786	S	S	*	*				36.8	140.2	120.2	-75.9	-69.3	0	0	0	125.4
511	K	23.7	Very low	24.7	Very low	184 Å²	184	133 Å²	133	80%	0.8	79%	0.786	S	S	*	*			trans	82.5	88.5	141.7	-77.9	-177	175.3	-174.6	0	122.2
512	S	22.8	Very low	25	Very low	97 Å²	97	133.4 Å²	133.4	68%	0.678	79%	0.788	S	S	*	*				42.9	135.1	111.6	65.4	0	0	0	0	124.3
513	Q	23.2	Very low	25	Very low	178 Å²	178	134.5 Å²	134.5	83%	0.832	79%	0.789	S	S	*	*			trans	93.7	122.8	143.2	-80.9	178.9	-23	0	0	122.6
514	S	22.4	Very low	25	Very low	110 Å²	110	136.8 Å²	136.8	77%	0.769	79%	0.788	S	S	*	*			trans	63.3	153.5	143.9	56.2	0	0	0	0	120.9
515	S	23.8	Very low	25.3	Very low	100 Å²	100	134.1 Å²	134.1	70%	0.699	78%	0.78	S	S	*	*			cis	-174.6	151.1	-23.5	53.7	0	0	0	0	111.8
516	C	22.2	Very low	25.1	Very low	113 Å²	113	135.3 Å²	135.3	76%	0.764	78%	0.777	S	S	*	*			trans	75.9	129.4	149.8	-69.9	0	0	0	0	123.4
517	L	22.4	Very low	25	Very low	163 Å²	163	139.9 Å²	139.9	85%	0.853	78%	0.782	S	S	*	*			trans	98.4	140.4	133.3	-76.1	165.1	0	0	0	124.2
518	S	23.9	Very low	24.9	Very low	119 Å²	119	135.3 Å²	135.3	83%	0.832	77%	0.772	S	S	*	*			trans	90	139.1	156.3	-58.8	0	0	0	0	121.3
519	G	19.5	Very low	25.2	Very low	72 Å²	72	138.3 Å²	138.3	74%	0.742	78%	0.775	S	S	*	*			trans	-108.8	-137	174.3	0	0	0	0	0	112.2
520	P	46.5	Very low	25.1	Very low	113 Å²	113	134.5 Å²	134.5	73%	0.734	78%	0.775	S	S	*	*			cis	-143.1	-167	8.3	45.6	-26.3	0	0	0	116.4
521	N	28	Very low	25.3	Very low	148 Å²	148	132 Å²	132	79%	0.791	78%	0.778	S	S	*	*			trans	59.3	116.4	155	-65	-0.5	0	0	0	122.4
522	E	29.1	Very low	25.2	Very low	189 Å²	189	128 Å²	128	88%	0.883	78%	0.779	S	S	*	*				-163.2	158.2	93.7	-101.4	179	173.2	0	0	110.8
523	E	24.6	Very low	25.5	Very low	167 Å²	167	131.8 Å²	131.8	78%	0.78	79%	0.786	S	S	*	*	S	Bend	trans	15.4	133.9	173.3	-57	-148.1	115	0	0	121.5
524	Q	22.2	Very low	25.5	Very low	153 Å²	153	134 Å²	134	72%	0.715	79%	0.788	S	S	*	*			cis	-152.9	173.2	6.6	-113.1	-177.8	35	0	0	109.8
525	P	31.3	Very low	25.5	Very low	107 Å²	107	136.2 Å²	136.2	70%	0.695	79%	0.786	S	S	*	*			trans	-86.2	143.4	-133.3	-9.1	29.1	0	0	0	116.2
526	L	21.4	Very low	25.6	Very low	135 Å²	135	140.5 Å²	140.5	71%	0.707	80%	0.795	S	S	*	*				71.1	142.1	56.4	-56.4	174	0	0	0	113.7
527	F	21.4	Very low	25.8	Very low	180 Å²	180	139 Å²	139	79%	0.789	79%	0.791	S	S	*	*			cis	-162.7	167.5	8.1	-123.1	-37.4	0	0	0	112.7
528	S	23.2	Very low	25.8	Very low	105 Å²	105	137.9 Å²	137.9	73%	0.734	79%	0.791	S	S	*	*			trans	74.2	141.1	148.2	-157.3	0	0	0	0	123.1
529	T	30	Very low	25.9	Very low	136 Å²	136	137.5 Å²	137.5	83%	0.834	79%	0.788	S	S	*	*			trans	-68.1	159.6	157.2	45.5	0	0	0	0	113.1
530	G	22.6	Very low	26.1	Very low	83 Å²	83	140.5 Å²	140.5	86%	0.856	79%	0.792	S	S	*	*			trans	-161.1	139.1	165.7	0	0	0	0	0	112.7
531	S	26.3	Very low	25.1	Very low	120 Å²	120	138.6 Å²	138.6	84%	0.839	79%	0.793	S	S	*	*			trans	-115.6	166.3	171.3	58.9	0	0	0	0	110.6
532	A	23.3	Very low	25	Very low	101 Å²	101	138.3 Å²	138.3	84%	0.835	79%	0.79	S	S	*	*			trans	74.9	158.3	176	0	0	0	0	0	117.6
533	Q	29	Very low	24.8	Very low	175 Å²	175	138.2 Å²	138.2	82%	0.818	79%	0.787	S	S	*	*			trans	-80.5	164.5	-174.5	-53.2	138.7	-56	0	0	111.3
534	Y	23.1	Very low	25.1	Very low	224 Å²	224	140.3 Å²	140.3	88%	0.878	79%	0.793	S	S	*	*			trans	-157.5	142.1	133.5	-110.5	-73.1	0	0	0	114.3
535	H	22.6	Very low	25.2	Very low	158 Å²	158	136.7 Å²	136.7	73%	0.731	79%	0.79	S	S	*	*			trans	-53.4	158	-172.9	-62.6	-122.6	0	0	0	119.1
536	Q	25.3	Very low	24.9	Very low	190 Å²	190	137.8 Å²	137.8	89%	0.888	79%	0.79	S	S	*	*				-166.3	143	119.3	-109.2	177.6	16.5	0	0	116
537	A	25.2	Very low	25	Very low	82 Å²	82	138.9 Å²	138.9	68%	0.678	79%	0.791	S	S	*	*			trans	44.8	144.7	140	0	0	0	0	0	123.5
538	T	24	Very low	25.1	Very low	138 Å²	138	137.7 Å²	137.7	85%	0.847	79%	0.788	S	S	*	*			cis	-169.6	134.9	-12.7	23	0	0	0	0	111.3
539	S	24.6	Very low	25.1	Very low	112 Å²	112	139.6 Å²	139.6	78%	0.783	79%	0.789	S	S	*	*			trans	-172.7	136.8	133.6	62	0	0	0	0	113.7
540	T	24.7	Very low	24.8	Very low	134 Å²	134	139.1 Å²	139.1	82%	0.822	79%	0.786	S	S	*	*			trans	-15.3	147	158.4	52.7	0	0	0	0	118.7
541	G	24.5	Very low	24.7	Very low	73 Å²	73	142.6 Å²	142.6	75%	0.753	78%	0.784	S	S	*	*			cis	163.1	-170.2	7.7	0	0	0	0	0	110.1
542	I	27	Very low	25.1	Very low	142 Å²	142	141.9 Å²	141.9	73%	0.728	78%	0.777	S	S	*	*			cis	-166.9	139.6	-9.5	-131.7	170.8	0	0	0	112.6
543	K	25	Very low	25	Very low	188 Å²	188	142.5 Å²	142.5	82%	0.817	78%	0.775	S	S	*	*			trans	67.9	154.7	158	-66.8	-179.7	-178	-179.9	0	123.9
544	K	29.6	Very low	24.7	Very low	210 Å²	210	141.9 Å²	141.9	91%	0.913	78%	0.777	S	S	*	*			trans	81	133.8	170.7	-66.4	-171.8	177.1	-175.4	0	117
545	A	25.9	Very low	24.7	Very low	77 Å²	77	136.6 Å²	136.6	64%	0.636	77%	0.773	S	S	*	*			cis	-163.8	153	-11.9	0	0	0	0	0	111.7
546	N	24.4	Very low	24.8	Very low	131 Å²	131	135.6 Å²	135.6	70%	0.701	78%	0.778	S	S	*	*			trans	55.7	157.3	155.5	-67.2	41.9	0	0	0	118.5
547	E	22.2	Very low	25.4	Very low	157 Å²	157	131.1 Å²	131.1	73%	0.734	77%	0.765	S	S	*	*			cis	171.9	175.3	-14.4	-101.8	166	-179	0	0	104.6
548	H	24.6	Very low	25.4	Very low	155 Å²	155	135.5 Å²	135.5	72%	0.718	77%	0.772	S	S	*	*			cis	-166.1	145.8	-43.2	-136.1	-107.7	0	0	0	107.5
549	L	24	Very low	25.4	Very low	146 Å²	146	131.8 Å²	131.8	76%	0.764	76%	0.761	S	S	*	*			trans	65.3	164.1	162.7	-63.7	157.5	0	0	0	117.2
550	T	22.1	Very low	25.4	Very low	126 Å²	126	134 Å²	134	77%	0.773	76%	0.764	S	S	*	*			cis	-148.5	156.5	10.6	-22.1	0	0	0	0	112.9
551	L	20.9	Very low	25.5	Very low	155 Å²	155	131.4 Å²	131.4	81%	0.812	76%	0.756	S	S	*	*			trans	-85.7	-174	153.5	-84.5	157.4	0	0	0	109.4
552	P	34.9	Very low	25.5	Very low	105 Å²	105	135.5 Å²	135.5	68%	0.682	76%	0.761	S	S	*	*			cis	-139.9	-167.9	1.8	43.2	-23.8	0	0	0	116.2
553	S	21.8	Very low	25.5	Very low	114 Å²	114	134 Å²	134	80%	0.797	76%	0.762	S	S	*	*			trans	81.9	156.4	140.2	-69.3	0	0	0	0	123.8
554	N	22.6	Very low	25.6	Very low	163 Å²	163	134.1 Å²	134.1	87%	0.872	77%	0.766	S	S	*	*			trans	-99.9	151.3	-174.3	-42.4	-71.1	0	0	0	113.9
555	S	23.5	Very low	25.4	Very low	113 Å²	113	132.2 Å²	132.2	79%	0.79	76%	0.764	S	S	*	*			trans	-178.9	121.1	136.2	55.6	0	0	0	0	115.3
556	V	24.5	Very low	25.2	Very low	136 Å²	136	133.1 Å²	133.1	82%	0.824	77%	0.766	S	S	*	*				22.7	143.3	113.3	174.5	0	0	0	0	118.1
557	P	38.1	Very low	25.1	Very low	97 Å²	97	132.3 Å²	132.3	63%	0.63	77%	0.77	S	S	*	*			cis	-139.1	-172	20.2	33.5	-9.9	0	0	0	118.5
558	Q	23.9	Very low	25.3	Very low	173 Å²	173	133.2 Å²	133.2	81%	0.808	77%	0.774	S	S	*	*			trans	67.2	151.1	158.1	-98.6	130.9	-44	0	0	119.5
559	G	23.8	Very low	25.2	Very low	60 Å²	60	133 Å²	133	62%	0.619	78%	0.783	S	S	*	*			cis	109.4	108.6	11.5	0	0	0	0	0	109.3
560	D	25.8	Very low	25.2	Very low	160 Å²	160	130.6 Å²	130.6	86%	0.856	78%	0.784	S	S	*	*				-176.9	172.4	67.8	-84.4	-30	0	0	0	107.8
561	A	25.7	Very low	25.4	Very low	79 Å²	79	130.7 Å²	130.7	65%	0.653	79%	0.785	S	S	*	*			cis	-160.1	-179.7	-9.2	0	0	0	0	0	109.3
562	D	26.1	Very low	25.9	Very low	159 Å²	159	129.2 Å²	129.2	85%	0.85	79%	0.788	S	S	*	*			trans	61	127.8	164.9	-61.9	-26.4	0	0	0	119.7
563	S	26	Very low	25.6	Very low	109 Å²	109	128.1 Å²	128.1	76%	0.762	80%	0.795	S	S	*	*			cis	-151.1	141.7	-6.4	52.7	0	0	0	0	111.2
564	H	27.7	Very low	25.7	Very low	192 Å²	192	126.5 Å²	126.5	89%	0.889	80%	0.797	S	S	*	*			trans	-135.7	154.1	-178.6	-85.8	-85.8	0	0	0	109.8
565	L	24	Very low	25.9	Very low	169 Å²	169	127.2 Å²	127.2	89%	0.885	80%	0.795	S	S	*	*			trans	-155.2	141.1	142.4	-114.4	163.9	0	0	0	111.8
566	S	23.3	Very low	25.9	Very low	96 Å²	96	130.6 Å²	130.6	67%	0.671	80%	0.798	S	S	*	*			trans	-91.5	-179.4	175.9	58.6	0	0	0	0	109.5
567	C	20.9	Very low	25.8	Very low	115 Å²	115	127.3 Å²	127.3	78%	0.777	79%	0.792	S	S	*	*				-169.3	167.7	57.1	-130.6	0	0	0	0	113.7
568	H	26.9	Very low	25.2	Very low	176 Å²	176	129.9 Å²	129.9	82%	0.815	80%	0.799	S	S	*	*			trans	-77.8	157.5	163.1	-45.7	-98.4	0	0	0	110.9
569	T	22.8	Very low	25.2	Very low	149 Å²	149	128.5 Å²	128.5	91%	0.914	79%	0.794	S	S	*	*			trans	-143.2	156.1	140.7	-40.7	0	0	0	0	110.1
570	A	23.4	Very low	25.2	Very low	96 Å²	96	133.9 Å²	133.9	79%	0.793	80%	0.801	S	S	*	*			trans	-98	-163.7	-175	0	0	0	0	0	114
571	T	27.6	Very low	25.2	Very low	128 Å²	128	131.4 Å²	131.4	79%	0.785	79%	0.792	S	S	*	*			trans	-78.1	161.1	-166.2	44.6	0	0	0	0	117.3
572	S	31.1	Very low	25.2	Very low	125 Å²	125	135.1 Å²	135.1	87%	0.874	79%	0.793	S	S	*	*			trans	73.8	146.7	164.6	76.1	0	0	0	0	117.2
573	G	27.6	Very low	25.1	Very low	81 Å²	81	134.8 Å²	134.8	84%	0.835	79%	0.786	S	S	*	*			cis	174.3	141.3	-8.4	0	0	0	0	0	111.6
574	G	24.9	Very low	25	Very low	80 Å²	80	135.1 Å²	135.1	83%	0.825	79%	0.789	S	S	*	*			trans	-169.2	167.1	-175.4	0	0	0	0	0	113.7
575	Q	25.7	Very low	24.9	Very low	178 Å²	178	135.2 Å²	135.2	83%	0.832	79%	0.787	S	S	*	*			trans	-123.3	164.5	-166.9	-53.7	177.6	-74.4	0	0	114.6
576	Q	24.2	Very low	25.9	Very low	184 Å²	184	132.1 Å²	132.1	86%	0.86	78%	0.777	S	S	*	*			trans	75.4	149.9	153.8	-71.2	170.1	0.8	0	0	121
577	G	23.2	Very low	26	Very low	68 Å²	68	132.3 Å²	132.3	70%	0.701	78%	0.778	S	S	*	*			trans	84.4	103.8	174.3	0	0	0	0	0	114.5
578	I	25.2	Very low	26.3	Very low	151 Å²	151	135.6 Å²	135.6	77%	0.774	78%	0.779	S	S	*	*			cis	81.8	123.6	30.7	-55.5	-179.2	0	0	0	115
579	M	22.5	Very low	26.2	Very low	144 Å²	144	134.5 Å²	134.5	71%	0.709	78%	0.78	S	S	*	*			trans	71.3	147.6	170	-80.7	143.7	40.5	0	0	117.4
580	F	24.7	Very low	26.4	Very low	172 Å²	172	138.6 Å²	138.6	75%	0.754	78%	0.778	S	S	*	*			cis	-143.4	172.2	7.8	-119.4	-44	0	0	0	114.4
581	T	25.9	Very low	26.5	Very low	109 Å²	109	138.8 Å²	138.8	67%	0.669	77%	0.774	S	S	*	*			trans	-56.9	169.8	178.4	50.4	0	0	0	0	116.1
582	K	25.3	Very low	26.4	Very low	156 Å²	156	139.6 Å²	139.6	68%	0.678	77%	0.773	S	S	*	*				-176.9	155.5	66.6	-127.6	-178.3	-177.8	-121.7	0	115.1
583	E	24.6	Very low	26.2	Very low	152 Å²	152	139.8 Å²	139.8	71%	0.71	77%	0.768	S	S	*	*			trans	41.2	148.6	138.6	-80.2	158.7	-153	0	0	122.4
584	S	24	Very low	26.9	Very low	116 Å²	116	140.7 Å²	140.7	81%	0.811	76%	0.759	S	S	*	*			cis	-162.1	-162.2	4.9	56.6	0	0	0	0	114.1
585	K	24.2	Very low	27	Very low	194 Å²	194	145.3 Å²	145.3	84%	0.843	76%	0.759	S	S	*	*			trans	-98.1	-170.2	-168.5	-78.2	179.7	177.1	174.3	0	113
586	P	44.9	Very low	27.1	Very low	104 Å²	104	142.5 Å²	142.5	68%	0.675	76%	0.755	S	S	*	*				-145.1	-178.8	-54.9	43.4	-26.4	0	0	0	116.9
587	S	26.4	Very low	27.2	Very low	101 Å²	101	137.8 Å²	137.8	71%	0.706	74%	0.742	S	S	*	*			trans	85.4	164	136.7	79.8	0	0	0	0	124.5
588	K	26.4	Very low	27.4	Very low	183 Å²	183	145 Å²	145	80%	0.796	75%	0.748	S	S	*	*			trans	79.6	147.4	170.6	-64.7	-174.9	-179.8	177	0	117.2
589	N	25.3	Very low	27.5	Very low	154 Å²	154	144.9 Å²	144.9	82%	0.824	74%	0.744	S	S	*	*			cis	-153.1	177.6	-4.5	-125.3	7.6	0	0	0	113.7
590	R	27.1	Very low	27.6	Very low	235 Å²	235	144.9 Å²	144.9	89%	0.887	75%	0.752	S	S	*	*			trans	-135.1	152.4	179	-177.4	-174.8	-176.6	-154.8	3.4	112.2
591	S	25.3	Very low	27.6	Very low	100 Å²	100	139.8 Å²	139.8	70%	0.699	75%	0.748	S	S	*	*			trans	-138.2	-162.3	178.1	-159.5	0	0	0	0	114.6
592	L	25.1	Very low	27.6	Very low	145 Å²	145	142.9 Å²	142.9	76%	0.759	76%	0.76	S	S	*	*			trans	-107.9	172.3	-160.1	-85.5	56.4	0	0	0	112.4
593	V	28.6	Very low	27.6	Very low	129 Å²	129	141.4 Å²	141.4	78%	0.782	77%	0.765	S	S	*	*			cis	76.1	137.2	32.1	-177.4	0	0	0	0	110.6
594	P	42.1	Very low	27.6	Very low	100 Å²	100	139.6 Å²	139.6	65%	0.649	77%	0.769	S	S	*	*			cis	-141.7	175.6	36.9	45.8	-27.5	0	0	0	119.5
595	E	26.6	Very low	27.7	Very low	176 Å²	176	142.2 Å²	142.2	82%	0.822	77%	0.774	S	S	*	*			trans	51.1	166.3	137.7	-71.7	174.4	-174.3	0	0	122.7
596	T	26.9	Very low	27.7	Very low	120 Å²	120	137 Å²	137	74%	0.736	78%	0.775	S	S	*	*			cis	-162.7	-175.5	-7.7	25	0	0	0	0	108
597	S	27.1	Very low	26.7	Very low	85 Å²	85	138.3 Å²	138.3	59%	0.594	79%	0.785	S	S	*	*				-170.8	167.2	-51	70.2	0	0	0	0	111.2
598	R	27.4	Very low	26.6	Very low	219 Å²	219	138.1 Å²	138.1	83%	0.826	79%	0.79	S	S	*	*			trans	69.6	162.6	166	-65.9	170.5	179	175.9	1	116.9
599	H	27.2	Very low	26.5	Very low	148 Å²	148	136.8 Å²	136.8	69%	0.685	79%	0.791	S	S	*	*			cis	-160.9	160.7	-9.5	-113.8	-44.9	0	0	0	110.3
600	T	24.7	Very low	26.5	Very low	145 Å²	145	135.8 Å²	135.8	89%	0.89	79%	0.79	S	S	*	*			trans	59.2	157.6	157.7	47.7	0	0	0	0	119.5
601	G	24.1	Very low	26.4	Very low	65 Å²	65	134 Å²	134	67%	0.67	79%	0.789	S	S	*	*			cis	175.4	169.8	-5.7	0	0	0	0	0	113.2
602	D	26	Very low	26.3	Very low	173 Å²	173	133 Å²	133	93%	0.925	80%	0.795	S	S	*	*			trans	65.7	173.1	164.5	-69.8	-32.5	0	0	0	122.6
603	T	25.1	Very low	26.3	Very low	126 Å²	126	134.2 Å²	134.2	77%	0.773	80%	0.802	S	S	*	*			trans	-132.7	145.4	-149.8	-37.7	0	0	0	0	111.6
604	S	25.4	Very low	26	Very low	113 Å²	113	132 Å²	132	79%	0.79	79%	0.792	S	S	*	*				160.3	168.3	128.7	57.7	0	0	0	0	115.4
605	N	26.4	Very low	25.3	Very low	171 Å²	171	133.6 Å²	133.6	91%	0.914	80%	0.795	S	S	*	*			trans	-55.3	150	-172.6	-49.2	-39.3	0	0	0	116.6
606	G	24.1	Very low	25.3	Very low	84 Å²	84	133.2 Å²	133.2	87%	0.866	79%	0.793	S	S	*	*			trans	179.1	132.7	160.9	0	0	0	0	0	112.6
607	C	23.3	Very low	25.1	Very low	133 Å²	133	134 Å²	134	90%	0.899	80%	0.797	S	S	*	*			trans	-121.7	124.5	-177.2	177.9	0	0	0	0	111.5
608	A	24.4	Very low	25	Very low	97 Å²	97	137.3 Å²	137.3	80%	0.802	80%	0.803	S	S	*	*			trans	-164.6	149	160.3	0	0	0	0	0	111
609	D	24.1	Very low	24.8	Very low	154 Å²	154	134.7 Å²	134.7	82%	0.824	80%	0.8	S	S	*	*			trans	-74.5	160.1	176.4	-60	-93.7	0	0	0	114
610	V	25.3	Very low	24.6	Very low	133 Å²	133	134 Å²	134	81%	0.806	80%	0.801	S	S	*	*				-175	141.4	114	145.1	0	0	0	0	112.9
611	K	24.7	Very low	24.5	Very low	197 Å²	197	133.7 Å²	133.7	86%	0.857	79%	0.792	S	S	*	*			trans	-3.1	130.7	163.9	-55.3	171.1	-177.7	173.9	0	119.3
612	G	24.4	Very low	24.5	Very low	81 Å²	81	135.2 Å²	135.2	84%	0.835	80%	0.799	S	S	*	*			trans	-137.3	134.6	149.6	0	0	0	0	0	109.8
613	L	23.4	Very low	24.3	Very low	170 Å²	170	134.1 Å²	134.1	89%	0.89	79%	0.792	S	S	*	*			trans	-127.2	153.2	-171.3	-127.8	152.1	0	0	0	111.5
614	S	23.9	Very low	24.2	Very low	82 Å²	82	132.3 Å²	132.3	57%	0.573	79%	0.791	S	S	*	*			trans	-66.2	148.9	-176.2	176.7	0	0	0	0	114
615	N	26.3	Very low	23.9	Very low	133 Å²	133	133.4 Å²	133.4	71%	0.711	79%	0.792	S	S	*	*				179.7	135	111.9	-85.6	-15.3	0	0	0	116.3
616	H	26.7	Very low	23.7	Very low	168 Å²	168	130.6 Å²	130.6	78%	0.778	79%	0.786	S	S	*	*			trans	25.6	155.8	144.4	-60.5	-67.6	0	0	0	125.2
617	V	23.7	Very low	23.6	Very low	138 Å²	138	132.2 Å²	132.2	84%	0.836	78%	0.784	S	S	*	*			trans	159.4	134.6	131.5	154.8	0	0	0	0	107.5
618	H	23.8	Very low	25	Very low	153 Å²	153	131.1 Å²	131.1	71%	0.708	78%	0.775	S	S	*	*			cis	-152.5	-163.1	7.7	-157.5	27.3	0	0	0	112.5
619	Q	23.6	Very low	24.8	Very low	164 Å²	164	134.3 Å²	134.3	77%	0.766	78%	0.779	S	S	*	*			trans	75.4	124.6	153.1	-93	175.4	-13.7	0	0	120.9
620	L	22.9	Very low	24.8	Very low	135 Å²	135	135.7 Å²	135.7	71%	0.707	78%	0.78	S	S	*	*			cis	-158.3	158.6	-18.4	-124.6	-178.7	0	0	0	109.9
621	I	23.7	Very low	24.7	Very low	138 Å²	138	132.5 Å²	132.5	71%	0.708	77%	0.774	S	S	*	*			trans	-131	155	170.9	-70.4	176.5	0	0	0	108.4
622	A	22.1	Very low	24.6	Very low	97 Å²	97	130.6 Å²	130.6	80%	0.802	77%	0.773	S	S	*	*			trans	-138	152.2	161.2	0	0	0	0	0	109.7
623	D	22.8	Very low	24.6	Very low	149 Å²	149	131.5 Å²	131.5	80%	0.797	77%	0.767	S	S	*	*			trans	-114.4	-169.7	-151.5	-60.2	-75	0	0	0	116.3
624	A	22.5	Very low	25.1	Very low	89 Å²	89	129.2 Å²	129.2	74%	0.736	76%	0.762	S	S	*	*			trans	91.9	110.9	166.9	0	0	0	0	0	116.9
625	V	20.3	Very low	25.1	Very low	136 Å²	136	132 Å²	132	82%	0.824	77%	0.771	S	S	*	*				77.8	111.9	61.7	172.1	0	0	0	0	111.5
626	S	21.6	Very low	25	Very low	112 Å²	112	131.9 Å²	131.9	78%	0.783	77%	0.769	S	S	*	*				-168.7	-178.1	76.3	36	0	0	0	0	113.5
627	S	22.9	Very low	24.8	Very low	117 Å²	117	130.5 Å²	130.5	82%	0.818	77%	0.767	S	S	*	*			trans	-110.2	-146.4	-158.1	-50.6	0	0	0	0	115.1
628	P	50.9	Low	24.7	Very low	110 Å²	110	131.1 Å²	131.1	71%	0.714	76%	0.764	S	S	*	*				-120.5	-173.1	-127.9	39.6	-20.1	0	0	0	115
629	N	22.2	Very low	24.7	Very low	164 Å²	164	127.6 Å²	127.6	88%	0.877	76%	0.761	S	S	*	*			trans	-156.5	169.9	150.5	-115.8	-39.8	0	0	0	115.3
630	H	24	Very low	24.6	Very low	183 Å²	183	128 Å²	128	85%	0.847	77%	0.768	S	S	*	*			trans	-107	167.8	-158.4	-94.1	-106.7	0	0	0	116.6
631	G	22.4	Very low	24.7	Very low	66 Å²	66	128 Å²	128	68%	0.68	77%	0.769	S	S	*	*			trans	129.6	134.9	150.5	0	0	0	0	0	115.3
632	D	22.3	Very low	25.4	Very low	158 Å²	158	126.2 Å²	126.2	85%	0.845	77%	0.767	S	S	*	*			cis	-160.1	172	-16.9	-129.1	-39.5	0	0	0	111.8
633	S	24.4	Very low	25.5	Very low	100 Å²	100	129.6 Å²	129.6	70%	0.699	77%	0.766	S	S	*	*			trans	-95.6	164.6	171.9	-56.5	0	0	0	0	111.6
634	P	33.3	Very low	25.5	Very low	122 Å²	122	129.7 Å²	129.7	79%	0.792	77%	0.765	S	S	*	*				-156.8	127.9	89.2	36.6	-15.1	0	0	0	118.5
635	N	24.7	Very low	25.6	Very low	141 Å²	141	130.1 Å²	130.1	75%	0.754	76%	0.763	S	S	*	*				59.5	152.8	101.2	-137	1.6	0	0	0	123.6
636	L	23.5	Very low	25.8	Very low	130 Å²	130	128.4 Å²	128.4	68%	0.681	76%	0.763	S	S	*	*			trans	87.8	111.9	150.1	-63.4	174.7	0	0	0	124.2
637	L	23.1	Very low	26	Very low	138 Å²	138	130 Å²	130	72%	0.723	76%	0.762	S	S	*	*				121.6	143.5	105.9	-87.5	170.9	0	0	0	123
638	I	22.1	Very low	26.1	Very low	152 Å²	152	131.7 Å²	131.7	78%	0.779	76%	0.761	S	S	*	*			trans	77.3	143	154.3	-71.6	154.8	0	0	0	118.4
639	A	22.7	Very low	24.8	Very low	79 Å²	79	134.4 Å²	134.4	65%	0.653	77%	0.768	S	S	*	*			trans	-124.2	166	177.7	0	0	0	0	0	109.4
640	D	22.4	Very low	24.9	Very low	171 Å²	171	129.7 Å²	129.7	91%	0.914	76%	0.758	S	S	*	*				-162.6	162.3	128	-106.3	-27.6	0	0	0	112.2
641	N	24.1	Very low	25	Very low	137 Å²	137	131 Å²	131	73%	0.733	76%	0.761	S	S	*	*			trans	-148.2	144.4	-178.6	-172.3	0.8	0	0	0	106.2
642	P	38.9	Very low	25.1	Very low	100 Å²	100	132 Å²	132	65%	0.649	76%	0.763	S	S	*	*				-155.1	147.7	111	35.7	-17	0	0	0	117.6
643	Q	24.7	Very low	25.3	Very low	167 Å²	167	132.6 Å²	132.6	78%	0.78	77%	0.766	S	S	*	*			trans	70.2	159.6	135.7	-68.9	170	14.8	0	0	118.9
644	L	22.8	Very low	25.3	Very low	151 Å²	151	131 Å²	131	79%	0.791	77%	0.767	S	S	*	*			cis	-140.8	164.4	-0.1	-133.7	152.9	0	0	0	110.7
645	S	23.9	Very low	24.9	Very low	99 Å²	99	132.8 Å²	132.8	69%	0.692	77%	0.769	S	S	*	*			trans	-114.5	151	-171.2	50.7	0	0	0	0	114
646	A	24.5	Very low	25	Very low	100 Å²	100	132.7 Å²	132.7	83%	0.826	77%	0.774	S	S	*	*			trans	176.8	172.9	147.2	0	0	0	0	0	112.7
647	L	25.2	Very low	25	Very low	144 Å²	144	129.3 Å²	129.3	75%	0.754	77%	0.77	S	S	*	*				-163.2	120.7	-69.1	-148.8	82.4	0	0	0	112.3
648	L	25.9	Very low	24.9	Very low	153 Å²	153	130.3 Å²	130.3	80%	0.801	78%	0.782	S	S	*	*			trans	56.5	173.4	151.2	-71.3	171.8	0	0	0	122.8
649	I	24.1	Very low	25	Very low	168 Å²	168	126 Å²	126	86%	0.862	78%	0.775	S	S	*	*			trans	74.6	127.3	164.1	-42.6	-176.8	0	0	0	116
650	G	24.1	Very low	25.2	Very low	65 Å²	65	128.6 Å²	128.6	67%	0.67	78%	0.783	S	S	*	*			cis	143.1	139.2	10.6	0	0	0	0	0	111.7
651	K	25.2	Very low	25.5	Very low	209 Å²	209	125.5 Å²	125.5	91%	0.909	77%	0.773	S	S	*	*			trans	63.3	111.9	156.1	-71.6	-174.9	174.5	-179.4	0	123.1
652	A	25.7	Very low	25.7	Very low	87 Å²	87	124.5 Å²	124.5	72%	0.719	77%	0.768	S	S	*	*				84	159.2	111.8	0	0	0	0	0	123
653	N	25.2	Very low	25.6	Very low	171 Å²	171	127.4 Å²	127.4	91%	0.914	77%	0.77	S	S	*	*			trans	70.4	155.2	173	-65.1	-1.9	0	0	0	118.2
654	G	25.4	Very low	25.8	Very low	68 Å²	68	125.1 Å²	125.1	70%	0.701	77%	0.768	S	S	*	*			trans	-173.6	164.6	173.8	0	0	0	0	0	111.2
655	N	25.4	Very low	26.1	Very low	159 Å²	159	124.4 Å²	124.4	85%	0.85	77%	0.765	S	S	*	*			trans	-168	142.4	165.2	-116.5	-10.5	0	0	0	112.6
656	V	25.2	Very low	26.4	Very low	139 Å²	139	125.7 Å²	125.7	84%	0.842	76%	0.764	S	S	*	*			trans	37.9	126.1	143.2	-176.4	0	0	0	0	121.2
657	G	23.6	Very low	26.4	Very low	59 Å²	59	127.6 Å²	127.6	61%	0.608	76%	0.759	S	S	*	*			trans	149.6	113.9	137	0	0	0	0	0	119.8
658	T	22.8	Very low	26.4	Very low	158 Å²	158	128.6 Å²	128.6	97%	0.969	76%	0.759	S	S	*	*			trans	58.7	155.2	154.3	52.2	0	0	0	0	120.3
659	G	24.1	Very low	27.6	Very low	61 Å²	61	126.6 Å²	126.6	63%	0.629	76%	0.755	S	S	*	*			cis	168.4	125	-12.7	0	0	0	0	0	116
660	T	27.1	Very low	27.8	Very low	134 Å²	134	122.6 Å²	122.6	82%	0.822	75%	0.747	S	S	*	*			trans	65.2	136.8	150.2	46.8	0	0	0	0	125.3
661	C	28.2	Very low	28	Very low	106 Å²	106	125.5 Å²	125.5	72%	0.716	75%	0.752	S	S	*	*			trans	72.3	151.9	143.8	-70	0	0	0	0	119.7
662	D	27.6	Very low	28.1	Very low	117 Å²	117	123.1 Å²	123.1	63%	0.626	74%	0.743	S	S	*	*			cis	-166.5	172.7	-3.3	-108.9	3.9	0	0	0	107.7
663	K	36.8	Very low	28	Very low	160 Å²	160	123.4 Å²	123.4	70%	0.696	74%	0.737	S	S	*	*			cis	168.2	-168.1	-13.1	-178.3	163.5	167.8	178.7	0	109.1
664	V	28.7	Very low	28	Very low	120 Å²	120	123.9 Å²	123.9	73%	0.727	73%	0.73	S	S	*	*			trans	74.6	149.1	166.4	-174.2	0	0	0	0	113
665	N	28.7	Very low	28.1	Very low	136 Å²	136	125 Å²	125	73%	0.727	72%	0.724	S	S	*	*			cis	-148.4	179.2	8.2	-127.7	-13	0	0	0	107.4
666	N	30	Very low	28	Very low	125 Å²	125	123.8 Å²	123.8	67%	0.668	72%	0.717	S	S	*	*			cis	-165.7	-176.5	-22.3	-142.9	-10.1	0	0	0	105.7
667	I	26.1	Very low	28	Very low	141 Å²	141	125 Å²	125	72%	0.723	71%	0.714	S	S	*	*			cis	-154.4	170.7	-4.7	-162.6	165.1	0	0	0	108.1
668	H	25	Very low	28.1	Very low	165 Å²	165	126.6 Å²	126.6	76%	0.764	72%	0.716	S	S	*	*			trans	-144.1	155.1	170.8	-134.9	-15	0	0	0	110.3
669	P	50.9	Low	28.2	Very low	111 Å²	111	125.8 Å²	125.8	72%	0.721	71%	0.71	S	S	*	*				-133.5	-155.5	76.3	33.3	-12.5	0	0	0	110.7
670	A	28.7	Very low	28.3	Very low	84 Å²	84	127.1 Å²	127.1	69%	0.694	72%	0.715	S	S	*	*			cis	-165.9	-176.7	17.5	0	0	0	0	0	108.5
671	V	28.1	Very low	28.3	Very low	125 Å²	125	126 Å²	126	76%	0.758	71%	0.713	S	S	*	*			cis	177.4	147.8	-20.4	139.7	0	0	0	0	104.3
672	H	25.9	Very low	28.4	Very low	159 Å²	159	125.9 Å²	125.9	74%	0.736	71%	0.713	S	S	*	*			cis	-149.1	-152.2	22.6	-153.1	23.8	0	0	0	113.2
673	T	24.4	Very low	29.3	Very low	94 Å²	94	125.8 Å²	125.8	58%	0.577	72%	0.719	S	S	*	*			trans	-33.3	160.2	153.6	53	0	0	0	0	115.9
674	K	26.1	Very low	28.6	Very low	180 Å²	180	123.2 Å²	123.2	78%	0.783	72%	0.721	S	S	*	*			cis	-178.6	179.7	1.6	-105.8	-171.2	161.4	-165.7	0	105.7
675	T	26.6	Very low	28.7	Very low	92 Å²	92	123.2 Å²	123.2	56%	0.564	73%	0.726	S	S	*	*			cis	-175.7	144.3	-20.6	32.9	0	0	0	0	104.1
676	D	24.4	Very low	28.6	Very low	133 Å²	133	121.4 Å²	121.4	71%	0.711	73%	0.73	S	S	*	*			cis	-149.2	-173.3	-6.4	-82.1	-30.2	0	0	0	105.8
677	H	25	Very low	28.3	Very low	165 Å²	165	123.1 Å²	123.1	76%	0.764	74%	0.738	S	S	*	*			cis	-148.6	144.3	32.3	-98.4	-96.3	0	0	0	109.6
678	S	25.7	Very low	28.2	Very low	93 Å²	93	121.4 Å²	121.4	65%	0.65	74%	0.738	S	S	*	*				59	108.5	85.7	106.7	0	0	0	0	114.5
679	V	24.7	Very low	28.1	Very low	140 Å²	140	120.3 Å²	120.3	85%	0.848	74%	0.743	S	S	*	*			cis	-144.7	137.2	7.7	177.9	0	0	0	0	111.6
680	A	25	Very low	26.7	Very low	89 Å²	89	119.7 Å²	119.7	74%	0.736	75%	0.747	S	S	*	*			trans	-120.6	178.9	159.1	0	0	0	0	0	107.5
681	S	27.3	Very low	26.8	Very low	111 Å²	111	122 Å²	122	78%	0.776	75%	0.753	S	S	*	*			cis	-164.7	-171.7	18.6	56.3	0	0	0	0	110.8
682	S	30.6	Very low	26.7	Very low	103 Å²	103	121.9 Å²	121.9	72%	0.72	76%	0.755	S	S	*	*			trans	-57.3	-177.9	157.5	-34.5	0	0	0	0	113
683	P	45.8	Very low	26.8	Very low	115 Å²	115	119.3 Å²	119.3	75%	0.747	76%	0.755	S	S	*	*			cis	-146.3	-176.5	8.2	44.1	-23.3	0	0	0	118.7
684	S	23.9	Very low	27.5	Very low	106 Å²	106	120.1 Å²	120.1	74%	0.741	76%	0.762	S	S	*	*			trans	35.2	116.9	144.5	-56.2	0	0	0	0	125.5
685	S	30.2	Very low	27.4	Very low	121 Å²	121	120.4 Å²	120.4	85%	0.846	76%	0.763	S	S	*	*				68.3	112.8	123.6	-53.6	0	0	0	0	124.2
686	A	26.2	Very low	27.3	Very low	98 Å²	98	121 Å²	121	81%	0.81	77%	0.771	S	S	*	*			trans	-168.2	111	140.3	0	0	0	0	0	116.5
687	I	24.1	Very low	27.3	Very low	161 Å²	161	120.7 Å²	120.7	83%	0.826	77%	0.774	S	S	*	*				44.8	107.8	128.1	-62	177.7	0	0	0	122.1
688	S	24.5	Very low	27.2	Very low	104 Å²	104	120.1 Å²	120.1	73%	0.727	77%	0.772	S	S	*	*				78.6	151.7	129.9	-65.5	0	0	0	0	127
689	T	22.5	Very low	27.2	Very low	143 Å²	143	123.2 Å²	123.2	88%	0.877	78%	0.776	S	S	*	*			trans	95.7	153.2	143.4	18.8	0	0	0	0	122.5
690	A	22.1	Very low	27.1	Very low	97 Å²	97	128 Å²	128	80%	0.802	78%	0.779	S	S	*	*			trans	80.2	98.1	173.1	0	0	0	0	0	119.4
691	T	30.4	Very low	27	Very low	132 Å²	132	128.8 Å²	128.8	81%	0.81	78%	0.779	S	S	*	*			trans	-68.5	152.3	148.6	32.2	0	0	0	0	110.5
692	P	25.4	Very low	26.8	Very low	124 Å²	124	130.4 Å²	130.4	81%	0.805	78%	0.777	S	S	*	*				-147.5	144.7	93.8	38.8	-22.3	0	0	0	116.4
693	S	28.1	Very low	26.5	Very low	105 Å²	105	132.6 Å²	132.6	73%	0.734	78%	0.781	S	S	*	*			trans	-69.3	169.4	153.2	-27.6	0	0	0	0	109.6
694	P	40	Very low	25.4	Very low	111 Å²	111	132.4 Å²	132.4	72%	0.721	78%	0.782	S	S	*	*			cis	-155.7	-157.6	43.2	36.7	-9.8	0	0	0	116.4
695	K	22.7	Very low	25.3	Very low	185 Å²	185	133.3 Å²	133.3	80%	0.804	78%	0.783	S	S	*	*			trans	86.2	122.1	166.4	-53.4	-176.2	-176.9	-179.1	0	116.3
696	S	25.3	Very low	25	Very low	105 Å²	105	133 Å²	133	73%	0.734	78%	0.776	S	S	*	*			cis	83	105.8	7.6	96.6	0	0	0	0	119.2
697	T	23.9	Very low	24.8	Very low	126 Å²	126	132.6 Å²	132.6	77%	0.773	77%	0.767	S	S	*	*			trans	-171.9	143.8	155.7	27.3	0	0	0	0	107.5
698	E	24	Very low	24.7	Very low	154 Å²	154	132.1 Å²	132.1	72%	0.72	77%	0.766	S	S	*	*			cis	-156.9	141.6	-9.9	-142.4	158.3	-151	0	0	113.2
699	Q	24.1	Very low	24.7	Very low	157 Å²	157	133.1 Å²	133.1	73%	0.734	76%	0.763	S	S	*	*			trans	18.6	138.2	141.9	-54.2	174.1	23.7	0	0	120
700	R	23.4	Very low	25	Very low	241 Å²	241	130.3 Å²	130.3	91%	0.909	75%	0.749	S	S	*	*				-150.1	153.4	71.6	-94.7	-179.8	174.5	-178	-1.4	115.5
701	S	22.6	Very low	25.5	Very low	105 Å²	105	131.4 Å²	131.4	73%	0.734	75%	0.748	S	S	*	*			trans	-104.5	164.6	171.5	168.9	0	0	0	0	109.7
702	I	23.4	Very low	25.3	Very low	146 Å²	146	132.5 Å²	132.5	75%	0.749	74%	0.744	S	S	*	*			trans	-175.6	148	130.4	-99.3	159.5	0	0	0	113.7
703	N	23.4	Very low	25.3	Very low	148 Å²	148	132.4 Å²	132.4	79%	0.791	75%	0.746	S	S	*	*			trans	72.9	113.8	164	-73.4	-8.2	0	0	0	122.7
704	S	22.5	Very low	25.2	Very low	111 Å²	111	130.7 Å²	130.7	78%	0.776	75%	0.745	S	S	*	*			trans	-91.9	143.9	152.4	52.9	0	0	0	0	112.2
705	V	23	Very low	24.5	Very low	125 Å²	125	132.8 Å²	132.8	76%	0.758	75%	0.749	S	S	*	*			trans	-146.7	114	153.5	-157.8	0	0	0	0	106.8
706	T	22.7	Very low	24.6	Very low	115 Å²	115	132 Å²	132	71%	0.706	75%	0.748	S	S	*	*				41.4	104.5	96	11.1	0	0	0	0	113.6
707	S	22.8	Very low	24.7	Very low	89 Å²	89	134 Å²	134	62%	0.622	76%	0.756	S	S	*	*				92.6	161.1	89.8	67.3	0	0	0	0	114.8
708	L	22.1	Very low	24.8	Very low	151 Å²	151	133.2 Å²	133.2	79%	0.791	75%	0.751	S	S	*	*			trans	73.9	150.2	173.9	-51.8	167.1	0	0	0	114
709	N	24.4	Very low	24.8	Very low	125 Å²	125	133.6 Å²	133.6	67%	0.668	76%	0.758	S	S	*	*			cis	-147.6	160.1	1.9	-136.4	-8.3	0	0	0	113.5
710	S	29.5	Very low	25	Very low	84 Å²	84	129.6 Å²	129.6	59%	0.587	76%	0.759	S	S	*	*			trans	-87.2	173.1	167.7	-50.3	0	0	0	0	111.7
711	P	31.9	Very low	25.2	Very low	120 Å²	120	128 Å²	128	78%	0.779	76%	0.762	S	S	*	*				-104.8	129.6	127.4	-9.8	28.2	0	0	0	108.9
712	H	26.5	Very low	25.3	Very low	156 Å²	156	126.5 Å²	126.5	72%	0.722	76%	0.763	S	S	*	*				58.1	125.7	61.2	-58	-59.8	0	0	0	111.9
713	S	25.6	Very low	25.5	Very low	121 Å²	121	128.1 Å²	128.1	85%	0.846	77%	0.772	S	S	*	*			cis	-161.2	164.7	3.2	45.9	0	0	0	0	109.9
714	G	26	Very low	25.7	Very low	70 Å²	70	124.2 Å²	124.2	72%	0.722	77%	0.767	S	S	*	*			cis	-167.9	-156.6	9.7	0	0	0	0	0	114.2
715	L	24	Very low	25.8	Very low	154 Å²	154	128.2 Å²	128.2	81%	0.806	77%	0.77	S	S	*	*			trans	-69	156	-171.8	-74.9	62.7	0	0	0	112.9
716	H	26.1	Very low	26.1	Very low	170 Å²	170	127.4 Å²	127.4	79%	0.787	77%	0.77	S	S	*	*				-168.9	109.8	108.6	-94.7	-65.2	0	0	0	112	V718	H716-V718 VanDerWaalsContact ND1-CG2 3.28Å; H716-V718 WeakPolarHBondContact ND1-CG2 3.49Å
717	T	26.8	Very low	26.4	Very low	145 Å²	145	130.9 Å²	130.9	89%	0.89	78%	0.778	S	S	*	*			trans	-114.4	133.5	141.7	38.3	0	0	0	0	107
718	V	25.3	Very low	26.6	Very low	110 Å²	110	131 Å²	131	67%	0.667	78%	0.779	S	S	*	*			trans	-134	122.3	-177.1	174.2	0	0	0	0	107.3	H716	H716-V718 VanDerWaalsContact ND1-CG2 3.28Å; H716-V718 WeakPolarHBondContact ND1-CG2 3.49Å
719	N	25	Very low	26.7	Very low	162 Å²	162	128.8 Å²	128.8	87%	0.866	78%	0.776	S	S	*	*			trans	-70.4	137.5	166.2	-74.1	-20.7	0	0	0	108.6
720	G	27.8	Very low	26.8	Very low	74 Å²	74	128.6 Å²	128.6	76%	0.763	78%	0.78	S	S	*	*			trans	-78.1	172.9	174.9	0	0	0	0	0	113
721	E	26.9	Very low	26.6	Very low	208 Å²	208	133.5 Å²	133.5	97%	0.972	79%	0.791	S	S	*	*			trans	-152.1	150.6	170.9	-130.9	177.2	-147.3	0	0	109.3
722	G	26.6	Very low	26.3	Very low	73 Å²	73	132.8 Å²	132.8	75%	0.753	78%	0.784	S	S	*	*			trans	154.9	75.9	177.7	0	0	0	0	0	116.8
723	L	26.5	Very low	26.2	Very low	179 Å²	179	132.4 Å²	132.4	94%	0.937	79%	0.787	S	S	*	*			trans	80.7	113.1	165.4	-151.5	76.2	0	0	0	117.4
724	G	27.1	Very low	26	Very low	66 Å²	66	134.7 Å²	134.7	68%	0.68	79%	0.789	S	S	*	*			cis	165.6	175.6	-12.7	0	0	0	0	0	115.7
725	K	26.2	Very low	26.2	Very low	196 Å²	196	137.2 Å²	137.2	85%	0.852	79%	0.792	S	S	*	*			trans	71.2	101.5	165.1	-59.1	-174	177.7	-177.8	0	119.3
726	S	28.8	Very low	26.2	Very low	108 Å²	108	138.1 Å²	138.1	76%	0.755	80%	0.797	S	S	*	*				151.2	125.6	103.6	-76.3	0	0	0	0	115
727	Q	27.7	Very low	26.2	Very low	188 Å²	188	133.5 Å²	133.5	88%	0.879	79%	0.789	S	S	*	*			trans	33.1	142.2	141.2	-64.9	177.5	-11.1	0	0	121.6
728	S	27	Very low	26.1	Very low	90 Å²	90	131.7 Å²	131.7	63%	0.629	78%	0.782	S	S	*	*			cis	-179	148.6	-6.9	47.2	0	0	0	0	111.6
729	S	25.8	Very low	26.2	Very low	105 Å²	105	134 Å²	134	73%	0.734	79%	0.785	S	S	*	*			trans	59.5	152.5	155.8	50.9	0	0	0	0	119
730	T	25.3	Very low	26.2	Very low	122 Å²	122	137.2 Å²	137.2	75%	0.748	79%	0.785	S	S	*	*			cis	-161.6	132.6	-2.8	12.1	0	0	0	0	107
731	K	25.2	Very low	26	Very low	187 Å²	187	139 Å²	139	81%	0.813	79%	0.785	S	S	*	*				84.8	150	92.8	-161.7	-166	177.7	-171.8	0	115.7
732	V	26.5	Very low	25.8	Very low	105 Å²	105	135.6 Å²	135.6	64%	0.636	78%	0.779	S	S	*	*			trans	99	96.2	163.4	-170.6	0	0	0	0	117.6
733	D	24.1	Very low	25.8	Very low	147 Å²	147	137.9 Å²	137.9	79%	0.786	78%	0.784	S	S	*	*				46.1	140.7	123.6	-43.1	-29.3	0	0	0	123.2
734	L	21.1	Very low	26	Very low	170 Å²	170	137.9 Å²	137.9	89%	0.89	78%	0.779	S	S	*	*			trans	-141	116.9	174.1	-129.4	172.7	0	0	0	110
735	P	31.4	Very low	26.2	Very low	122 Å²	122	142.9 Å²	142.9	79%	0.792	79%	0.788	S	S	*	*			trans	-89.7	177.3	179	34.8	-35	0	0	0	114.1
736	L	23.5	Very low	26.2	Very low	173 Å²	173	139.9 Å²	139.9	91%	0.906	78%	0.781	S	S	*	*			trans	-92.1	156.4	-165.2	-168.2	72.1	0	0	0	114.5
737	A	25.1	Very low	26.5	Very low	74 Å²	74	140 Å²	140	61%	0.612	78%	0.779	S	S	*	*			trans	115.2	127.7	134.2	0	0	0	0	0	120.8
738	S	24.6	Very low	26.7	Very low	106 Å²	106	137 Å²	137	74%	0.741	78%	0.779	S	S	*	*			trans	71.6	150.2	143.6	79.4	0	0	0	0	119.5
739	H	27.6	Very low	27.2	Very low	160 Å²	160	140.2 Å²	140.2	74%	0.741	79%	0.786	S	S	*	*			cis	-158.6	144.9	-19.4	-118.7	-33.7	0	0	0	112.2
740	R	25.9	Very low	28.5	Very low	228 Å²	228	140.6 Å²	140.6	86%	0.86	79%	0.789	S	S	*	*			trans	38.7	127.6	147.9	-73.3	176.9	170.2	179.4	-1.8	121
741	S	22.6	Very low	30.4	Very low	111 Å²	111	140.9 Å²	140.9	78%	0.776	79%	0.79	S	S	*	*				-152.7	128	109.5	56.3	0	0	0	0	113.6
742	T	24.2	Very low	32.6	Very low	138 Å²	138	136.2 Å²	136.2	85%	0.847	78%	0.781	S	S	*	*			trans	11.3	110.1	160.1	49.1	0	0	0	0	120.7
743	S	26.4	Very low	34.9	Very low	121 Å²	121	136.9 Å²	136.9	85%	0.846	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-80	144.9	157.1	-54	0	0	0	0	111.7
744	Q	30.2	Very low	37.2	Very low	179 Å²	179	131 Å²	131	84%	0.836	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-75.4	155.5	171.2	-66.9	170.9	-16.3	0	0	111.3	L746	Q744-L746 PolarHBondContact O-N 3.49Å
745	I	30.7	Very low	40	Very low	171 Å²	171	124.1 Å²	124.1	88%	0.877	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-72.8	118.2	173.5	-60.6	173.5	0	0	0	108.4
746	L	27.1	Very low	42.3	Very low	132 Å²	132	120.4 Å²	120.4	69%	0.691	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-70	139.1	173.8	-89.5	77	0	0	0	110.8	Q744	Q744-L746 PolarHBondContact O-N 3.49Å
747	P	34.3	Very low	44.9	Very low	112 Å²	112	112.3 Å²	112.3	73%	0.727	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-67.9	153.8	161.2	31.4	-33.9	0	0	0	110.4	M749	P747-M749 PolarHBondContact O-N 3.32Å
748	S	33	Very low	47.5	Very low	125 Å²	125	112.2 Å²	112.2	87%	0.874	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-56.4	128	-179.9	-170.8	0	0	0	0	111.8	S750	S748-S750 PolarHBondContact O-N 3.13Å
749	M	36	Very low	50.1	Low	156 Å²	156	111.6 Å²	111.6	77%	0.768	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-76	120	-177.3	-65.2	-168	74.5	0	0	111.5	P747 V751	P747-M749 PolarHBondContact O-N 3.32Å; M749-V751 PolarHBondContact O-N 3.19Å
750	S	52.7	Low	52.4	Low	113 Å²	113	104.2 Å²	104.2	79%	0.79	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-70.8	117.4	168.2	55.2	0	0	0	0	110.5	S748 S752	S748-S750 PolarHBondContact O-N 3.13Å; S750-S752 PolarHBondContact O-N 2.96Å
751	V	66.8	Low	54.7	Low	129 Å²	129	94.2 Å²	94.2	78%	0.782	56%	0.557	S	S	*	*	P	Polyproline II helix	trans	-76.5	121.7	177.9	-179.5	0	0	0	0	110.2	M749 I753	M749-V751 PolarHBondContact O-N 3.19Å; V751-I753 HydrophobicContact CG1-CG2 4.44Å
752	S	70.9	Confident	57.3	Low	89 Å²	89	95 Å²	95	62%	0.622	55%	0.547	S	S	*	.	P	Polyproline II helix	trans	-84.1	122.1	165.5	-175.5	0	0	0	0	109.7	S750 C754	S750-S752 PolarHBondContact O-N 2.96Å; S752-C754 PolarHBondContact OG-N 3.32Å; S752-C754 PolarHBondContact OG-O 3.39Å
753	I	74.8	Confident	59.5	Low	119 Å²	119	90.5 Å²	90.5	61%	0.61	52%	0.523	S	S	*	.			trans	-90.5	-6.1	172.3	66.7	170.4	0	0	0	113.1	V751 E1154	V751-I753 HydrophobicContact CG1-CG2 4.44Å; I753-E1154 HydrophobicContact CD1-CG 3.94Å
754	C	72.8	Confident	61.5	Low	24 Å²	24	85.4 Å²	85.4	16%	0.162	49%	0.487	C	S	.	.	S	Bend	trans	-105	143.8	178.9	-61.7	0	0	0	0	111.1	S752 K1157	S752-C754 PolarHBondContact OG-N 3.32Å; S752-C754 PolarHBondContact OG-O 3.39Å; C754-K1157 HydrophobicContact CB-CG 4.04Å; C754-K1157 VanDerWaalsContact SG-CG 3.6Å
755	P	78.8	Confident	63.3	Low	25 Å²	25	84.5 Å²	84.5	16%	0.162	48%	0.476	C	S	.	.			trans	-64.7	155	172.7	31.5	-39	0	0	0	111.2	E759 V760 I777 L1161 Y1251	P755-E759 HydrophobicContact CB-CB 4.11Å; P755-V760 HydrophobicContact CB-CG2 4.3Å; P755-V760 HydrophobicContact CG-CG2 3.84Å; P755-I777 HydrophobicContact CB-CG2 4.05Å; P755-I777 HydrophobicContact CG-CG2 3.7Å; P755-L1161 HydrophobicContact CG-CD1 3.85Å; P755-L1161 HydrophobicContact CG-CD2 4.02Å; P755-Y1251 WeakPolarHBondContact O-CE1 3.45Å; P755-Y1251 PolarHBondContact O-OH 2.99Å
756	S	79.7	Confident	64.7	Low	44 Å²	44	81 Å²	81	31%	0.308	46%	0.459	S	S	.	.			trans	-66	156	166.4	65.4	0	0	0	0	111.4	T758 E759 V760	S756-T758 PolarHBondContact O-N 3.24Å; S756-T758 VanDerWaalsContact O-N 3.14Å; S756-E759 WeakPolarHBondContact CB-OE2 3.27Å; S756-E759 PolarHBondContact N-OE2 3.43Å; S756-E759 PolarHBondContact O-N 3.42Å; S756-E759 VanDerWaalsContact O-N 3.09Å; S756-E759 VanDerWaalsContact OG-CD 3.29Å; S756-E759 WeakPolarHBondContact OG-CG 3.5Å; S756-E759 PolarHBondContact OG-N 3.38Å; S756-E759 PolarHBondContact OG-OE2 3.2Å; S756-V760 WeakPolarHBondContact O-CG2 3.13Å; S756-V760 PolarHBondContact O-N 2.91Å
757	S	78.9	Confident	65.8	Low	2 Å²	2	79.6 Å²	79.6	1%	0.014	46%	0.458	C	S	.	.	H	α-helix	trans	-47.9	-41.7	170.8	64.4	0	0	0	0	112.6	E759 V760 L761 I1248 D1252	S757-E759 VanDerWaalsContact C-N 3.3Å; S757-E759 PolarHBondContact O-N 3.47Å; S757-V760 WeakPolarHBondContact O-CB 3.46Å; S757-V760 PolarHBondContact O-N 3.31Å; S757-L761 VanDerWaalsContact O-CG 3.23Å; S757-L761 WeakPolarHBondContact O-CG 3.24Å; S757-L761 PolarHBondContact O-N 3.07Å; S757-I1248 WeakPolarHBondContact OG-CG2 3.46Å; S757-D1252 WeakPolarHBondContact CB-OD1 3.49Å; S757-D1252 WeakPolarHBondContact CB-OD2 3.46Å; S757-D1252 PolarHBondContact N-OD1 3.19Å; S757-D1252 PolarHBondContact OG-OD1 2.97Å; S757-D1252 PolarHBondContact OG-OD2 3.43Å
758	T	79.4	Confident	66.5	Low	72 Å²	72	75.1 Å²	75.1	44%	0.442	43%	0.432	S	S	.	.	H	α-helix	trans	-64.6	-33.4	-175.9	-66.6	0	0	0	0	112.2	S756 K762	S756-T758 PolarHBondContact O-N 3.24Å; S756-T758 VanDerWaalsContact O-N 3.14Å; T758-K762 HydrophobicContact CG2-CD 4.26Å; T758-K762 WeakPolarHBondContact O-CB 3.49Å; T758-K762 WeakPolarHBondContact O-CD 3.32Å; T758-K762 WeakPolarHBondContact O-CG 3.32Å; T758-K762 PolarHBondContact O-N 2.95Å; T758-K762 VanDerWaalsContact O-N 3.14Å
759	E	78.3	Confident	66.8	Low	94 Å²	94	78.9 Å²	78.9	44%	0.439	43%	0.433	S	S	.	.	H	α-helix	trans	-75.4	-38.6	175.5	-70.1	157.8	132.5	0	0	111.7	P755 S756 S757 K762 A763 I777	P755-E759 HydrophobicContact CB-CB 4.11Å; S756-E759 WeakPolarHBondContact CB-OE2 3.27Å; S756-E759 PolarHBondContact N-OE2 3.43Å; S756-E759 PolarHBondContact O-N 3.42Å; S756-E759 VanDerWaalsContact O-N 3.09Å; S756-E759 VanDerWaalsContact OG-CD 3.29Å; S756-E759 WeakPolarHBondContact OG-CG 3.5Å; S756-E759 PolarHBondContact OG-N 3.38Å; S756-E759 PolarHBondContact OG-OE2 3.2Å; S757-E759 VanDerWaalsContact C-N 3.3Å; S757-E759 PolarHBondContact O-N 3.47Å; E759-K762 PolarHBondContact O-N 2.87Å; E759-A763 PolarHBondContact O-N 2.82Å; E759-I777 HydrophobicContact CB-CD1 4.25Å; E759-I777 WeakPolarHBondContact O-CD1 3.35Å
760	V	76.1	Confident	66.9	Low	5 Å²	5	79.4 Å²	79.4	3%	0.03	44%	0.438	C	S	.	.	H	α-helix	trans	-59.3	-49.3	174.1	-178.2	0	0	0	0	110.8	P755 S756 S757 K762 A763 C764 L1161 K1165	P755-V760 HydrophobicContact CB-CG2 4.3Å; P755-V760 HydrophobicContact CG-CG2 3.84Å; S756-V760 WeakPolarHBondContact O-CG2 3.13Å; S756-V760 PolarHBondContact O-N 2.91Å; S757-V760 WeakPolarHBondContact O-CB 3.46Å; S757-V760 PolarHBondContact O-N 3.31Å; V760-K762 VanDerWaalsContact C-N 3.35Å; V760-K762 PolarHBondContact O-N 3.17Å; V760-A763 PolarHBondContact O-N 2.77Å; V760-A763 VanDerWaalsContact O-N 3.16Å; V760-C764 PolarHBondContact O-N 2.99Å; V760-C764 VanDerWaalsContact O-N 3.09Å; V760-L1161 HydrophobicContact CB-CD1 4.49Å; V760-L1161 HydrophobicContact CG1-CD1 4.34Å; V760-L1161 HydrophobicContact CG2-CD1 3.31Å; V760-K1165 HydrophobicContact CG1-CB 4Å
761	L	74.7	Confident	66.5	Low	17 Å²	17	77.3 Å²	77.3	9%	0.089	44%	0.435	C	S	.	.	H	α-helix	trans	-62.2	-39.9	178	-62.8	164.4	0	0	0	112.2	S757 A763 C764 R765 Q1168 M1244 I1248	S757-L761 VanDerWaalsContact O-CG 3.23Å; S757-L761 WeakPolarHBondContact O-CG 3.24Å; S757-L761 PolarHBondContact O-N 3.07Å; L761-A763 VanDerWaalsContact C-N 3.29Å; L761-A763 PolarHBondContact O-N 3.21Å; L761-C764 PolarHBondContact O-N 2.92Å; L761-R765 WeakPolarHBondContact O-CG 3.44Å; L761-R765 PolarHBondContact O-N 3.22Å; L761-R765 VanDerWaalsContact O-N 3.17Å; L761-Q1168 HydrophobicContact CD2-CB 4.47Å; L761-Q1168 VanDerWaalsContact CD2-CD 3.44Å; L761-Q1168 HydrophobicContact CD2-CG 3.88Å; L761-M1244 HydrophobicContact CD2-CG 4.39Å; L761-I1248 HydrophobicContact CD1-CD1 3.53Å; L761-I1248 HydrophobicContact CD1-CG1 4.04Å; L761-I1248 HydrophobicContact CD2-CD1 4.36Å
762	K	76.9	Confident	65.3	Low	129 Å²	129	78.2 Å²	78.2	56%	0.561	43%	0.434	S	S	*	.	H	α-helix	trans	-63.5	-32.8	175.5	-79	168.7	-177.9	174.4	0	112.5	T758 E759 V760 N766	T758-K762 HydrophobicContact CG2-CD 4.26Å; T758-K762 WeakPolarHBondContact O-CB 3.49Å; T758-K762 WeakPolarHBondContact O-CD 3.32Å; T758-K762 WeakPolarHBondContact O-CG 3.32Å; T758-K762 PolarHBondContact O-N 2.95Å; T758-K762 VanDerWaalsContact O-N 3.14Å; E759-K762 PolarHBondContact O-N 2.87Å; V760-K762 VanDerWaalsContact C-N 3.35Å; V760-K762 PolarHBondContact O-N 3.17Å; K762-N766 PolarHBondContact O-ND2 3.49Å
763	A	71.4	Confident	64	Low	42 Å²	42	77 Å²	77	35%	0.347	43%	0.426	S	S	.	.	H	α-helix	trans	-75.4	-40.2	176.4	0	0	0	0	0	112.8	E759 V760 L761 R765 N766 I777	E759-A763 PolarHBondContact O-N 2.82Å; V760-A763 PolarHBondContact O-N 2.77Å; V760-A763 VanDerWaalsContact O-N 3.16Å; L761-A763 VanDerWaalsContact C-N 3.29Å; L761-A763 PolarHBondContact O-N 3.21Å; A763-R765 VanDerWaalsContact C-N 3.35Å; A763-R765 PolarHBondContact O-N 2.86Å; A763-N766 PolarHBondContact O-N 3Å; A763-I777 HydrophobicContact CB-CD1 3.58Å; A763-I777 HydrophobicContact CB-CG1 4.07Å
764	C	68.5	Low	62.9	Low	15 Å²	15	77.7 Å²	77.7	10%	0.101	43%	0.431	C	S	.	.	H	α-helix	trans	-58.6	-46.3	174.2	-67.5	0	0	0	0	111.8	V760 L761 N766 Q1168 T1169 E1172	V760-C764 PolarHBondContact O-N 2.99Å; V760-C764 VanDerWaalsContact O-N 3.09Å; L761-C764 PolarHBondContact O-N 2.92Å; C764-N766 PolarHBondContact O-N 3.39Å; C764-N766 VanDerWaalsContact O-N 3.14Å; C764-Q1168 HydrophobicContact CB-CB 4.3Å; C764-Q1168 HydrophobicContact CB-CG 3.51Å; C764-T1169 PolarHBondContact SG-OG1 2.61Å; C764-T1169 VanDerWaalsContact SG-OG1 3.42Å; C764-E1172 WeakPolarHBondContact CB-OE2 3.46Å
765	R	67.3	Low	61.5	Low	159 Å²	159	81.9 Å²	81.9	60%	0.6	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-10.7	-177.6	-71.1	174.4	-172.7	-176.9	5.8	115.7	L761 A763 P767 E1172	L761-R765 WeakPolarHBondContact O-CG 3.44Å; L761-R765 PolarHBondContact O-N 3.22Å; L761-R765 VanDerWaalsContact O-N 3.17Å; A763-R765 VanDerWaalsContact C-N 3.35Å; A763-R765 PolarHBondContact O-N 2.86Å; R765-P767 VanDerWaalsContact C-CD 3.41Å; R765-P767 WeakPolarHBondContact O-CD 3.43Å; R765-E1172 WeakPolarHBondContact CG-OE1 3.3Å; R765-E1172 IonicContact NE-OE1 2.85Å
766	N	59.5	Low	60.4	Low	98 Å²	98	84.4 Å²	84.4	52%	0.524	48%	0.478	S	S	.	.			trans	-124.8	65.4	-173.7	-71.9	-72.5	0	0	0	113.2	K762 A763 C764 G768	K762-N766 PolarHBondContact O-ND2 3.49Å; A763-N766 PolarHBondContact O-N 3Å; C764-N766 PolarHBondContact O-N 3.39Å; C764-N766 VanDerWaalsContact O-N 3.14Å; N766-G768 PolarHBondContact O-N 2.9Å; N766-G768 VanDerWaalsContact O-N 3.13Å
767	P	52.1	Low	59.4	Low	103 Å²	103	85.6 Å²	85.6	67%	0.669	48%	0.48	S	S	*	.			trans	-60.4	115.6	154.3	29.4	-31.4	0	0	0	107.1	R765	R765-P767 VanDerWaalsContact C-CD 3.41Å; R765-P767 WeakPolarHBondContact O-CD 3.43Å
768	G	47.3	Very low	58.5	Low	17 Å²	17	87.4 Å²	87.4	18%	0.175	49%	0.489	C	S	.	.			trans	-61.7	150.8	-173.1	0	0	0	0	0	111.7	N766 N770 G771 L772	N766-G768 PolarHBondContact O-N 2.9Å; N766-G768 VanDerWaalsContact O-N 3.13Å; G768-N770 PolarHBondContact O-N 3.31Å; G768-G771 PolarHBondContact O-N 3Å; G768-L772 VanDerWaalsContact CA-O 3.31Å; G768-L772 WeakPolarHBondContact CA-O 3.38Å
769	K	39.1	Very low	57.7	Low	205 Å²	205	90.8 Å²	90.8	89%	0.891	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	125.9	169.7	-65.9	-178.1	178.9	-179.1	0	107.6
770	N	38.8	Very low	56.8	Low	166 Å²	166	91.1 Å²	91.1	89%	0.888	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.2	12.4	-169.7	-45.1	-15.6	0	0	0	116.6	G768 L772	G768-N770 PolarHBondContact O-N 3.31Å; N770-L772 VanDerWaalsContact C-N 3.29Å; N770-L772 PolarHBondContact O-N 3.42Å
771	G	44.3	Very low	56.6	Low	69 Å²	69	99.7 Å²	99.7	71%	0.711	55%	0.546	S	S	*	.	S	Bend	trans	79.2	1.8	167.8	0	0	0	0	0	116.2	G768	G768-G771 PolarHBondContact O-N 3Å
772	L	41.9	Very low	56.7	Low	148 Å²	148	101.5 Å²	101.5	78%	0.775	56%	0.559	S	S	*	*			trans	-104.2	120.6	168.6	-69.5	167.1	0	0	0	108.2	G768 N770	G768-L772 VanDerWaalsContact CA-O 3.31Å; G768-L772 WeakPolarHBondContact CA-O 3.38Å; N770-L772 VanDerWaalsContact C-N 3.29Å; N770-L772 PolarHBondContact O-N 3.42Å
773	S	43.3	Very low	57	Low	65 Å²	65	100.9 Å²	100.9	46%	0.455	57%	0.569	S	S	.	*			trans	-80.1	153.5	177.2	71.1	0	0	0	0	111.9
774	N	51	Low	57.7	Low	133 Å²	133	103.7 Å²	103.7	71%	0.711	58%	0.583	S	S	*	*	S	Bend	trans	-60.2	148.6	164.3	-60.8	-33.1	0	0	0	110.1	C776	N774-C776 PolarHBondContact O-N 3.39Å
775	S	44.9	Very low	58.8	Low	111 Å²	111	105 Å²	105	78%	0.776	59%	0.591	S	S	*	*	S	Bend	trans	16.3	89.5	167.6	58.6	0	0	0	0	116.1	I777	S775-I777 PolarHBondContact O-N 2.87Å
776	C	54	Low	60	Low	79 Å²	79	107.4 Å²	107.4	53%	0.534	60%	0.6	S	S	.	*			trans	-66	119.9	-176.9	-160.7	0	0	0	0	111.7	N774 L778	N774-C776 PolarHBondContact O-N 3.39Å; C776-L778 PolarHBondContact O-N 3.49Å; C776-L778 PolarHBondContact SG-O 3.44Å
777	I	59.3	Low	61.7	Low	68 Å²	68	104.3 Å²	104.3	35%	0.349	59%	0.586	S	S	.	*	S	Bend	trans	-64.8	-25.2	-174.3	-63.7	-172.1	0	0	0	113.1	P755 E759 A763 S775	P755-I777 HydrophobicContact CB-CG2 4.05Å; P755-I777 HydrophobicContact CG-CG2 3.7Å; E759-I777 HydrophobicContact CB-CD1 4.25Å; E759-I777 WeakPolarHBondContact O-CD1 3.35Å; A763-I777 HydrophobicContact CB-CD1 3.58Å; A763-I777 HydrophobicContact CB-CG1 4.07Å; S775-I777 PolarHBondContact O-N 2.87Å
778	L	60.5	Low	63.7	Low	40 Å²	40	101.6 Å²	101.6	21%	0.209	57%	0.568	C	S	.	*	S	Bend	trans	-145.5	153.9	177.2	-76.2	-177.2	0	0	0	111.4	C776 D780 Y1158 L1161	C776-L778 PolarHBondContact O-N 3.49Å; C776-L778 PolarHBondContact SG-O 3.44Å; L778-D780 PolarHBondContact O-N 2.95Å; L778-Y1158 HydrophobicContact CD1-CE2 4.11Å; L778-Y1158 HydrophobicContact CD2-CE2 4.14Å; L778-L1161 HydrophobicContact CD1-CD2 3.72Å; L778-L1161 HydrophobicContact CD1-CG 3.75Å; L778-L1161 HydrophobicContact CD2-CD2 4.37Å; L778-L1161 HydrophobicContact CG-CD2 4.33Å
779	L	62.2	Low	65.9	Low	144 Å²	144	106.8 Å²	106.8	75%	0.754	60%	0.596	S	S	*	*			trans	-77.4	96.7	165.8	-164.6	80.7	0	0	0	109.7	K781	L779-K781 PolarHBondContact O-N 2.75Å; L779-K781 VanDerWaalsContact O-N 3.14Å
780	D	60.3	Low	68.6	Low	101 Å²	101	99.7 Å²	99.7	54%	0.54	57%	0.573	S	S	.	*			trans	-63.3	-20.7	-175.4	-69.5	-37.3	0	0	0	114.3	L778 C782 K1165	L778-D780 PolarHBondContact O-N 2.95Å; D780-C782 PolarHBondContact O-N 3.15Å; D780-K1165 WeakPolarHBondContact OD1-CE 3.35Å; D780-K1165 IonicContact OD1-NZ 3.44Å; D780-K1165 PolarHBondContact OD1-NZ 3.41Å; D780-K1165 IonicContact OD2-NZ 2.82Å; D780-K1165 PolarHBondContact OD2-NZ 3Å
781	K	71.4	Confident	71.3	Confident	184 Å²	184	93.3 Å²	93.3	80%	0.8	54%	0.54	S	S	*	.			trans	-89.4	88.3	177.5	-67.7	-174.2	178.7	-179.3	0	110.9	L779	L779-K781 PolarHBondContact O-N 2.75Å; L779-K781 VanDerWaalsContact O-N 3.14Å
782	C	76.9	Confident	73.5	Confident	56 Å²	56	100.1 Å²	100.1	38%	0.378	55%	0.546	S	S	.	.	P	Polyproline II helix	trans	-65	148.7	162.5	-61.9	0	0	0	0	110.5	D780	D780-C782 PolarHBondContact O-N 3.15Å
783	P	83.5	Confident	75.9	Confident	116 Å²	116	97.4 Å²	97.4	75%	0.753	54%	0.537	S	S	*	.	P	Polyproline II helix	trans	-64.4	144.4	167.8	28.9	-34.3	0	0	0	110.3
784	P	86.3	Confident	78.3	Confident	100 Å²	100	98 Å²	98	65%	0.649	54%	0.54	S	S	*	.	P	Polyproline II helix	trans	-68.5	146.7	176.4	29	-34.5	0	0	0	111.1
785	P	91.5	Very high	80.4	Confident	42 Å²	42	94.1 Å²	94.1	27%	0.273	52%	0.519	S	S	.	.	P	Polyproline II helix	trans	-64.5	142.8	174.3	27.8	-33.9	0	0	0	110.5	E1121 W1122 L1125	P785-E1121 HydrophobicContact CG-CB 4.14Å; P785-W1122 HydrophobicContact CB-CB 4.14Å; P785-W1122 HydrophobicContact CB-CE3 4.23Å; P785-W1122 HydrophobicContact CG-CB 4.35Å; P785-W1122 HydrophobicContact CG-CE3 4.36Å; P785-W1122 WeakPolarHBondContact O-CZ3 3.46Å; P785-L1125 HydrophobicContact CG-CB 4.36Å; P785-L1125 HydrophobicContact CG-CD2 4.05Å; P785-L1125 WeakPolarHBondContact O-CD2 3.44Å
786	R	91.3	Very high	82.8	Confident	210 Å²	210	91.8 Å²	91.8	79%	0.792	50%	0.501	S	S	*	.			trans	-144.8	155.7	178.6	64.1	-177.8	-178.3	-174.6	0.6	109.9
787	P	94.8	Very high	84.8	Confident	33 Å²	33	91.1 Å²	91.1	21%	0.214	49%	0.489	C	S	.	.	P	Polyproline II helix	trans	-63.5	147	172.4	-14.6	30	0	0	0	110.6	W1038 W1122	P787-W1038 HydrophobicContact CB-CE3 4.43Å; P787-W1038 HydrophobicContact CB-CH2 3.88Å; P787-W1038 HydrophobicContact CB-CZ2 4.44Å; P787-W1038 HydrophobicContact CB-CZ3 3.88Å; P787-W1038 HydrophobicContact CG-CH2 4.09Å; P787-W1038 HydrophobicContact CG-CZ3 4.12Å; P787-W1122 HydrophobicContact CG-CH2 3.6Å; P787-W1122 HydrophobicContact CG-CZ2 3.81Å; P787-W1122 HydrophobicContact CG-CZ3 4.38Å
788	P	94.9	Very high	86.4	Confident	46 Å²	46	93.7 Å²	93.7	30%	0.299	50%	0.503	S	S	.	.	P	Polyproline II helix	trans	-68.6	144.7	173	29.1	-34.4	0	0	0	110.8	D1036 W1038 G1039	P788-D1036 WeakPolarHBondContact CG-O 3.41Å; P788-W1038 VanDerWaalsContact CD-CE2 3.44Å; P788-W1038 HydrophobicContact CG-CG 4.37Å; P788-G1039 WeakPolarHBondContact O-CA 3.32Å
789	T	94.6	Very high	88.1	Confident	126 Å²	126	97.4 Å²	97.4	77%	0.773	52%	0.518	S	S	*	.	P	Polyproline II helix	trans	-69.2	159.3	162.8	50.6	0	0	0	0	110.1
790	S	94.4	Very high	89.7	Confident	56 Å²	56	90.6 Å²	90.6	39%	0.392	48%	0.482	S	S	.	.	S	Bend	trans	-48.6	131.2	176.7	-165	0	0	0	0	111.9
791	P	95.3	Very high	91.5	Very high	32 Å²	32	91.2 Å²	91.2	21%	0.208	49%	0.486	C	S	.	.	P	Polyproline II helix	trans	-58.2	148.6	-175	-30.1	38.6	0	0	0	114.7	D1036 Y1037	P791-D1036 HydrophobicContact CB-CB 4.39Å; P791-D1036 HydrophobicContact CG-CB 3.49Å; P791-D1036 VanDerWaalsContact CG-CB 3.49Å; P791-Y1037 HydrophobicContact CB-CE2 4.26Å; P791-Y1037 HydrophobicContact CG-CD1 4.27Å; P791-Y1037 HydrophobicContact CG-CD2 3.81Å; P791-Y1037 HydrophobicContact CG-CE1 4.21Å; P791-Y1037 HydrophobicContact CG-CE2 3.7Å; P791-Y1037 HydrophobicContact CG-CG 4.1Å
792	Y	90.7	Very high	92.7	Very high	213 Å²	213	83.6 Å²	83.6	84%	0.835	46%	0.455	S	S	*	.	S	Bend	trans	-117.4	135.5	179.2	-174	-88.6	0	0	0	111.3
793	P	93.8	Very high	93.7	Very high	91 Å²	91	86.5 Å²	86.5	59%	0.591	47%	0.473	S	S	*	.	S	Bend	cis	-73.5	149.6	-2.4	31.4	-35.8	0	0	0	112.6
794	P	92.9	Very high	94.4	Very high	78 Å²	78	81.9 Å²	81.9	51%	0.506	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-63.8	142.5	176.5	28	-35.3	0	0	0	111.1
795	L	95.2	Very high	94.9	Very high	51 Å²	51	78 Å²	78	27%	0.267	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-78.5	134.6	-177.8	-67.7	178.9	0	0	0	112	K799 L800 N1068 P1070	L795-K799 HydrophobicContact CB-CB 4.4Å; L795-K799 HydrophobicContact CD2-CB 4.43Å; L795-K799 HydrophobicContact CD2-CD 4.47Å; L795-L800 HydrophobicContact CB-CD2 3.77Å; L795-N1068 PolarHBondContact O-ND2 3.22Å; L795-P1070 HydrophobicContact CD1-CB 3.82Å; L795-P1070 HydrophobicContact CD1-CG 3.64Å
796	P	95.6	Very high	95.1	Very high	62 Å²	62	78.2 Å²	78.2	40%	0.403	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-70.4	157.6	172.3	34.4	-37.8	0	0	0	110.7	D798 K799	P796-D798 WeakPolarHBondContact CB-OD1 3.44Å; P796-D798 VanDerWaalsContact CG-OD1 3.24Å; P796-D798 WeakPolarHBondContact CG-OD1 3.15Å; P796-D798 PolarHBondContact O-N 3.05Å; P796-D798 VanDerWaalsContact O-N 3.1Å; P796-K799 HydrophobicContact CG-CD 4.05Å; P796-K799 HydrophobicContact CG-CG 4.11Å; P796-K799 PolarHBondContact O-N 3.37Å
797	K	95.3	Very high	95.4	Very high	65 Å²	65	69.9 Å²	69.9	28%	0.283	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-56.7	-31	-169.1	-65	-72.1	-166.3	165.6	0	113.9	K799 L800 Y1065 E1066	K797-K799 VanDerWaalsContact C-N 3.25Å; K797-K799 PolarHBondContact O-N 3.45Å; K797-L800 HydrophobicContact CD-CD1 3.75Å; K797-L800 PolarHBondContact O-N 3.3Å; K797-Y1065 HydrophobicContact CB-CE2 4.3Å; K797-Y1065 HydrophobicContact CD-CD1 4.39Å; K797-Y1065 HydrophobicContact CD-CD2 4.49Å; K797-Y1065 HydrophobicContact CD-CE1 3.9Å; K797-Y1065 HydrophobicContact CD-CE2 4Å; K797-Y1065 PolarHBondContact NZ-O 2.91Å; K797-E1066 IonicContact NZ-OE1 3.88Å; K797-E1066 PolarHBondContact NZ-OE1 3.23Å; K797-E1066 IonicContact NZ-OE2 2.88Å; K797-E1066 PolarHBondContact NZ-OE2 2.83Å
798	D	93.6	Very high	95.4	Very high	121 Å²	121	74.6 Å²	74.6	65%	0.647	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-63.7	-24.8	175.1	57.6	-64.8	0	0	0	113.9	P796	P796-D798 WeakPolarHBondContact CB-OD1 3.44Å; P796-D798 VanDerWaalsContact CG-OD1 3.24Å; P796-D798 WeakPolarHBondContact CG-OD1 3.15Å; P796-D798 PolarHBondContact O-N 3.05Å; P796-D798 VanDerWaalsContact O-N 3.1Å
799	K	95.4	Very high	95.3	Very high	118 Å²	118	73.2 Å²	73.2	51%	0.513	40%	0.395	S	S	.	.	G	3₁₀ helix	trans	-97.7	4.8	-179.1	-60.4	-173	-175.9	177.3	0	113.9	L795 P796 K797 N801	L795-K799 HydrophobicContact CB-CB 4.4Å; L795-K799 HydrophobicContact CD2-CB 4.43Å; L795-K799 HydrophobicContact CD2-CD 4.47Å; P796-K799 HydrophobicContact CG-CD 4.05Å; P796-K799 HydrophobicContact CG-CG 4.11Å; P796-K799 PolarHBondContact O-N 3.37Å; K797-K799 VanDerWaalsContact C-N 3.25Å; K797-K799 PolarHBondContact O-N 3.45Å; K799-N801 VanDerWaalsContact C-N 3.34Å
800	L	97	Very high	94.9	Very high	2 Å²	2	74.9 Å²	74.9	1%	0.01	39%	0.394	C	S	.	.	S	Bend	trans	-83.3	-9.9	-179	-56.6	-176.1	0	0	0	113.9	L795 K797 P802 Y1065 N1068 P1070 V1071	L795-L800 HydrophobicContact CB-CD2 3.77Å; K797-L800 HydrophobicContact CD-CD1 3.75Å; K797-L800 PolarHBondContact O-N 3.3Å; L800-P802 WeakPolarHBondContact O-CD 3.41Å; L800-Y1065 HydrophobicContact CB-CD2 4.05Å; L800-Y1065 HydrophobicContact CB-CE2 4.37Å; L800-Y1065 HydrophobicContact CD1-CD2 3.7Å; L800-Y1065 HydrophobicContact CD1-CE2 4.05Å; L800-Y1065 HydrophobicContact CD1-CG 4.35Å; L800-Y1065 WeakPolarHBondContact CD1-O 3.43Å; L800-N1068 VanDerWaalsContact CD2-C 3.48Å; L800-N1068 HydrophobicContact CD2-CB 4.42Å; L800-N1068 WeakPolarHBondContact CD2-O 3.41Å; L800-P1070 WeakPolarHBondContact O-CA 3.44Å; L800-V1071 PolarHBondContact O-N 2.94Å
801	N	97.5	Very high	94.8	Very high	114 Å²	114	76.3 Å²	76.3	61%	0.61	40%	0.398	S	S	*	.	S	Bend	trans	-119.9	64	173.1	-62	-85.5	0	0	0	110.1	K799	K799-N801 VanDerWaalsContact C-N 3.34Å
802	P	97.2	Very high	94.7	Very high	24 Å²	24	80.8 Å²	80.8	16%	0.156	41%	0.414	C	S	.	.	P	Polyproline II helix	trans	-68.4	146.8	-176.4	29.7	-36.8	0	0	0	112.5	L800 P1070 Y1072	L800-P802 WeakPolarHBondContact O-CD 3.41Å; P802-P1070 HydrophobicContact CG-CB 4.23Å; P802-Y1072 HydrophobicContact CB-CD1 3.98Å; P802-Y1072 HydrophobicContact CB-CE1 3.57Å; P802-Y1072 HydrophobicContact CG-CD1 3.59Å; P802-Y1072 HydrophobicContact CG-CD2 3.8Å; P802-Y1072 HydrophobicContact CG-CE1 3.49Å; P802-Y1072 VanDerWaalsContact CG-CE1 3.49Å; P802-Y1072 HydrophobicContact CG-CE2 3.67Å; P802-Y1072 HydrophobicContact CG-CG 3.76Å
803	P	96.2	Very high	94.8	Very high	117 Å²	117	81 Å²	81	76%	0.76	41%	0.413	S	S	*	.	P	Polyproline II helix	trans	-66.4	140.1	174.5	29.2	-34.7	0	0	0	110.6	P805 Y1072	P803-P805 WeakPolarHBondContact O-CD 3.32Å; P803-Y1072 WeakPolarHBondContact O-CD1 3.3Å; P803-Y1072 WeakPolarHBondContact O-CE1 3.11Å
804	T	98.3	Very high	94.7	Very high	18 Å²	18	79.1 Å²	79.1	11%	0.11	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-73.4	125.4	179.8	-62.8	0	0	0	0	110.8	S806 V831 V833 F1074	T804-S806 PolarHBondContact O-N 3.15Å; T804-S806 PolarHBondContact O-OG 3.48Å; T804-V831 HydrophobicContact CG2-CG1 4.13Å; T804-V833 HydrophobicContact CG2-CG1 3.95Å; T804-F1074 HydrophobicContact CG2-CB 4.33Å; T804-F1074 HydrophobicContact CG2-CD1 3.57Å; T804-F1074 HydrophobicContact CG2-CD2 4.3Å; T804-F1074 HydrophobicContact CG2-CE1 3.87Å; T804-F1074 HydrophobicContact CG2-CG 3.81Å; T804-F1074 HydrophobicContact CG2-CZ 4.37Å; T804-F1074 WeakPolarHBondContact OG1-CD1 3.45Å
805	P	98.1	Very high	94.8	Very high	20 Å²	20	75.4 Å²	75.4	13%	0.13	37%	0.374	C	S	.	.			trans	-52.9	114.9	173.6	-25.9	34.9	0	0	0	110.5	P803 F823 N829 V831 T832 V833	P803-P805 WeakPolarHBondContact O-CD 3.32Å; P805-F823 HydrophobicContact CB-CE1 3.71Å; P805-F823 HydrophobicContact CB-CZ 3.88Å; P805-N829 HydrophobicContact CG-CB 4.38Å; P805-V831 WeakPolarHBondContact CB-O 3.26Å; P805-V831 WeakPolarHBondContact CD-O 3.49Å; P805-V831 WeakPolarHBondContact CG-O 3.4Å; P805-T832 CarbonylContact O-C 3.57Å; P805-T832 VanDerWaalsContact O-CA 3.32Å; P805-T832 WeakPolarHBondContact O-CA 3.2Å; P805-V833 PolarHBondContact O-N 3.44Å
806	S	95.9	Very high	94.8	Very high	46 Å²	46	77.2 Å²	77.2	32%	0.322	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	129.9	-170.8	-63.2	0	0	0	0	109.6	T804 V833	T804-S806 PolarHBondContact O-N 3.15Å; T804-S806 PolarHBondContact O-OG 3.48Å; S806-V833 WeakPolarHBondContact CA-O 3.49Å; S806-V833 VanDerWaalsContact OG-CG1 3.25Å; S806-V833 WeakPolarHBondContact OG-CG1 3.39Å
807	I	96.1	Very high	94.7	Very high	35 Å²	35	80.3 Å²	80.3	18%	0.179	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	133.5	174.7	-68.1	178.8	0	0	0	108	L809 L820 F823 T832 V833 I834 R835	I807-L809 HydrophobicContact CG2-CD2 3.69Å; I807-L809 HydrophobicContact CG2-CG 4.36Å; I807-L820 HydrophobicContact CD1-CD1 3.4Å; I807-L820 HydrophobicContact CG2-CD1 4.09Å; I807-F823 HydrophobicContact CD1-CB 4.18Å; I807-F823 HydrophobicContact CD1-CD1 3.49Å; I807-F823 VanDerWaalsContact CD1-CD1 3.49Å; I807-F823 HydrophobicContact CD1-CD2 4.39Å; I807-F823 HydrophobicContact CD1-CE1 3.87Å; I807-F823 HydrophobicContact CD1-CG 3.77Å; I807-F823 HydrophobicContact CD1-CZ 4.46Å; I807-F823 HydrophobicContact CG1-CD1 4.28Å; I807-F823 HydrophobicContact CG1-CE1 4.15Å; I807-T832 HydrophobicContact CD1-CG2 4.23Å; I807-T832 HydrophobicContact CG1-CG2 4.35Å; I807-V833 PolarHBondContact N-O 2.95Å; I807-I834 CarbonylContact O-C 3.59Å; I807-I834 WeakPolarHBondContact O-CA 3.36Å; I807-R835 WeakPolarHBondContact O-CB 3.24Å; I807-R835 PolarHBondContact O-N 3.26Å
808	Y	96.1	Very high	94.4	Very high	132 Å²	132	81.8 Å²	81.8	52%	0.518	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	132.5	176	-63.7	-102.1	0	0	0	108.3	H487 R835	H487-Y808 AromaticContact CE1-CE1 3.99Å; Y808-R835 HydrophobicContact CD1-CB 3.67Å; Y808-R835 HydrophobicContact CD1-CG 3.94Å; Y808-R835 HydrophobicContact CE1-CB 3.95Å; Y808-R835 HydrophobicContact CE1-CG 3.75Å; Y808-R835 HydrophobicContact CE2-CG 4.37Å; Y808-R835 HydrophobicContact CG-CB 4.13Å; Y808-R835 HydrophobicContact CG-CG 4.35Å
809	L	93.1	Very high	94.5	Very high	17 Å²	17	78.6 Å²	78.6	9%	0.089	39%	0.389	C	S	.	.			trans	-118.7	120.9	177.3	-53.9	-179.9	0	0	0	108.7	I807 D814 A815 I834 R835 L837 A840	I807-L809 HydrophobicContact CG2-CD2 3.69Å; I807-L809 HydrophobicContact CG2-CG 4.36Å; L809-D814 HydrophobicContact CB-CB 4.36Å; L809-D814 HydrophobicContact CD2-CB 3.66Å; L809-A815 HydrophobicContact CD1-CB 3.87Å; L809-I834 HydrophobicContact CD1-CG2 3.27Å; L809-I834 HydrophobicContact CD2-CG2 4.48Å; L809-I834 HydrophobicContact CG-CG2 3.69Å; L809-R835 PolarHBondContact N-O 3.35Å; L809-L837 HydrophobicContact CD1-CB 4.44Å; L809-L837 HydrophobicContact CD1-CD1 3.45Å; L809-L837 VanDerWaalsContact CD1-CD1 3.45Å; L809-A840 HydrophobicContact CB-CB 3.87Å
810	E	86.1	Confident	94.4	Very high	160 Å²	160	73.4 Å²	73.4	75%	0.748	37%	0.367	S	S	*	.			trans	-90	-38.3	175.8	-65	173.7	-167.9	0	0	110.2	D814	E810-D814 PolarHBondContact N-OD2 3.01Å; E810-D814 VanDerWaalsContact N-OD2 3.07Å
811	N	90.9	Very high	94.4	Very high	87 Å²	87	76.4 Å²	76.4	47%	0.465	38%	0.381	S	S	.	.	S	Bend	trans	-129.8	156	-165.9	-69.6	-83.7	0	0	0	112.4	R813 D814	N811-R813 PolarHBondContact O-N 2.92Å; N811-R813 VanDerWaalsContact O-N 3.1Å; N811-D814 PolarHBondContact N-OD2 2.94Å; N811-D814 WeakPolarHBondContact O-CB 3.41Å; N811-D814 VanDerWaalsContact O-CG 3.3Å; N811-D814 PolarHBondContact O-N 3.24Å
812	K	93.8	Very high	94.3	Very high	126 Å²	126	77.3 Å²	77.3	55%	0.548	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-30.2	175.8	179.8	170.4	-179.6	179.2	0	113.4	D814 F816 A840 L841	K812-D814 VanDerWaalsContact C-N 3.35Å; K812-F816 HydrophobicContact CG-CD2 4.39Å; K812-F816 HydrophobicContact CG-CE2 4.32Å; K812-F816 WeakPolarHBondContact O-CD2 3.48Å; K812-A840 VanDerWaalsContact CA-O 3.3Å; K812-A840 WeakPolarHBondContact CA-O 3.02Å; K812-A840 WeakPolarHBondContact CB-O 3.44Å; K812-A840 PolarHBondContact N-O 3.36Å; K812-A840 VanDerWaalsContact N-O 3.15Å; K812-L841 HydrophobicContact CG-CD2 4.03Å
813	R	93.8	Very high	94.3	Very high	217 Å²	217	79.8 Å²	79.8	82%	0.819	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-43.6	-177.8	-58.7	-175.8	-168.2	-177.2	5.7	110.9	N811 A815 F816 F817	N811-R813 PolarHBondContact O-N 2.92Å; N811-R813 VanDerWaalsContact O-N 3.1Å; R813-A815 VanDerWaalsContact C-N 3.3Å; R813-A815 PolarHBondContact O-N 3.35Å; R813-F816 CarbonylContact O-C 3.53Å; R813-F816 WeakPolarHBondContact O-CA 3.25Å; R813-F816 PolarHBondContact O-N 3.21Å; R813-F817 PolarHBondContact O-N 2.91Å
814	D	91.4	Very high	94.3	Very high	52 Å²	52	74.2 Å²	74.2	28%	0.278	35%	0.354	S	S	.	.	G	3₁₀ helix	trans	-60.2	-41.7	-176.1	-35.9	-15.8	0	0	0	110.5	L809 E810 N811 K812 F816 F817	L809-D814 HydrophobicContact CB-CB 4.36Å; L809-D814 HydrophobicContact CD2-CB 3.66Å; E810-D814 PolarHBondContact N-OD2 3.01Å; E810-D814 VanDerWaalsContact N-OD2 3.07Å; N811-D814 PolarHBondContact N-OD2 2.94Å; N811-D814 WeakPolarHBondContact O-CB 3.41Å; N811-D814 VanDerWaalsContact O-CG 3.3Å; N811-D814 PolarHBondContact O-N 3.24Å; K812-D814 VanDerWaalsContact C-N 3.35Å; D814-F816 PolarHBondContact O-N 2.98Å; D814-F817 VanDerWaalsContact O-CB 3.25Å; D814-F817 WeakPolarHBondContact O-CB 3.49Å; D814-F817 PolarHBondContact O-N 2.85Å; D814-F817 VanDerWaalsContact O-N 3.1Å
815	A	94.2	Very high	94.3	Very high	0 Å²	0	74.4 Å²	74.4	0%	0	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-61.2	-22.9	175.1	0	0	0	0	0	114	L809 R813 L837 L841 P971	L809-A815 HydrophobicContact CD1-CB 3.87Å; R813-A815 VanDerWaalsContact C-N 3.3Å; R813-A815 PolarHBondContact O-N 3.35Å; A815-L837 HydrophobicContact CB-CD1 3.94Å; A815-L841 HydrophobicContact CB-CD2 3.57Å; A815-L841 HydrophobicContact CB-CG 4.04Å; A815-P971 WeakPolarHBondContact O-CB 3.31Å; A815-P971 WeakPolarHBondContact O-CG 3.29Å
816	F	95.3	Very high	94.2	Very high	89 Å²	89	76.3 Å²	76.3	39%	0.39	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-106.4	6.1	178.2	-74.1	-98.3	0	0	0	112.9	K812 R813 D814 P818 L841 K969 P971	K812-F816 HydrophobicContact CG-CD2 4.39Å; K812-F816 HydrophobicContact CG-CE2 4.32Å; K812-F816 WeakPolarHBondContact O-CD2 3.48Å; R813-F816 CarbonylContact O-C 3.53Å; R813-F816 WeakPolarHBondContact O-CA 3.25Å; R813-F816 PolarHBondContact O-N 3.21Å; D814-F816 PolarHBondContact O-N 2.98Å; F816-P818 WeakPolarHBondContact O-CD 3.35Å; F816-L841 HydrophobicContact CD2-CD2 4.3Å; F816-L841 HydrophobicContact CE2-CD2 3.71Å; F816-K969 WeakPolarHBondContact CZ-O 3.42Å; F816-P971 HydrophobicContact CD1-CB 4.3Å; F816-P971 HydrophobicContact CE1-CB 4.35Å
817	F	92.9	Very high	94.1	Very high	127 Å²	127	78.3 Å²	78.3	56%	0.557	38%	0.376	S	S	*	.			trans	-67.3	119.2	179.4	-175.4	-129.4	0	0	0	110.6	R813 D814 P819 L820	R813-F817 PolarHBondContact O-N 2.91Å; D814-F817 VanDerWaalsContact O-CB 3.25Å; D814-F817 WeakPolarHBondContact O-CB 3.49Å; D814-F817 PolarHBondContact O-N 2.85Å; D814-F817 VanDerWaalsContact O-N 3.1Å; F817-P819 HydrophobicContact CD1-CB 4.15Å; F817-P819 HydrophobicContact CD1-CG 4.1Å; F817-P819 HydrophobicContact CE1-CB 3.83Å; F817-P819 HydrophobicContact CE1-CG 3.61Å; F817-P819 HydrophobicContact CE2-CG 4.17Å; F817-P819 HydrophobicContact CZ-CB 4.37Å; F817-P819 HydrophobicContact CZ-CG 3.65Å; F817-L820 WeakPolarHBondContact O-CB 3.48Å; F817-L820 PolarHBondContact O-N 3.39Å
818	P	89.5	Confident	94	Very high	95 Å²	95	85 Å²	85	62%	0.617	40%	0.403	S	S	*	.	H	α-helix	trans	-56.8	-36.1	-169.4	-26.5	34.4	0	0	0	116.3	F816 L820 H821	F816-P818 WeakPolarHBondContact O-CD 3.35Å; P818-L820 PolarHBondContact O-N 2.84Å; P818-H821 PolarHBondContact O-N 3.45Å
819	P	95.1	Very high	94.1	Very high	54 Å²	54	79.7 Å²	79.7	35%	0.351	38%	0.384	S	S	.	.	H	α-helix	trans	-60.3	-20	173.5	-28.6	38.6	0	0	0	115.3	F817 H821 Q822 F823	F817-P819 HydrophobicContact CD1-CB 4.15Å; F817-P819 HydrophobicContact CD1-CG 4.1Å; F817-P819 HydrophobicContact CE1-CB 3.83Å; F817-P819 HydrophobicContact CE1-CG 3.61Å; F817-P819 HydrophobicContact CE2-CG 4.17Å; F817-P819 HydrophobicContact CZ-CB 4.37Å; F817-P819 HydrophobicContact CZ-CG 3.65Å; P819-H821 VanDerWaalsContact C-N 3.32Å; P819-H821 PolarHBondContact O-N 3.24Å; P819-Q822 PolarHBondContact O-N 2.91Å; P819-F823 WeakPolarHBondContact O-CB 3.48Å; P819-F823 PolarHBondContact O-N 3.11Å
820	L	94.7	Very high	94.3	Very high	10 Å²	10	79.1 Å²	79.1	5%	0.052	38%	0.382	C	S	.	.	H	α-helix	trans	-58.2	-44.9	174.2	179.2	57.9	0	0	0	111.3	I807 F817 P818 Q822 F823 C824 I834 F973	I807-L820 HydrophobicContact CD1-CD1 3.4Å; I807-L820 HydrophobicContact CG2-CD1 4.09Å; F817-L820 WeakPolarHBondContact O-CB 3.48Å; F817-L820 PolarHBondContact O-N 3.39Å; P818-L820 PolarHBondContact O-N 2.84Å; L820-Q822 VanDerWaalsContact C-N 3.34Å; L820-Q822 PolarHBondContact O-N 3.03Å; L820-F823 PolarHBondContact O-N 3.47Å; L820-C824 PolarHBondContact O-N 3.27Å; L820-C824 PolarHBondContact O-SG 2.82Å; L820-C824 VanDerWaalsContact O-SG 3.36Å; L820-I834 HydrophobicContact CD1-CD1 4.1Å; L820-I834 HydrophobicContact CD2-CD1 4.44Å; L820-F973 HydrophobicContact CD2-CE1 4.13Å; L820-F973 HydrophobicContact CD2-CZ 4.05Å; L820-F973 HydrophobicContact CG-CE1 4.14Å; L820-F973 HydrophobicContact CG-CZ 3.87Å
821	H	96.4	Very high	94.9	Very high	64 Å²	64	71.5 Å²	71.5	30%	0.296	35%	0.346	S	S	.	.	H	α-helix	trans	-64.4	-39.9	176.9	178.7	-148	0	0	0	111.5	P818 P819 C824 T825 F973	P818-H821 PolarHBondContact O-N 3.45Å; P819-H821 VanDerWaalsContact C-N 3.32Å; P819-H821 PolarHBondContact O-N 3.24Å; H821-C824 PolarHBondContact O-N 3.4Å; H821-T825 WeakPolarHBondContact O-CB 3.42Å; H821-T825 WeakPolarHBondContact O-CG2 3.28Å; H821-T825 PolarHBondContact O-N 3.17Å; H821-T825 PolarHBondContact O-OG1 2.91Å; H821-F973 HydrophobicContact CB-CB 4.19Å; H821-F973 HydrophobicContact CB-CD1 3.83Å; H821-F973 HydrophobicContact CB-CD2 4.35Å; H821-F973 HydrophobicContact CB-CE1 4.31Å; H821-F973 HydrophobicContact CB-CG 3.87Å; H821-F973 WeakPolarHBondContact CD2-CB 3.46Å; H821-F973 AromaticContact CD2-CD2 3.68Å; H821-F973 AromaticContact CD2-CG 3.57Å; H821-F973 AromaticContact CG-CG 3.79Å
822	Q	94.5	Very high	95.3	Very high	134 Å²	134	67.4 Å²	67.4	63%	0.626	32%	0.324	S	S	*	.	H	α-helix	trans	-66.5	-36.6	176.5	-63.5	-179.7	-12.3	0	0	112	P819 L820 N826	P819-Q822 PolarHBondContact O-N 2.91Å; L820-Q822 VanDerWaalsContact C-N 3.34Å; L820-Q822 PolarHBondContact O-N 3.03Å; Q822-N826 WeakPolarHBondContact O-CB 3.26Å; Q822-N826 PolarHBondContact O-N 3.31Å
823	F	97	Very high	95.5	Very high	75 Å²	75	61.4 Å²	61.4	33%	0.329	30%	0.298	S	S	.	.	H	α-helix	trans	-66.6	-47	175.7	-172.2	-80.8	0	0	0	111.7	P805 I807 P819 L820 T825 N826 N829 T832	P805-F823 HydrophobicContact CB-CE1 3.71Å; P805-F823 HydrophobicContact CB-CZ 3.88Å; I807-F823 HydrophobicContact CD1-CB 4.18Å; I807-F823 HydrophobicContact CD1-CD1 3.49Å; I807-F823 VanDerWaalsContact CD1-CD1 3.49Å; I807-F823 HydrophobicContact CD1-CD2 4.39Å; I807-F823 HydrophobicContact CD1-CE1 3.87Å; I807-F823 HydrophobicContact CD1-CG 3.77Å; I807-F823 HydrophobicContact CD1-CZ 4.46Å; I807-F823 HydrophobicContact CG1-CD1 4.28Å; I807-F823 HydrophobicContact CG1-CE1 4.15Å; P819-F823 WeakPolarHBondContact O-CB 3.48Å; P819-F823 PolarHBondContact O-N 3.11Å; L820-F823 PolarHBondContact O-N 3.47Å; F823-T825 VanDerWaalsContact C-N 3.32Å; F823-T825 PolarHBondContact O-N 3.05Å; F823-N826 WeakPolarHBondContact O-CB 3.31Å; F823-N826 PolarHBondContact O-N 3Å; F823-N829 WeakPolarHBondContact CD1-ND2 3.48Å; F823-N829 WeakPolarHBondContact CE1-ND2 3.44Å; F823-N829 PolarHBondContact O-ND2 2.7Å; F823-T832 HydrophobicContact CD1-CG2 3.95Å; F823-T832 HydrophobicContact CE1-CG2 3.83Å
824	C	97.8	Very high	95.8	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-65.3	-33.5	178.4	-68.1	0	0	0	0	112.8	L820 H821 F973 W1083 N1085	L820-C824 PolarHBondContact O-N 3.27Å; L820-C824 PolarHBondContact O-SG 2.82Å; L820-C824 VanDerWaalsContact O-SG 3.36Å; H821-C824 PolarHBondContact O-N 3.4Å; C824-F973 HydrophobicContact CB-CE2 4.3Å; C824-W1083 HydrophobicContact CB-CD2 3.88Å; C824-W1083 HydrophobicContact CB-CG 3.84Å; C824-W1083 HydrophobicContact CB-CZ2 4.45Å; C824-W1083 VanDerWaalsContact O-CD1 3.3Å; C824-W1083 PolarHBondContact O-NE1 2.82Å; C824-N1085 PolarHBondContact O-ND2 3.19Å
825	T	97.1	Very high	96.1	Very high	22 Å²	22	50 Å²	50	14%	0.135	25%	0.251	C	S	.	.	H	α-helix	trans	-90.5	-7.8	-179.9	53.9	0	0	0	0	114.6	H821 F823 P827 W1083 N1085 P1107	H821-T825 WeakPolarHBondContact O-CB 3.42Å; H821-T825 WeakPolarHBondContact O-CG2 3.28Å; H821-T825 PolarHBondContact O-N 3.17Å; H821-T825 PolarHBondContact O-OG1 2.91Å; F823-T825 VanDerWaalsContact C-N 3.32Å; F823-T825 PolarHBondContact O-N 3.05Å; T825-P827 VanDerWaalsContact O-CD 3.32Å; T825-P827 WeakPolarHBondContact O-CD 3.35Å; T825-W1083 HydrophobicContact CG2-CZ2 3.89Å; T825-N1085 PolarHBondContact O-ND2 2.99Å; T825-P1107 HydrophobicContact CG2-CB 3.77Å; T825-P1107 HydrophobicContact CG2-CG 3.66Å
826	N	96.3	Very high	95.9	Very high	61 Å²	61	51.4 Å²	51.4	33%	0.326	27%	0.266	S	S	.	.			trans	-57.7	119.4	176.5	-178.9	-9.2	0	0	0	110.4	Q822 F823 K828 N829 N1085	Q822-N826 WeakPolarHBondContact O-CB 3.26Å; Q822-N826 PolarHBondContact O-N 3.31Å; F823-N826 WeakPolarHBondContact O-CB 3.31Å; F823-N826 PolarHBondContact O-N 3Å; N826-K828 PolarHBondContact O-N 3.5Å; N826-K828 WeakPolarHBondContact OD1-CB 3.2Å; N826-K828 PolarHBondContact OD1-N 3.02Å; N826-K828 VanDerWaalsContact OD1-N 3.09Å; N826-N829 WeakPolarHBondContact O-CB 3.44Å; N826-N829 PolarHBondContact O-N 3.24Å; N826-N1085 PolarHBondContact O-ND2 3.18Å
827	P	93.4	Very high	96	Very high	88 Å²	88	47.4 Å²	47.4	57%	0.571	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-18.1	-177.7	-26.6	36.1	0	0	0	114.8	T825 N829 C1111	T825-P827 VanDerWaalsContact O-CD 3.32Å; T825-P827 WeakPolarHBondContact O-CD 3.35Å; P827-N829 PolarHBondContact O-N 2.88Å; P827-C1111 HydrophobicContact CG-CB 4.31Å
828	K	94.5	Very high	96.2	Very high	174 Å²	174	41.7 Å²	41.7	76%	0.757	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-11.5	173.3	-61.9	-175.4	179	-178.9	0	113.9	N826 P830	N826-K828 PolarHBondContact O-N 3.5Å; N826-K828 WeakPolarHBondContact OD1-CB 3.2Å; N826-K828 PolarHBondContact OD1-N 3.02Å; N826-K828 VanDerWaalsContact OD1-N 3.09Å; K828-P830 WeakPolarHBondContact O-CD 3.32Å
829	N	97.9	Very high	96.4	Very high	21 Å²	21	39.8 Å²	39.8	11%	0.112	22%	0.222	C	C	.	.			trans	-110	97.8	176.7	-66	-17	0	0	0	108.6	P805 F823 N826 P827 V831 N1085	P805-N829 HydrophobicContact CG-CB 4.38Å; F823-N829 WeakPolarHBondContact CD1-ND2 3.48Å; F823-N829 WeakPolarHBondContact CE1-ND2 3.44Å; F823-N829 PolarHBondContact O-ND2 2.7Å; N826-N829 WeakPolarHBondContact O-CB 3.44Å; N826-N829 PolarHBondContact O-N 3.24Å; P827-N829 PolarHBondContact O-N 2.88Å; N829-V831 VanDerWaalsContact C-N 3.27Å; N829-V831 PolarHBondContact O-N 3.25Å; N829-N1085 VanDerWaalsContact O-CB 3.26Å; N829-N1085 WeakPolarHBondContact O-CB 3.44Å; N829-N1085 PolarHBondContact O-ND2 3.38Å
830	P	98.4	Very high	96.5	Very high	6 Å²	6	37.8 Å²	37.8	4%	0.039	21%	0.21	C	C	.	.	S	Bend	trans	-67.3	-32.3	176.5	-19.7	32.9	0	0	0	112.1	K828 V1032 P1034 Y1072 N1085 T1088	K828-P830 WeakPolarHBondContact O-CD 3.32Å; P830-V1032 HydrophobicContact CB-CG1 4.15Å; P830-P1034 HydrophobicContact CG-CB 3.89Å; P830-P1034 HydrophobicContact CG-CG 3.91Å; P830-Y1072 HydrophobicContact CG-CE2 3.85Å; P830-N1085 VanDerWaalsContact O-CB 3.27Å; P830-N1085 WeakPolarHBondContact O-CB 3.18Å; P830-N1085 PolarHBondContact O-N 2.92Å; P830-T1088 WeakPolarHBondContact CA-OG1 3.14Å; P830-T1088 HydrophobicContact CB-CG2 3.61Å; P830-T1088 WeakPolarHBondContact CB-OG1 3.44Å; P830-T1088 WeakPolarHBondContact O-CB 3.46Å; P830-T1088 WeakPolarHBondContact O-CG2 3.38Å; P830-T1088 PolarHBondContact O-OG1 3.09Å
831	V	98.8	Very high	96.6	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	149.4	178.7	52.8	0	0	0	0	109.6	T804 P805 N829 V1032 Y1072 F1074 V1082 W1083 I1084	T804-V831 HydrophobicContact CG2-CG1 4.13Å; P805-V831 WeakPolarHBondContact CB-O 3.26Å; P805-V831 WeakPolarHBondContact CD-O 3.49Å; P805-V831 WeakPolarHBondContact CG-O 3.4Å; N829-V831 VanDerWaalsContact C-N 3.27Å; N829-V831 PolarHBondContact O-N 3.25Å; V831-V1032 HydrophobicContact CB-CB 4.49Å; V831-V1032 HydrophobicContact CB-CG1 4.01Å; V831-V1032 HydrophobicContact CB-CG2 4.21Å; V831-V1032 HydrophobicContact CG1-CB 4.01Å; V831-V1032 HydrophobicContact CG1-CG1 3.71Å; V831-V1032 HydrophobicContact CG1-CG2 4.12Å; V831-V1032 HydrophobicContact CG2-CG2 4.4Å; V831-Y1072 HydrophobicContact CG1-CG 4.35Å; V831-F1074 HydrophobicContact CG1-CE1 4.26Å; V831-F1074 HydrophobicContact CG2-CE1 3.78Å; V831-F1074 HydrophobicContact CG2-CZ 3.68Å; V831-V1082 HydrophobicContact CG2-CG1 3.9Å; V831-W1083 CarbonylContact C-O 3.54Å; V831-W1083 VanDerWaalsContact CA-O 3.29Å; V831-W1083 WeakPolarHBondContact CA-O 3.39Å; V831-I1084 HydrophobicContact CB-CD1 4.18Å; V831-I1084 HydrophobicContact CG2-CD1 3.89Å
832	T	98.9	Very high	96.7	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	132.4	164.8	-61.8	0	0	0	0	109.1	P805 I807 F823 I834 W1083	P805-T832 CarbonylContact O-C 3.57Å; P805-T832 VanDerWaalsContact O-CA 3.32Å; P805-T832 WeakPolarHBondContact O-CA 3.2Å; I807-T832 HydrophobicContact CD1-CG2 4.23Å; I807-T832 HydrophobicContact CG1-CG2 4.35Å; F823-T832 HydrophobicContact CD1-CG2 3.95Å; F823-T832 HydrophobicContact CE1-CG2 3.83Å; T832-I834 HydrophobicContact CG2-CG1 4.25Å; T832-W1083 PolarHBondContact N-O 2.73Å; T832-W1083 PolarHBondContact O-N 2.79Å
833	V	98.8	Very high	96.8	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	118.5	170.8	64	0	0	0	0	109.9	T804 P805 S806 I807 F1074 D1080 L1081 V1082	T804-V833 HydrophobicContact CG2-CG1 3.95Å; P805-V833 PolarHBondContact O-N 3.44Å; S806-V833 WeakPolarHBondContact CA-O 3.49Å; S806-V833 VanDerWaalsContact OG-CG1 3.25Å; S806-V833 WeakPolarHBondContact OG-CG1 3.39Å; I807-V833 PolarHBondContact N-O 2.95Å; V833-F1074 HydrophobicContact CB-CD2 4.3Å; V833-F1074 HydrophobicContact CB-CE2 4.01Å; V833-F1074 HydrophobicContact CG1-CD2 4.41Å; V833-F1074 HydrophobicContact CG2-CD2 4.43Å; V833-F1074 HydrophobicContact CG2-CE2 4.16Å; V833-D1080 HydrophobicContact CG2-CB 4.29Å; V833-L1081 CarbonylContact C-O 3.48Å; V833-L1081 WeakPolarHBondContact CA-O 3.37Å; V833-V1082 HydrophobicContact CG2-CG2 4.19Å
834	I	98.6	Very high	96.9	Very high	3 Å²	3	37.8 Å²	37.8	2%	0.015	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	101.8	179.2	-50.9	-175.4	0	0	0	107.7	I807 L809 L820 T832 L837 D1080 L1081	I807-I834 CarbonylContact O-C 3.59Å; I807-I834 WeakPolarHBondContact O-CA 3.36Å; L809-I834 HydrophobicContact CD1-CG2 3.27Å; L809-I834 HydrophobicContact CD2-CG2 4.48Å; L809-I834 HydrophobicContact CG-CG2 3.69Å; L820-I834 HydrophobicContact CD1-CD1 4.1Å; L820-I834 HydrophobicContact CD2-CD1 4.44Å; T832-I834 HydrophobicContact CG2-CG1 4.25Å; I834-L837 HydrophobicContact CG2-CB 4.12Å; I834-L837 HydrophobicContact CG2-CD1 4.3Å; I834-D1080 WeakPolarHBondContact O-CA 3.36Å; I834-L1081 HydrophobicContact CB-CB 4.32Å; I834-L1081 HydrophobicContact CD1-CD2 4.06Å; I834-L1081 HydrophobicContact CG1-CD2 4.34Å; I834-L1081 PolarHBondContact N-O 2.72Å; I834-L1081 PolarHBondContact O-N 2.9Å
835	R	97.6	Very high	96.9	Very high	28 Å²	28	39.3 Å²	39.3	11%	0.106	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	135.3	-175	-57.6	-64.2	-174	178.8	-2.7	111.2	I807 Y808 L809 L837 I1075 D1080	I807-R835 WeakPolarHBondContact O-CB 3.24Å; I807-R835 PolarHBondContact O-N 3.26Å; Y808-R835 HydrophobicContact CD1-CB 3.67Å; Y808-R835 HydrophobicContact CD1-CG 3.94Å; Y808-R835 HydrophobicContact CE1-CB 3.95Å; Y808-R835 HydrophobicContact CE1-CG 3.75Å; Y808-R835 HydrophobicContact CE2-CG 4.37Å; Y808-R835 HydrophobicContact CG-CB 4.13Å; Y808-R835 HydrophobicContact CG-CG 4.35Å; L809-R835 PolarHBondContact N-O 3.35Å; R835-L837 PolarHBondContact O-N 3.13Å; R835-I1075 PolarHBondContact NH1-O 3.43Å; R835-I1075 PolarHBondContact NH2-O 3.05Å; R835-D1080 VanDerWaalsContact CA-OD1 3.24Å; R835-D1080 WeakPolarHBondContact CA-OD1 3.48Å; R835-D1080 WeakPolarHBondContact CD-OD2 3.46Å; R835-D1080 IonicContact CZ-OD2 2.99Å; R835-D1080 IonicContact NE-OD2 3.58Å; R835-D1080 IonicContact NH1-OD2 2.78Å; R835-D1080 PolarHBondContact NH1-OD2 3.4Å
836	G	89.7	Confident	96.9	Very high	29 Å²	29	39.8 Å²	39.8	30%	0.299	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.5	9.9	173.1	0	0	0	0	0	116	A838 G839 A840 D1080	G836-A838 VanDerWaalsContact C-N 3.25Å; G836-A838 PolarHBondContact O-N 2.87Å; G836-A838 VanDerWaalsContact O-N 3.14Å; G836-G839 WeakPolarHBondContact O-CA 3.21Å; G836-G839 PolarHBondContact O-N 2.92Å; G836-A840 PolarHBondContact O-N 3.25Å; G836-D1080 PolarHBondContact N-OD1 3.01Å
837	L	97.8	Very high	97.1	Very high	4 Å²	4	38.2 Å²	38.2	2%	0.021	22%	0.221	C	C	.	.	H	α-helix	trans	-50.7	-43	-175.5	179.3	70.7	0	0	0	113	L809 A815 I834 R835 G839 A840 L841 L970 G1079 L1081	L809-L837 HydrophobicContact CD1-CB 4.44Å; L809-L837 HydrophobicContact CD1-CD1 3.45Å; L809-L837 VanDerWaalsContact CD1-CD1 3.45Å; A815-L837 HydrophobicContact CB-CD1 3.94Å; I834-L837 HydrophobicContact CG2-CB 4.12Å; I834-L837 HydrophobicContact CG2-CD1 4.3Å; R835-L837 PolarHBondContact O-N 3.13Å; L837-G839 VanDerWaalsContact C-N 3.3Å; L837-G839 PolarHBondContact O-N 2.87Å; L837-A840 PolarHBondContact O-N 3.09Å; L837-L841 HydrophobicContact CD1-CD1 3.63Å; L837-L841 HydrophobicContact CD1-CG 3.91Å; L837-L841 HydrophobicContact CG-CD1 3.94Å; L837-L841 HydrophobicContact CG-CG 4.4Å; L837-L841 WeakPolarHBondContact O-CB 3.29Å; L837-L841 PolarHBondContact O-N 3.28Å; L837-L970 HydrophobicContact CD2-CD2 3.9Å; L837-G1079 PolarHBondContact N-O 3.29Å; L837-L1081 HydrophobicContact CB-CB 4.46Å; L837-L1081 HydrophobicContact CD2-CB 3.53Å; L837-L1081 HydrophobicContact CD2-CD1 3.32Å; L837-L1081 HydrophobicContact CD2-CG 4.04Å
838	A	96.8	Very high	97.3	Very high	7 Å²	7	34.2 Å²	34.2	6%	0.058	19%	0.194	C	C	.	.	H	α-helix	trans	-62.3	-35.9	178.9	0	0	0	0	0	112.9	G836 K842 L843 L845 G1079	G836-A838 VanDerWaalsContact C-N 3.25Å; G836-A838 PolarHBondContact O-N 2.87Å; G836-A838 VanDerWaalsContact O-N 3.14Å; A838-K842 CarbonylContact O-C 3.58Å; A838-K842 WeakPolarHBondContact O-CA 3.23Å; A838-K842 PolarHBondContact O-N 3.38Å; A838-L843 HydrophobicContact CB-CB 4.08Å; A838-L843 HydrophobicContact CB-CD1 4.31Å; A838-L843 HydrophobicContact CB-CG 4.47Å; A838-L843 PolarHBondContact O-N 3.31Å; A838-L845 HydrophobicContact CB-CD1 3.81Å; A838-L845 HydrophobicContact CB-CD2 4.06Å; A838-L845 HydrophobicContact CB-CG 4.05Å; A838-G1079 PolarHBondContact N-O 3.28Å
839	G	94.9	Very high	97.5	Very high	56 Å²	56	27.6 Å²	27.6	58%	0.577	17%	0.17	S	C	*	.	H	α-helix	trans	-68.7	-52.5	173.5	0	0	0	0	0	111.7	G836 L837 L841 K842	G836-G839 WeakPolarHBondContact O-CA 3.21Å; G836-G839 PolarHBondContact O-N 2.92Å; L837-G839 VanDerWaalsContact C-N 3.3Å; L837-G839 PolarHBondContact O-N 2.87Å; G839-L841 VanDerWaalsContact C-N 3.28Å; G839-L841 PolarHBondContact O-N 3Å; G839-K842 PolarHBondContact O-N 3.48Å
840	A	96.6	Very high	97.5	Very high	11 Å²	11	28.1 Å²	28.1	9%	0.091	17%	0.174	C	C	.	.	H	α-helix	trans	-57.4	-37.5	-179.4	0	0	0	0	0	113.2	L809 K812 G836 L837	L809-A840 HydrophobicContact CB-CB 3.87Å; K812-A840 VanDerWaalsContact CA-O 3.3Å; K812-A840 WeakPolarHBondContact CA-O 3.02Å; K812-A840 WeakPolarHBondContact CB-O 3.44Å; K812-A840 PolarHBondContact N-O 3.36Å; K812-A840 VanDerWaalsContact N-O 3.15Å; G836-A840 PolarHBondContact O-N 3.25Å; L837-A840 PolarHBondContact O-N 3.09Å
841	L	97.4	Very high	97.5	Very high	10 Å²	10	34.6 Å²	34.6	5%	0.052	20%	0.201	C	C	.	.	H	α-helix	trans	-89.3	-11.7	177.1	-70	-175.6	0	0	0	114.8	K812 A815 F816 L837 G839 L843 L970	K812-L841 HydrophobicContact CG-CD2 4.03Å; A815-L841 HydrophobicContact CB-CD2 3.57Å; A815-L841 HydrophobicContact CB-CG 4.04Å; F816-L841 HydrophobicContact CD2-CD2 4.3Å; F816-L841 HydrophobicContact CE2-CD2 3.71Å; L837-L841 HydrophobicContact CD1-CD1 3.63Å; L837-L841 HydrophobicContact CD1-CG 3.91Å; L837-L841 HydrophobicContact CG-CD1 3.94Å; L837-L841 HydrophobicContact CG-CG 4.4Å; L837-L841 WeakPolarHBondContact O-CB 3.29Å; L837-L841 PolarHBondContact O-N 3.28Å; G839-L841 VanDerWaalsContact C-N 3.28Å; G839-L841 PolarHBondContact O-N 3Å; L841-L843 HydrophobicContact CB-CD2 4.02Å; L841-L843 HydrophobicContact CB-CG 3.95Å; L841-L843 HydrophobicContact CD1-CD2 4.42Å; L841-L970 HydrophobicContact CD1-CD2 3.83Å
842	K	97.5	Very high	97.5	Very high	171 Å²	171	36.4 Å²	36.4	74%	0.743	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.3	59.4	-168.1	-55.6	-173.8	-179.4	-173.4	0	111.7	A838 G839 K969	A838-K842 CarbonylContact O-C 3.58Å; A838-K842 WeakPolarHBondContact O-CA 3.23Å; A838-K842 PolarHBondContact O-N 3.38Å; G839-K842 PolarHBondContact O-N 3.48Å; K842-K969 PolarHBondContact O-NZ 3.39Å
843	L	98.2	Very high	97.4	Very high	18 Å²	18	36.4 Å²	36.4	9%	0.094	21%	0.213	C	C	.	.			trans	-81.9	125.5	170.6	-57.6	-176.5	0	0	0	110.5	A838 L841 L845 E966 K969 L970	A838-L843 HydrophobicContact CB-CB 4.08Å; A838-L843 HydrophobicContact CB-CD1 4.31Å; A838-L843 HydrophobicContact CB-CG 4.47Å; A838-L843 PolarHBondContact O-N 3.31Å; L841-L843 HydrophobicContact CB-CD2 4.02Å; L841-L843 HydrophobicContact CB-CG 3.95Å; L841-L843 HydrophobicContact CD1-CD2 4.42Å; L843-L845 HydrophobicContact CB-CD2 4.26Å; L843-L845 PolarHBondContact O-N 2.9Å; L843-L845 VanDerWaalsContact O-N 3.11Å; L843-E966 WeakPolarHBondContact CA-OE1 3.1Å; L843-K969 HydrophobicContact CD2-CB 3.65Å; L843-K969 HydrophobicContact CD2-CD 3.79Å; L843-K969 HydrophobicContact CD2-CG 4.35Å; L843-L970 HydrophobicContact CD1-CD2 4.1Å
844	D	98.3	Very high	97.4	Very high	85 Å²	85	38.5 Å²	38.5	46%	0.455	23%	0.225	S	C	.	.			trans	-78.9	87.7	169.7	-173.1	1.2	0	0	0	110.3	G846 L847 E966	D844-G846 PolarHBondContact O-N 2.98Å; D844-G846 VanDerWaalsContact OD1-CA 3.26Å; D844-G846 WeakPolarHBondContact OD1-CA 3.17Å; D844-G846 PolarHBondContact OD1-N 3.33Å; D844-L847 HydrophobicContact CB-CD1 4.2Å; D844-L847 HydrophobicContact CB-CG 4.17Å; D844-L847 PolarHBondContact O-N 3.19Å; D844-E966 PolarHBondContact N-OE1 3.13Å
845	L	98.1	Very high	97.4	Very high	32 Å²	32	44.4 Å²	44.4	17%	0.168	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-64.4	-17	172.3	-56	-177.6	0	0	0	112.3	A838 L843 L847 F848 S849 I1021 I1023	A838-L845 HydrophobicContact CB-CD1 3.81Å; A838-L845 HydrophobicContact CB-CD2 4.06Å; A838-L845 HydrophobicContact CB-CG 4.05Å; L843-L845 HydrophobicContact CB-CD2 4.26Å; L843-L845 PolarHBondContact O-N 2.9Å; L843-L845 VanDerWaalsContact O-N 3.11Å; L845-L847 PolarHBondContact O-N 3.12Å; L845-F848 PolarHBondContact O-N 3.46Å; L845-S849 PolarHBondContact O-N 3.46Å; L845-I1021 HydrophobicContact CD2-CG2 4.31Å; L845-I1023 HydrophobicContact CB-CG2 4.25Å; L845-I1023 HydrophobicContact CD2-CD1 4.08Å; L845-I1023 WeakPolarHBondContact O-CG2 3.49Å
846	G	97.7	Very high	97.3	Very high	32 Å²	32	45.2 Å²	45.2	33%	0.33	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-59.7	-32.4	176.1	0	0	0	0	0	112.9	D844 F848 S849 T852	D844-G846 PolarHBondContact O-N 2.98Å; D844-G846 VanDerWaalsContact OD1-CA 3.26Å; D844-G846 WeakPolarHBondContact OD1-CA 3.17Å; D844-G846 PolarHBondContact OD1-N 3.33Å; G846-F848 PolarHBondContact O-N 3.01Å; G846-F848 VanDerWaalsContact O-N 3.13Å; G846-S849 WeakPolarHBondContact O-CB 3.35Å; G846-S849 PolarHBondContact O-N 3.04Å; G846-S849 PolarHBondContact O-OG 2.88Å; G846-T852 WeakPolarHBondContact O-CB 3.5Å; G846-T852 PolarHBondContact O-OG1 3.38Å
847	L	98.6	Very high	97.6	Very high	28 Å²	28	45.1 Å²	45.1	15%	0.147	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-58.8	-22.8	174	-62.2	176.5	0	0	0	113.6	D844 L845 L962 Q963 E966	D844-L847 HydrophobicContact CB-CD1 4.2Å; D844-L847 HydrophobicContact CB-CG 4.17Å; D844-L847 PolarHBondContact O-N 3.19Å; L845-L847 PolarHBondContact O-N 3.12Å; L847-L962 HydrophobicContact CD1-CB 4.41Å; L847-L962 HydrophobicContact CD2-CB 4.3Å; L847-Q963 HydrophobicContact CB-CG 4.26Å; L847-Q963 WeakPolarHBondContact O-CG 3.46Å; L847-Q963 PolarHBondContact O-NE2 2.94Å; L847-E966 HydrophobicContact CD1-CB 3.91Å; L847-E966 HydrophobicContact CD1-CG 4.01Å
848	F	98.6	Very high	97.6	Very high	3 Å²	3	49 Å²	49	1%	0.013	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-107.3	7.6	178.6	-56.2	-90.5	0	0	0	112.7	L845 G846 L853 L954 Q963 L967 I1023 N1099 I1101	L845-F848 PolarHBondContact O-N 3.46Å; G846-F848 PolarHBondContact O-N 3.01Å; G846-F848 VanDerWaalsContact O-N 3.13Å; F848-L853 WeakPolarHBondContact O-CD1 3.4Å; F848-L954 HydrophobicContact CD1-CD1 4.25Å; F848-L954 HydrophobicContact CE1-CD1 4.13Å; F848-Q963 HydrophobicContact CD1-CB 4.27Å; F848-Q963 HydrophobicContact CD1-CG 4.04Å; F848-Q963 HydrophobicContact CE1-CB 3.59Å; F848-Q963 HydrophobicContact CE1-CG 3.88Å; F848-Q963 HydrophobicContact CZ-CB 3.76Å; F848-Q963 HydrophobicContact CZ-CG 4.22Å; F848-Q963 WeakPolarHBondContact CZ-O 2.92Å; F848-L967 HydrophobicContact CE2-CD2 4.42Å; F848-L967 HydrophobicContact CZ-CD1 4.16Å; F848-L967 HydrophobicContact CZ-CD2 3.98Å; F848-L967 HydrophobicContact CZ-CG 4Å; F848-I1023 HydrophobicContact CB-CD1 3.64Å; F848-I1023 HydrophobicContact CB-CG1 3.78Å; F848-I1023 HydrophobicContact CB-CG2 3.94Å; F848-I1023 HydrophobicContact CD2-CD1 4.18Å; F848-I1023 HydrophobicContact CG-CD1 3.96Å; F848-N1099 PolarHBondContact O-ND2 3.36Å; F848-N1099 VanDerWaalsContact O-ND2 3.13Å; F848-I1101 HydrophobicContact CD1-CD1 4.05Å; F848-I1101 HydrophobicContact CD1-CG2 3.57Å; F848-I1101 HydrophobicContact CD2-CD1 4.46Å; F848-I1101 HydrophobicContact CE1-CD1 3.73Å; F848-I1101 HydrophobicContact CE1-CG2 3.91Å; F848-I1101 HydrophobicContact CE2-CD1 4.19Å; F848-I1101 HydrophobicContact CG-CD1 4.39Å; F848-I1101 HydrophobicContact CG-CG2 4.34Å; F848-I1101 HydrophobicContact CZ-CD1 3.8Å
849	S	98.5	Very high	97.6	Very high	36 Å²	36	53.6 Å²	53.6	25%	0.252	30%	0.3	S	S	.	.	S	Bend	trans	-65.6	145.7	174	75	0	0	0	0	110.6	L845 G846 K851 T852 L853	L845-S849 PolarHBondContact O-N 3.46Å; G846-S849 WeakPolarHBondContact O-CB 3.35Å; G846-S849 PolarHBondContact O-N 3.04Å; G846-S849 PolarHBondContact O-OG 2.88Å; S849-K851 PolarHBondContact O-N 3.47Å; S849-K851 VanDerWaalsContact O-N 3.08Å; S849-T852 PolarHBondContact O-N 3.24Å; S849-T852 PolarHBondContact OG-N 2.91Å; S849-T852 PolarHBondContact OG-OG1 3.22Å; S849-L853 VanDerWaalsContact O-CG 3.29Å; S849-L853 WeakPolarHBondContact O-CG 3.41Å; S849-L853 PolarHBondContact O-N 3.3Å
850	T	98.3	Very high	97.8	Very high	32 Å²	32	52.6 Å²	52.6	20%	0.196	28%	0.28	C	S	.	.	H	α-helix	trans	-52.9	-33.2	177.6	-66.9	0	0	0	0	112.8	V854 A900 Q903 M1000 N1099	T850-V854 VanDerWaalsContact O-CG2 3.24Å; T850-V854 WeakPolarHBondContact O-CG2 3.43Å; T850-V854 PolarHBondContact O-N 3.27Å; T850-A900 HydrophobicContact CG2-CB 3.38Å; T850-Q903 PolarHBondContact OG1-OE1 3.33Å; T850-M1000 HydrophobicContact CG2-CE 3.56Å; T850-M1000 WeakPolarHBondContact OG1-CE 3.28Å; T850-N1099 PolarHBondContact N-ND2 2.93Å; T850-N1099 PolarHBondContact OG1-ND2 3.5Å; T850-N1099 PolarHBondContact OG1-OD1 3.34Å
851	K	97.8	Very high	97.8	Very high	141 Å²	141	58 Å²	58	61%	0.613	31%	0.305	S	S	*	.	H	α-helix	trans	-62.1	-59.4	173.5	-179.1	-174.6	164.4	-177.3	0	111.2	S849 L853 V854 E855	S849-K851 PolarHBondContact O-N 3.47Å; S849-K851 VanDerWaalsContact O-N 3.08Å; K851-L853 VanDerWaalsContact C-N 3.26Å; K851-L853 PolarHBondContact O-N 3.32Å; K851-V854 PolarHBondContact O-N 3.48Å; K851-V854 VanDerWaalsContact O-N 3.1Å; K851-E855 WeakPolarHBondContact CE-OE1 3.21Å; K851-E855 WeakPolarHBondContact CE-OE2 3.46Å; K851-E855 HydrophobicContact CG-CG 4.46Å; K851-E855 IonicContact NZ-OE1 3.74Å; K851-E855 WeakPolarHBondContact O-CG 3.41Å; K851-E855 PolarHBondContact O-N 2.85Å
852	T	98.3	Very high	97.9	Very high	39 Å²	39	57.6 Å²	57.6	24%	0.239	30%	0.302	C	S	.	.	H	α-helix	trans	-65.4	-29.2	-175.2	-56.4	0	0	0	0	112.8	G846 S849 E855 A856	G846-T852 WeakPolarHBondContact O-CB 3.5Å; G846-T852 PolarHBondContact O-OG1 3.38Å; S849-T852 PolarHBondContact O-N 3.24Å; S849-T852 PolarHBondContact OG-N 2.91Å; S849-T852 PolarHBondContact OG-OG1 3.22Å; T852-E855 PolarHBondContact O-N 3.32Å; T852-A856 VanDerWaalsContact O-CB 3.27Å; T852-A856 WeakPolarHBondContact O-CB 3.28Å; T852-A856 PolarHBondContact O-N 2.75Å
853	L	98.2	Very high	97.9	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-66.4	-40.6	172.9	-68.1	165	0	0	0	112.7	F848 S849 K851 N857 I896 W960 L998	F848-L853 WeakPolarHBondContact O-CD1 3.4Å; S849-L853 VanDerWaalsContact O-CG 3.29Å; S849-L853 WeakPolarHBondContact O-CG 3.41Å; S849-L853 PolarHBondContact O-N 3.3Å; K851-L853 VanDerWaalsContact C-N 3.26Å; K851-L853 PolarHBondContact O-N 3.32Å; L853-N857 PolarHBondContact O-N 3.03Å; L853-I896 HydrophobicContact CB-CG2 4.23Å; L853-W960 HydrophobicContact CD2-CE3 4.5Å; L853-W960 HydrophobicContact CD2-CH2 4.05Å; L853-W960 HydrophobicContact CD2-CZ3 3.71Å; L853-L998 HydrophobicContact CD1-CD1 3.98Å; L853-L998 HydrophobicContact CD1-CD2 3.48Å; L853-L998 VanDerWaalsContact CD1-CD2 3.48Å; L853-L998 HydrophobicContact CD1-CG 4.37Å; L853-L998 HydrophobicContact CD2-CD2 3.89Å; L853-L998 HydrophobicContact CG-CD2 4.28Å
854	V	98.3	Very high	97.9	Very high	43 Å²	43	50.3 Å²	50.3	26%	0.261	27%	0.271	S	S	.	.	H	α-helix	trans	-68.3	-42.1	173.6	173.4	0	0	0	0	111.1	T850 K851 A856 N858 I896 A897 A900	T850-V854 VanDerWaalsContact O-CG2 3.24Å; T850-V854 WeakPolarHBondContact O-CG2 3.43Å; T850-V854 PolarHBondContact O-N 3.27Å; K851-V854 PolarHBondContact O-N 3.48Å; K851-V854 VanDerWaalsContact O-N 3.1Å; V854-A856 VanDerWaalsContact C-N 3.28Å; V854-A856 PolarHBondContact O-N 2.89Å; V854-N858 HydrophobicContact CG1-CB 4.34Å; V854-N858 WeakPolarHBondContact O-CA 3.18Å; V854-N858 WeakPolarHBondContact O-CB 3.17Å; V854-N858 PolarHBondContact O-N 3.36Å; V854-N858 VanDerWaalsContact O-N 3.15Å; V854-I896 HydrophobicContact CG2-CG2 3.76Å; V854-A897 HydrophobicContact CG1-CB 4.36Å; V854-A900 HydrophobicContact CG2-CB 3.42Å; V854-A900 VanDerWaalsContact CG2-CB 3.42Å
855	E	97.9	Very high	98	Very high	127 Å²	127	49.6 Å²	49.6	59%	0.593	26%	0.262	S	S	*	.	H	α-helix	trans	-63.8	-32.8	177.4	-69.7	172.3	147.6	0	0	112.3	K851 T852	K851-E855 WeakPolarHBondContact CE-OE1 3.21Å; K851-E855 WeakPolarHBondContact CE-OE2 3.46Å; K851-E855 HydrophobicContact CG-CG 4.46Å; K851-E855 IonicContact NZ-OE1 3.74Å; K851-E855 WeakPolarHBondContact O-CG 3.41Å; K851-E855 PolarHBondContact O-N 2.85Å; T852-E855 PolarHBondContact O-N 3.32Å
856	A	96.2	Very high	98	Very high	46 Å²	46	49.8 Å²	49.8	38%	0.38	26%	0.264	S	S	.	.	H	α-helix	trans	-79.8	-50.3	177.1	0	0	0	0	0	113.2	T852 V854 W960	T852-A856 VanDerWaalsContact O-CB 3.27Å; T852-A856 WeakPolarHBondContact O-CB 3.28Å; T852-A856 PolarHBondContact O-N 2.75Å; V854-A856 VanDerWaalsContact C-N 3.28Å; V854-A856 PolarHBondContact O-N 2.89Å; A856-W960 HydrophobicContact CB-CE3 4.41Å; A856-W960 HydrophobicContact CB-CZ3 3.88Å
857	N	96.8	Very high	98	Very high	26 Å²	26	48.4 Å²	48.4	14%	0.139	25%	0.249	C	C	.	.	H	α-helix	trans	-148.4	69.5	-173.8	-59.8	-90.2	0	0	0	112.6	L853 E859 H860 K959 W960	L853-N857 PolarHBondContact O-N 3.03Å; N857-E859 PolarHBondContact O-N 2.9Å; N857-H860 HydrophobicContact CB-CB 3.9Å; N857-H860 VanDerWaalsContact O-CB 3.25Å; N857-H860 WeakPolarHBondContact O-CB 3.38Å; N857-H860 PolarHBondContact O-N 3.49Å; N857-H860 VanDerWaalsContact O-N 3.14Å; N857-K959 PolarHBondContact ND2-O 2.95Å; N857-K959 VanDerWaalsContact ND2-O 3.11Å; N857-K959 WeakPolarHBondContact OD1-CB 3.35Å; N857-K959 WeakPolarHBondContact OD1-CD 3.25Å; N857-K959 VanDerWaalsContact OD1-CG 3.3Å; N857-K959 WeakPolarHBondContact OD1-CG 3.4Å; N857-W960 HydrophobicContact CB-CH2 3.67Å; N857-W960 HydrophobicContact CB-CZ2 3.87Å; N857-W960 HydrophobicContact CB-CZ3 4.32Å; N857-W960 VanDerWaalsContact ND2-CH2 3.34Å; N857-W960 WeakPolarHBondContact ND2-CH2 3.32Å; N857-W960 WeakPolarHBondContact ND2-CZ3 3.44Å
858	N	96.6	Very high	97.9	Very high	86 Å²	86	48.5 Å²	48.5	46%	0.46	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47.5	-50.5	-179	58.4	-4.4	0	0	0	115.9	V854 H860 I896 A897	V854-N858 HydrophobicContact CG1-CB 4.34Å; V854-N858 WeakPolarHBondContact O-CA 3.18Å; V854-N858 WeakPolarHBondContact O-CB 3.17Å; V854-N858 PolarHBondContact O-N 3.36Å; V854-N858 VanDerWaalsContact O-N 3.15Å; N858-H860 VanDerWaalsContact C-N 3.32Å; N858-H860 PolarHBondContact O-N 3.43Å; N858-I896 PolarHBondContact O-N 3.45Å; N858-A897 HydrophobicContact CB-CB 4.07Å; N858-A897 WeakPolarHBondContact O-CB 3.41Å; N858-A897 PolarHBondContact O-N 3.25Å
859	E	97.8	Very high	97.8	Very high	104 Å²	104	51.3 Å²	51.3	49%	0.486	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	12.2	-177.6	-62.1	-48.8	130.4	0	0	114.1	N857 T895 K898	N857-E859 PolarHBondContact O-N 2.9Å; E859-T895 HydrophobicContact CB-CG2 4.42Å; E859-T895 WeakPolarHBondContact O-CG2 3.33Å; E859-T895 WeakPolarHBondContact OE2-CB 3.38Å; E859-T895 WeakPolarHBondContact OE2-CG2 3.41Å; E859-T895 PolarHBondContact OE2-OG1 3.21Å; E859-K898 IonicContact OE2-NZ 2.98Å
860	H	98.1	Very high	97.6	Very high	35 Å²	35	50.3 Å²	50.3	16%	0.162	26%	0.256	C	S	.	.			trans	-62.9	139.4	174.5	-167.7	105.4	0	0	0	111	N857 N858 T895 I896 D953 W960	N857-H860 HydrophobicContact CB-CB 3.9Å; N857-H860 VanDerWaalsContact O-CB 3.25Å; N857-H860 WeakPolarHBondContact O-CB 3.38Å; N857-H860 PolarHBondContact O-N 3.49Å; N857-H860 VanDerWaalsContact O-N 3.14Å; N858-H860 VanDerWaalsContact C-N 3.32Å; N858-H860 PolarHBondContact O-N 3.43Å; H860-T895 CarbonylContact O-C 3.56Å; H860-T895 VanDerWaalsContact O-CA 3.23Å; H860-T895 WeakPolarHBondContact O-CA 3.14Å; H860-I896 HydrophobicContact CB-CD1 3.75Å; H860-I896 HydrophobicContact CB-CG1 4.07Å; H860-I896 PolarHBondContact O-N 3.34Å; H860-D953 PolarHBondContact CE1-O 3.13Å; H860-D953 PolarHBondContact NE2-O 2.98Å; H860-D953 VanDerWaalsContact NE2-O 3.17Å; H860-W960 HydrophobicContact CB-CZ2 4.43Å; H860-W960 AromaticContact CE1-NE1 3.78Å; H860-W960 AromaticContact CG-CZ2 3.98Å; H860-W960 AromaticContact ND1-CZ2 3.75Å
861	M	97.8	Very high	97.4	Very high	125 Å²	125	51.6 Å²	51.6	62%	0.616	27%	0.265	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.8	140.4	-172.6	-173.5	174.1	67.9	0	0	112.9
862	V	98.4	Very high	97.1	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	123.2	178	176.1	0	0	0	0	108.9	V864 H893 T894 I896 Y899 I952	V862-V864 HydrophobicContact CG1-CG2 3.94Å; V862-H893 CarbonylContact O-C 3.36Å; V862-H893 WeakPolarHBondContact O-CA 3.32Å; V862-T894 HydrophobicContact CB-CG2 4.08Å; V862-T894 HydrophobicContact CG1-CG2 4.37Å; V862-T894 PolarHBondContact N-O 3.09Å; V862-T894 PolarHBondContact O-N 2.93Å; V862-I896 HydrophobicContact CG2-CB 4.32Å; V862-I896 HydrophobicContact CG2-CG1 3.54Å; V862-Y899 HydrophobicContact CG1-CG 4.45Å; V862-I952 HydrophobicContact CB-CD1 4.37Å; V862-I952 HydrophobicContact CB-CG1 4.22Å; V862-I952 HydrophobicContact CG1-CD1 3.85Å; V862-I952 HydrophobicContact CG1-CG1 3.88Å; V862-I952 HydrophobicContact CG2-CD1 3.8Å; V862-I952 HydrophobicContact CG2-CG1 3.95Å; V862-I952 HydrophobicContact CG2-CG2 4.4Å
863	E	98.4	Very high	96.8	Very high	33 Å²	33	46 Å²	46	15%	0.154	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	133.2	163.6	-165.3	-172.7	103.3	0	0	108.3	R865 R891 T950	E863-R865 IonicContact OE1-CZ 3.67Å; E863-R865 IonicContact OE1-NE 2.82Å; E863-R865 PolarHBondContact OE1-NE 3.06Å; E863-R865 IonicContact OE1-NH2 2.75Å; E863-R865 PolarHBondContact OE1-NH2 2.92Å; E863-R865 IonicContact OE2-NH2 2.66Å; E863-R891 HydrophobicContact CG-CG 3.76Å; E863-R891 WeakPolarHBondContact OE2-CD 3.4Å; E863-R891 IonicContact OE2-CZ 3.21Å; E863-R891 IonicContact OE2-NE 2.71Å; E863-R891 IonicContact OE2-NH1 2.8Å; E863-R891 PolarHBondContact OE2-NH1 2.89Å; E863-R891 VanDerWaalsContact OE2-NH1 3.07Å; E863-T950 HydrophobicContact CB-CG2 4.19Å; E863-T950 HydrophobicContact CG-CG2 4.42Å; E863-T950 PolarHBondContact O-N 3.21Å
864	V	98.6	Very high	96.7	Very high	4 Å²	4	47.7 Å²	47.7	2%	0.024	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	126.6	-178.2	175.5	0	0	0	0	110.3	V862 R891 S892 T894 Y899 K947 F948	V862-V864 HydrophobicContact CG1-CG2 3.94Å; V864-R891 CarbonylContact O-C 3.53Å; V864-R891 WeakPolarHBondContact O-CA 3.39Å; V864-S892 WeakPolarHBondContact CB-OG 3.47Å; V864-S892 PolarHBondContact N-O 2.81Å; V864-S892 PolarHBondContact O-N 3.25Å; V864-S892 PolarHBondContact O-OG 3.37Å; V864-T894 HydrophobicContact CG2-CG2 3.51Å; V864-Y899 HydrophobicContact CG2-CD2 4.1Å; V864-K947 HydrophobicContact CG1-CB 3.78Å; V864-K947 HydrophobicContact CG1-CD 4.34Å; V864-K947 HydrophobicContact CG1-CG 4.17Å; V864-F948 CarbonylContact C-O 3.58Å; V864-F948 WeakPolarHBondContact CA-O 3.32Å
865	R	98.4	Very high	96.6	Very high	70 Å²	70	45.9 Å²	45.9	26%	0.264	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	117.3	169.8	-62.7	-64.1	173	138.7	2	110.2	E863 Q867 S889 N890 K947 F948 T950	E863-R865 IonicContact OE1-CZ 3.67Å; E863-R865 IonicContact OE1-NE 2.82Å; E863-R865 PolarHBondContact OE1-NE 3.06Å; E863-R865 IonicContact OE1-NH2 2.75Å; E863-R865 PolarHBondContact OE1-NH2 2.92Å; E863-R865 IonicContact OE2-NH2 2.66Å; R865-Q867 HydrophobicContact CB-CG 4.32Å; R865-S889 WeakPolarHBondContact CD-O 3.47Å; R865-S889 PolarHBondContact NH1-O 3.02Å; R865-N890 WeakPolarHBondContact CA-O 3.28Å; R865-K947 CarbonylContact O-C 3.57Å; R865-K947 WeakPolarHBondContact O-CA 3.39Å; R865-F948 HydrophobicContact CB-CB 4.37Å; R865-F948 HydrophobicContact CB-CD1 4.4Å; R865-F948 PolarHBondContact N-O 3.42Å; R865-F948 PolarHBondContact O-N 3.37Å; R865-T950 HydrophobicContact CG-CG2 3.79Å
866	T	98.5	Very high	96.6	Very high	35 Å²	35	41.8 Å²	41.8	22%	0.215	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	129.2	171.2	-57	0	0	0	0	108.5	S889 N890 T945 I946	T866-S889 CarbonylContact O-C 3.4Å; T866-S889 WeakPolarHBondContact O-CA 3.37Å; T866-N890 PolarHBondContact N-O 3.36Å; T866-N890 PolarHBondContact O-N 2.79Å; T866-N890 PolarHBondContact O-OD1 2.76Å; T866-T945 HydrophobicContact CG2-CG2 3.42Å; T866-T945 VanDerWaalsContact CG2-CG2 3.42Å; T866-I946 WeakPolarHBondContact CA-O 3.37Å
867	Q	98.1	Very high	96.4	Very high	4 Å²	4	40.5 Å²	40.5	2%	0.019	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	165.8	-168.1	-64.4	178.9	-22	0	0	110.8	R865 S889 T945 I946 R1006	R865-Q867 HydrophobicContact CB-CG 4.32Å; Q867-S889 PolarHBondContact NE2-OG 3.45Å; Q867-T945 WeakPolarHBondContact O-CA 3.45Å; Q867-I946 HydrophobicContact CB-CD1 4.42Å; Q867-I946 HydrophobicContact CB-CG1 4.05Å; Q867-I946 PolarHBondContact N-O 3.26Å; Q867-I946 WeakPolarHBondContact O-CG1 3.31Å; Q867-I946 PolarHBondContact O-N 3.04Å; Q867-R1006 PolarHBondContact NE2-O 3.3Å
868	L	96.5	Very high	96.2	Very high	30 Å²	30	42.9 Å²	42.9	16%	0.157	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	128.3	173.5	-60.8	-179.8	0	0	0	110.7	Q870 P878 F943	L868-Q870 HydrophobicContact CB-CG 4.49Å; L868-Q870 PolarHBondContact O-N 2.82Å; L868-P878 HydrophobicContact CD1-CB 4.23Å; L868-P878 HydrophobicContact CD1-CG 4.23Å; L868-F943 HydrophobicContact CB-CB 3.98Å; L868-F943 HydrophobicContact CD1-CD2 4.43Å; L868-F943 HydrophobicContact CD2-CB 4.39Å
869	L	96.5	Very high	95.9	Very high	61 Å²	61	43.3 Å²	43.3	32%	0.319	23%	0.227	S	C	.	.			trans	-67.2	119.2	177.1	175.4	58.7	0	0	0	111.3	F943 K944 I946	L869-F943 WeakPolarHBondContact O-CD1 3.36Å; L869-K944 HydrophobicContact CB-CB 4.29Å; L869-K944 WeakPolarHBondContact CB-O 3.23Å; L869-K944 HydrophobicContact CD2-CB 4.21Å; L869-K944 PolarHBondContact N-O 3.08Å; L869-I946 HydrophobicContact CB-CD1 4.37Å; L869-I946 HydrophobicContact CB-CG1 4.49Å; L869-I946 HydrophobicContact CB-CG2 4.04Å
870	Q	95.3	Very high	95.5	Very high	15 Å²	15	39 Å²	39	7%	0.07	21%	0.209	C	C	.	.			trans	-144.5	157.8	-173.5	-67.6	-176.3	79.9	0	0	112.9	L868 N875 F943 Q1093	L868-Q870 HydrophobicContact CB-CG 4.49Å; L868-Q870 PolarHBondContact O-N 2.82Å; Q870-N875 PolarHBondContact NE2-OD1 2.87Å; Q870-F943 HydrophobicContact CG-CD1 3.96Å; Q870-F943 HydrophobicContact CG-CE1 4.1Å; Q870-F943 HydrophobicContact CG-CG 4.27Å; Q870-Q1093 PolarHBondContact O-NE2 2.88Å; Q870-Q1093 PolarHBondContact O-OE1 2.98Å
871	P	94.1	Very high	95.2	Very high	59 Å²	59	42.4 Å²	42.4	38%	0.383	23%	0.233	S	C	.	.			trans	-61	138.4	170.8	-18.1	31.5	0	0	0	111.1	D873 E874 R1006	P871-D873 VanDerWaalsContact C-N 3.32Å; P871-D873 PolarHBondContact O-N 3.05Å; P871-E874 HydrophobicContact CB-CB 4.41Å; P871-E874 HydrophobicContact CB-CG 4.29Å; P871-E874 CarbonylContact O-C 3.55Å; P871-E874 PolarHBondContact O-N 3.29Å; P871-R1006 PolarHBondContact O-NH2 3.05Å
872	A	89.6	Confident	95.1	Very high	7 Å²	7	42.6 Å²	42.6	6%	0.058	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-33.4	-168.7	0	0	0	0	0	114.7	E874 E1029 F1031 W1058 Q1093	A872-E874 VanDerWaalsContact C-N 3.27Å; A872-E874 PolarHBondContact O-N 2.72Å; A872-E1029 WeakPolarHBondContact CB-OE2 3.45Å; A872-F1031 HydrophobicContact CB-CE2 3.97Å; A872-F1031 HydrophobicContact CB-CZ 3.82Å; A872-W1058 VanDerWaalsContact O-CE2 3.31Å; A872-W1058 WeakPolarHBondContact O-CZ2 3.32Å; A872-W1058 PolarHBondContact O-NE1 3.12Å; A872-Q1093 HydrophobicContact CB-CB 4.16Å; A872-Q1093 HydrophobicContact CB-CG 4.22Å
873	D	92.6	Very high	95	Very high	55 Å²	55	45.1 Å²	45.1	29%	0.294	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	0.3	175.6	33.9	28.7	0	0	0	114.1	P871 L1061 R1073	P871-D873 VanDerWaalsContact C-N 3.32Å; P871-D873 PolarHBondContact O-N 3.05Å; D873-L1061 HydrophobicContact CB-CD1 3.62Å; D873-R1073 IonicContact OD2-CZ 2.74Å; D873-R1073 IonicContact OD2-NH1 3.71Å; D873-R1073 PolarHBondContact OD2-NH1 3.33Å; D873-R1073 IonicContact OD2-NH2 2.66Å; D873-R1073 PolarHBondContact OD2-NH2 3.06Å
874	E	95.8	Very high	94.9	Very high	36 Å²	36	45.4 Å²	45.4	17%	0.168	24%	0.244	C	C	.	.			trans	-125.4	147.1	178.7	-50.2	-160.9	122.6	0	0	113	P871 A872 W876 K883 K940 R1006	P871-E874 HydrophobicContact CB-CB 4.41Å; P871-E874 HydrophobicContact CB-CG 4.29Å; P871-E874 CarbonylContact O-C 3.55Å; P871-E874 PolarHBondContact O-N 3.29Å; A872-E874 VanDerWaalsContact C-N 3.27Å; A872-E874 PolarHBondContact O-N 2.72Å; E874-W876 VanDerWaalsContact CD-NE1 3.3Å; E874-W876 WeakPolarHBondContact OE1-CZ2 3.49Å; E874-W876 PolarHBondContact OE2-NE1 3.42Å; E874-K883 WeakPolarHBondContact OE1-CE 3.24Å; E874-K883 IonicContact OE1-NZ 2.74Å; E874-K883 PolarHBondContact OE1-NZ 3.48Å; E874-K940 IonicContact OE2-NZ 2.76Å; E874-K940 PolarHBondContact OE2-NZ 3.33Å; E874-R1006 PolarHBondContact O-NH1 2.95Å; E874-R1006 PolarHBondContact O-NH2 2.88Å
875	N	97.4	Very high	94.9	Very high	6 Å²	6	45.4 Å²	45.4	3%	0.032	24%	0.243	C	C	.	.			trans	-138.2	119.7	161.9	-175.1	68.9	0	0	0	109.2	Q870 K883 I884 R886 R1006 W1058	Q870-N875 PolarHBondContact NE2-OD1 2.87Å; N875-K883 CarbonylContact O-C 3.56Å; N875-K883 WeakPolarHBondContact O-CA 3.35Å; N875-I884 PolarHBondContact ND2-O 3.43Å; N875-I884 PolarHBondContact O-N 2.91Å; N875-R886 PolarHBondContact ND2-O 3.22Å; N875-R1006 PolarHBondContact OD1-NH1 2.82Å; N875-W1058 HydrophobicContact CB-CB 3.81Å; N875-W1058 HydrophobicContact CB-CG 3.91Å
876	W	96.4	Very high	94.9	Very high	40 Å²	40	48.4 Å²	48.4	15%	0.152	26%	0.255	C	S	.	.	B	Isolated β-bridge	trans	-106.5	159.8	-174.6	-64.7	83.9	0	0	0	111	E874 K882 K883 F943	E874-W876 VanDerWaalsContact CD-NE1 3.3Å; E874-W876 WeakPolarHBondContact OE1-CZ2 3.49Å; E874-W876 PolarHBondContact OE2-NE1 3.42Å; W876-K882 CarbonylContact C-O 3.6Å; W876-K882 VanDerWaalsContact CA-O 3.3Å; W876-K882 WeakPolarHBondContact CA-O 3.42Å; W876-K883 HydrophobicContact CD2-CG 4.28Å; W876-K883 HydrophobicContact CE3-CG 4.46Å; W876-K883 HydrophobicContact CH2-CG 4.16Å; W876-K883 HydrophobicContact CZ2-CG 3.98Å; W876-K883 HydrophobicContact CZ3-CG 4.41Å; W876-F943 HydrophobicContact CB-CE2 3.83Å; W876-F943 HydrophobicContact CB-CZ 3.74Å; W876-F943 AromaticContact CD1-CZ 4Å; W876-F943 HydrophobicContact CG-CE2 4.47Å; W876-F943 AromaticContact CG-CZ 3.89Å; W876-F943 HydrophobicContact CG-CZ 3.89Å
877	D	93.9	Very high	94.8	Very high	19 Å²	19	47 Å²	47	10%	0.102	25%	0.246	C	C	.	.			trans	-67.7	156.8	163.1	82.4	-77.5	0	0	0	111.1	T879 G880 T881 K882 I884	D877-T879 PolarHBondContact O-N 2.93Å; D877-T879 VanDerWaalsContact OD2-CB 3.25Å; D877-T879 WeakPolarHBondContact OD2-CB 3.3Å; D877-T879 WeakPolarHBondContact OD2-CG2 3.48Å; D877-T879 PolarHBondContact OD2-N 3.09Å; D877-T879 PolarHBondContact OD2-OG1 2.85Å; D877-G880 PolarHBondContact O-N 2.91Å; D877-T881 WeakPolarHBondContact OD1-CA 3.39Å; D877-T881 PolarHBondContact OD1-N 2.84Å; D877-K882 HydrophobicContact CB-CG 4.3Å; D877-K882 PolarHBondContact N-O 2.76Å; D877-K882 PolarHBondContact OD1-N 2.71Å; D877-I884 HydrophobicContact CB-CD1 3.95Å; D877-I884 HydrophobicContact CB-CG2 4.24Å
878	P	90.6	Very high	94.7	Very high	77 Å²	77	50.8 Å²	50.8	50%	0.5	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-15.3	-177.7	-27.7	36.2	0	0	0	115.8	L868	L868-P878 HydrophobicContact CD1-CB 4.23Å; L868-P878 HydrophobicContact CD1-CG 4.23Å
879	T	90.8	Very high	94.7	Very high	95 Å²	95	50.1 Å²	50.1	58%	0.583	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-7	174	78.4	0	0	0	0	113.9	D877 T881	D877-T879 PolarHBondContact O-N 2.93Å; D877-T879 VanDerWaalsContact OD2-CB 3.25Å; D877-T879 WeakPolarHBondContact OD2-CB 3.3Å; D877-T879 WeakPolarHBondContact OD2-CG2 3.48Å; D877-T879 PolarHBondContact OD2-N 3.09Å; D877-T879 PolarHBondContact OD2-OG1 2.85Å; T879-T881 VanDerWaalsContact C-N 3.31Å; T879-T881 PolarHBondContact O-N 2.83Å; T879-T881 WeakPolarHBondContact OG1-CB 3.46Å; T879-T881 PolarHBondContact OG1-OG1 3.07Å
880	G	90.8	Very high	94.7	Very high	12 Å²	12	51.1 Å²	51.1	12%	0.124	27%	0.267	C	S	.	.	S	Bend	trans	69.4	24.2	-177.1	0	0	0	0	0	114.1	D877	D877-G880 PolarHBondContact O-N 2.91Å
881	T	91.6	Very high	94.8	Very high	108 Å²	108	58 Å²	58	66%	0.663	29%	0.293	S	S	*	.	S	Bend	trans	-95.8	-38.1	-171.9	-62	0	0	0	0	113	D877 T879	D877-T881 WeakPolarHBondContact OD1-CA 3.39Å; D877-T881 PolarHBondContact OD1-N 2.84Å; T879-T881 VanDerWaalsContact C-N 3.31Å; T879-T881 PolarHBondContact O-N 2.83Å; T879-T881 WeakPolarHBondContact OG1-CB 3.46Å; T879-T881 PolarHBondContact OG1-OG1 3.07Å
882	K	94.2	Very high	95	Very high	129 Å²	129	57.6 Å²	57.6	56%	0.561	29%	0.291	S	S	*	.	S	Bend	trans	-143.3	152.1	-177.7	58.5	171.8	-178.2	176.9	0	112.6	W876 D877 I884	W876-K882 CarbonylContact C-O 3.6Å; W876-K882 VanDerWaalsContact CA-O 3.3Å; W876-K882 WeakPolarHBondContact CA-O 3.42Å; D877-K882 HydrophobicContact CB-CG 4.3Å; D877-K882 PolarHBondContact N-O 2.76Å; D877-K882 PolarHBondContact OD1-N 2.71Å; K882-I884 HydrophobicContact CD-CG2 4.14Å; K882-I884 HydrophobicContact CG-CG2 4.04Å
883	K	96.3	Very high	95.4	Very high	53 Å²	53	62.4 Å²	62.4	23%	0.23	31%	0.312	C	S	.	.	B	Isolated β-bridge	trans	-69.4	143	166.5	-62.6	-174.3	-178.8	-172	0	110.1	E874 N875 W876 N1060 E1062	E874-K883 WeakPolarHBondContact OE1-CE 3.24Å; E874-K883 IonicContact OE1-NZ 2.74Å; E874-K883 PolarHBondContact OE1-NZ 3.48Å; N875-K883 CarbonylContact O-C 3.56Å; N875-K883 WeakPolarHBondContact O-CA 3.35Å; W876-K883 HydrophobicContact CD2-CG 4.28Å; W876-K883 HydrophobicContact CE3-CG 4.46Å; W876-K883 HydrophobicContact CH2-CG 4.16Å; W876-K883 HydrophobicContact CZ2-CG 3.98Å; W876-K883 HydrophobicContact CZ3-CG 4.41Å; K883-N1060 WeakPolarHBondContact CD-OD1 3.32Å; K883-E1062 IonicContact NZ-OE1 3.88Å; K883-E1062 PolarHBondContact NZ-OE1 3.37Å
884	I	97.3	Very high	95.7	Very high	39 Å²	39	61.9 Å²	61.9	20%	0.2	31%	0.311	C	S	.	.			trans	-144.2	152.2	178.6	64.2	174.3	0	0	0	111.1	N875 D877 K882 R886	N875-I884 PolarHBondContact ND2-O 3.43Å; N875-I884 PolarHBondContact O-N 2.91Å; D877-I884 HydrophobicContact CB-CD1 3.95Å; D877-I884 HydrophobicContact CB-CG2 4.24Å; K882-I884 HydrophobicContact CD-CG2 4.14Å; K882-I884 HydrophobicContact CG-CG2 4.04Å; I884-R886 HydrophobicContact CD1-CB 4.26Å
885	W	98.3	Very high	95.9	Very high	3 Å²	3	61.1 Å²	61.1	1%	0.011	31%	0.309	C	S	.	.	S	Bend	trans	-76.7	-19.7	175.8	-78.4	66	0	0	0	114.4	C887 F1044 N1048 L1050 W1057 W1058 P1059 D1063 L1064	W885-C887 PolarHBondContact O-N 3.43Å; W885-F1044 HydrophobicContact CD2-CB 4.4Å; W885-F1044 HydrophobicContact CE3-CB 4.18Å; W885-F1044 HydrophobicContact CH2-CB 3.34Å; W885-F1044 HydrophobicContact CH2-CD1 4.28Å; W885-F1044 AromaticContact CH2-CD2 3.9Å; W885-F1044 HydrophobicContact CH2-CD2 3.9Å; W885-F1044 AromaticContact CH2-CG 3.61Å; W885-F1044 HydrophobicContact CH2-CG 3.61Å; W885-F1044 HydrophobicContact CZ2-CB 3.58Å; W885-F1044 AromaticContact CZ2-CD1 3.7Å; W885-F1044 HydrophobicContact CZ2-CD1 3.7Å; W885-F1044 HydrophobicContact CZ2-CD2 4.03Å; W885-F1044 HydrophobicContact CZ2-CE1 4.34Å; W885-F1044 AromaticContact CZ2-CG 3.52Å; W885-F1044 HydrophobicContact CZ2-CG 3.52Å; W885-F1044 HydrophobicContact CZ3-CB 3.67Å; W885-F1044 HydrophobicContact CZ3-CG 4.42Å; W885-N1048 HydrophobicContact CB-CB 3.89Å; W885-N1048 VanDerWaalsContact CD1-CG 3.48Å; W885-N1048 VanDerWaalsContact CD1-ND2 3.27Å; W885-N1048 HydrophobicContact CG-CB 4.26Å; W885-L1050 HydrophobicContact CB-CD1 3.63Å; W885-W1057 HydrophobicContact CE3-CE3 4.34Å; W885-W1057 HydrophobicContact CZ3-CE3 4.21Å; W885-W1057 CarbonylContact O-C 3.48Å; W885-W1057 WeakPolarHBondContact O-CA 3.31Å; W885-W1057 WeakPolarHBondContact O-CB 3.36Å; W885-W1058 PolarHBondContact O-N 2.71Å; W885-P1059 HydrophobicContact CE3-CB 4.33Å; W885-P1059 HydrophobicContact CE3-CG 4.4Å; W885-P1059 HydrophobicContact CH2-CB 3.71Å; W885-P1059 HydrophobicContact CH2-CG 4.2Å; W885-P1059 HydrophobicContact CZ2-CB 4.22Å; W885-P1059 HydrophobicContact CZ3-CB 3.78Å; W885-P1059 HydrophobicContact CZ3-CG 3.82Å; W885-D1063 HydrophobicContact CZ2-CB 4.08Å; W885-D1063 PolarHBondContact NE1-OD2 2.9Å; W885-L1064 HydrophobicContact CH2-CD2 3.93Å; W885-L1064 HydrophobicContact CH2-CG 4.47Å; W885-L1064 HydrophobicContact CZ2-CD2 4.41Å
886	R	98.1	Very high	95.9	Very high	134 Å²	134	60.9 Å²	60.9	51%	0.506	31%	0.307	S	S	.	.	B	Isolated β-bridge	trans	-76.9	117.7	-177.1	-177	175.7	-63.9	-89.8	-6.1	110.5	N875 I884 N1049 L1050	N875-R886 PolarHBondContact ND2-O 3.22Å; I884-R886 HydrophobicContact CD1-CB 4.26Å; R886-N1049 PolarHBondContact NH2-O 3.2Å; R886-L1050 HydrophobicContact CB-CD1 4.26Å; R886-L1050 HydrophobicContact CB-CD2 4.07Å; R886-L1050 HydrophobicContact CG-CD2 4.07Å; R886-L1050 VanDerWaalsContact CZ-CD2 3.49Å
887	C	97.7	Very high	96	Very high	5 Å²	5	59.6 Å²	59.6	3%	0.034	31%	0.305	C	S	.	.			trans	-97	115.9	177.2	-171.2	0	0	0	0	110	W885 S1056 W1058	W885-C887 PolarHBondContact O-N 3.43Å; C887-S1056 PolarHBondContact N-O 3.36Å; C887-S1056 VanDerWaalsContact O-CB 3.24Å; C887-S1056 WeakPolarHBondContact O-CB 3.31Å; C887-S1056 PolarHBondContact O-OG 2.78Å; C887-W1058 HydrophobicContact CB-CB 3.98Å
888	E	95.2	Very high	96.2	Very high	83 Å²	83	64 Å²	64	39%	0.388	32%	0.323	S	S	.	.			trans	-69.7	131.1	175.4	-175.9	154.8	-146.2	0	0	110.9	N890	E888-N890 WeakPolarHBondContact CG-OD1 3.5Å; E888-N890 PolarHBondContact OE1-ND2 2.89Å
889	S	96.6	Very high	96.6	Very high	17 Å²	17	60.5 Å²	60.5	12%	0.119	30%	0.3	C	S	.	.			trans	-163.5	62.3	-167.9	-164.3	0	0	0	0	111.3	R865 T866 Q867 S1056	R865-S889 WeakPolarHBondContact CD-O 3.47Å; R865-S889 PolarHBondContact NH1-O 3.02Å; T866-S889 CarbonylContact O-C 3.4Å; T866-S889 WeakPolarHBondContact O-CA 3.37Å; Q867-S889 PolarHBondContact NE2-OG 3.45Å; S889-S1056 WeakPolarHBondContact CB-OG 3.34Å
890	N	96.6	Very high	97	Very high	82 Å²	82	56.5 Å²	56.5	44%	0.439	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	131.4	-170.7	-35.7	74.7	0	0	0	110.6	R865 T866 E888	R865-N890 WeakPolarHBondContact CA-O 3.28Å; T866-N890 PolarHBondContact N-O 3.36Å; T866-N890 PolarHBondContact O-N 2.79Å; T866-N890 PolarHBondContact O-OD1 2.76Å; E888-N890 WeakPolarHBondContact CG-OD1 3.5Å; E888-N890 PolarHBondContact OE1-ND2 2.89Å
891	R	97.7	Very high	97.3	Very high	160 Å²	160	62.3 Å²	62.3	60%	0.604	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.2	138.9	-178.1	179.7	167.6	66.2	173.7	2.9	113.1	E863 V864	E863-R891 HydrophobicContact CG-CG 3.76Å; E863-R891 WeakPolarHBondContact OE2-CD 3.4Å; E863-R891 IonicContact OE2-CZ 3.21Å; E863-R891 IonicContact OE2-NE 2.71Å; E863-R891 IonicContact OE2-NH1 2.8Å; E863-R891 PolarHBondContact OE2-NH1 2.89Å; E863-R891 VanDerWaalsContact OE2-NH1 3.07Å; V864-R891 CarbonylContact O-C 3.53Å; V864-R891 WeakPolarHBondContact O-CA 3.39Å
892	S	98.2	Very high	97.7	Very high	49 Å²	49	59.6 Å²	59.6	34%	0.343	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	-178.9	166.4	57.2	0	0	0	0	109.6	V864	V864-S892 WeakPolarHBondContact CB-OG 3.47Å; V864-S892 PolarHBondContact N-O 2.81Å; V864-S892 PolarHBondContact O-N 3.25Å; V864-S892 PolarHBondContact O-OG 3.37Å
893	H	98.5	Very high	97.9	Very high	109 Å²	109	54.1 Å²	54.1	51%	0.505	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	151.7	177.7	-57.8	101.9	0	0	0	111.4	V862	V862-H893 CarbonylContact O-C 3.36Å; V862-H893 WeakPolarHBondContact O-CA 3.32Å
894	T	98.5	Very high	97.9	Very high	43 Å²	43	54 Å²	54	26%	0.264	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	-167.8	173.6	-156.3	0	0	0	0	110.8	V862 V864 K898 Y899	V862-T894 HydrophobicContact CB-CG2 4.08Å; V862-T894 HydrophobicContact CG1-CG2 4.37Å; V862-T894 PolarHBondContact N-O 3.09Å; V862-T894 PolarHBondContact O-N 2.93Å; V864-T894 HydrophobicContact CG2-CG2 3.51Å; T894-K898 WeakPolarHBondContact OG1-CB 3.4Å; T894-Y899 HydrophobicContact CG2-CD2 4.43Å
895	T	98.7	Very high	97.8	Very high	21 Å²	21	54.8 Å²	54.8	13%	0.129	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	157.4	173.5	60.8	0	0	0	0	112.7	E859 H860 A897 K898 Y899	E859-T895 HydrophobicContact CB-CG2 4.42Å; E859-T895 WeakPolarHBondContact O-CG2 3.33Å; E859-T895 WeakPolarHBondContact OE2-CB 3.38Å; E859-T895 WeakPolarHBondContact OE2-CG2 3.41Å; E859-T895 PolarHBondContact OE2-OG1 3.21Å; H860-T895 CarbonylContact O-C 3.56Å; H860-T895 VanDerWaalsContact O-CA 3.23Å; H860-T895 WeakPolarHBondContact O-CA 3.14Å; T895-A897 VanDerWaalsContact C-N 3.25Å; T895-A897 PolarHBondContact O-N 3.05Å; T895-K898 PolarHBondContact O-N 3.47Å; T895-K898 WeakPolarHBondContact OG1-CD 3.38Å; T895-Y899 PolarHBondContact O-N 3.12Å
896	I	98.2	Very high	97.8	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-52.1	-43.3	-177.9	-73.3	-174.7	0	0	0	111.2	L853 V854 N858 H860 V862 K898 Y899 A900 I952 W960	L853-I896 HydrophobicContact CB-CG2 4.23Å; V854-I896 HydrophobicContact CG2-CG2 3.76Å; N858-I896 PolarHBondContact O-N 3.45Å; H860-I896 HydrophobicContact CB-CD1 3.75Å; H860-I896 HydrophobicContact CB-CG1 4.07Å; H860-I896 PolarHBondContact O-N 3.34Å; V862-I896 HydrophobicContact CG2-CB 4.32Å; V862-I896 HydrophobicContact CG2-CG1 3.54Å; I896-K898 PolarHBondContact O-N 2.83Å; I896-Y899 PolarHBondContact O-N 2.92Å; I896-A900 WeakPolarHBondContact O-CB 3.37Å; I896-A900 PolarHBondContact O-N 3.1Å; I896-I952 HydrophobicContact CD1-CG2 3.94Å; I896-I952 HydrophobicContact CG1-CG2 4.28Å; I896-W960 HydrophobicContact CD1-CH2 3.87Å; I896-W960 HydrophobicContact CD1-CZ2 4.13Å
897	A	98.4	Very high	97.6	Very high	13 Å²	13	53.6 Å²	53.6	11%	0.107	27%	0.274	C	S	.	.	H	α-helix	trans	-60.2	-45.6	176.2	0	0	0	0	0	113.4	V854 N858 T895 A900 Q901	V854-A897 HydrophobicContact CG1-CB 4.36Å; N858-A897 HydrophobicContact CB-CB 4.07Å; N858-A897 WeakPolarHBondContact O-CB 3.41Å; N858-A897 PolarHBondContact O-N 3.25Å; T895-A897 VanDerWaalsContact C-N 3.25Å; T895-A897 PolarHBondContact O-N 3.05Å; A897-A900 PolarHBondContact O-N 2.88Å; A897-Q901 VanDerWaalsContact O-CG 3.29Å; A897-Q901 WeakPolarHBondContact O-CG 3.19Å; A897-Q901 PolarHBondContact O-N 2.83Å
898	K	98.6	Very high	97.4	Very high	111 Å²	111	58.8 Å²	58.8	48%	0.483	30%	0.298	S	S	.	.	H	α-helix	trans	-69.3	-36.6	179.8	-70.2	168	-175.3	138.9	0	111.8	E859 T894 T895 I896 Y902	E859-K898 IonicContact OE2-NZ 2.98Å; T894-K898 WeakPolarHBondContact OG1-CB 3.4Å; T895-K898 PolarHBondContact O-N 3.47Å; T895-K898 WeakPolarHBondContact OG1-CD 3.38Å; I896-K898 PolarHBondContact O-N 2.83Å; K898-Y902 PolarHBondContact O-N 3.11Å
899	Y	98.8	Very high	97.2	Very high	4 Å²	4	58.4 Å²	58.4	2%	0.016	30%	0.296	C	S	.	.	H	α-helix	trans	-71.4	-39.1	174.2	-167.9	-89.3	0	0	0	112.3	V862 V864 T894 T895 I896 Q901 Y902 Q903 K947 F948 G949 M1000	V862-Y899 HydrophobicContact CG1-CG 4.45Å; V864-Y899 HydrophobicContact CG2-CD2 4.1Å; T894-Y899 HydrophobicContact CG2-CD2 4.43Å; T895-Y899 PolarHBondContact O-N 3.12Å; I896-Y899 PolarHBondContact O-N 2.92Å; Y899-Q901 VanDerWaalsContact C-N 3.34Å; Y899-Q901 PolarHBondContact O-N 3.49Å; Y899-Y902 HydrophobicContact CD2-CD1 4.28Å; Y899-Y902 AromaticContact CE2-CD1 3.78Å; Y899-Y902 HydrophobicContact CE2-CD1 3.78Å; Y899-Y902 HydrophobicContact CE2-CE1 4.24Å; Y899-Y902 WeakPolarHBondContact O-CB 3.48Å; Y899-Y902 PolarHBondContact O-N 3.03Å; Y899-Y902 VanDerWaalsContact O-N 3.12Å; Y899-Q903 HydrophobicContact CE1-CB 4.17Å; Y899-Q903 PolarHBondContact O-N 2.68Å; Y899-K947 HydrophobicContact CE2-CB 4.22Å; Y899-K947 PolarHBondContact OH-O 2.85Å; Y899-F948 WeakPolarHBondContact OH-CA 3.49Å; Y899-G949 VanDerWaalsContact CE2-N 3.25Å; Y899-G949 PolarHBondContact OH-N 3.19Å; Y899-G949 VanDerWaalsContact OH-N 3.09Å; Y899-M1000 HydrophobicContact CD1-CB 3.62Å; Y899-M1000 HydrophobicContact CD1-CE 4Å; Y899-M1000 HydrophobicContact CD1-CG 4.45Å; Y899-M1000 HydrophobicContact CD1-SD 4.03Å; Y899-M1000 HydrophobicContact CE1-CB 3.38Å; Y899-M1000 WeakPolarHBondContact CE1-O 3.48Å; Y899-M1000 PolarHBondContact OH-O 3.21Å
900	A	98.4	Very high	97	Very high	11 Å²	11	59.6 Å²	59.6	9%	0.091	30%	0.304	C	S	.	.	H	α-helix	trans	-59.8	-42.5	174.4	0	0	0	0	0	112.4	T850 V854 I896 A897 Y902 Q903 A904 M1000	T850-A900 HydrophobicContact CG2-CB 3.38Å; V854-A900 HydrophobicContact CG2-CB 3.42Å; V854-A900 VanDerWaalsContact CG2-CB 3.42Å; I896-A900 WeakPolarHBondContact O-CB 3.37Å; I896-A900 PolarHBondContact O-N 3.1Å; A897-A900 PolarHBondContact O-N 2.88Å; A900-Y902 VanDerWaalsContact C-N 3.32Å; A900-Y902 PolarHBondContact O-N 3.37Å; A900-Q903 PolarHBondContact O-N 3.41Å; A900-A904 WeakPolarHBondContact O-CB 3.34Å; A900-A904 PolarHBondContact O-N 3.13Å; A900-M1000 HydrophobicContact CB-CE 4.36Å
901	Q	98.3	Very high	96.6	Very high	134 Å²	134	59 Å²	59	63%	0.626	30%	0.301	S	S	*	.	H	α-helix	trans	-59.9	-41.1	172.7	-72.7	167.9	1.2	0	0	111.8	A897 Y899 S905	A897-Q901 VanDerWaalsContact O-CG 3.29Å; A897-Q901 WeakPolarHBondContact O-CG 3.19Å; A897-Q901 PolarHBondContact O-N 2.83Å; Y899-Q901 VanDerWaalsContact C-N 3.34Å; Y899-Q901 PolarHBondContact O-N 3.49Å; Q901-S905 VanDerWaalsContact O-CB 3.3Å; Q901-S905 WeakPolarHBondContact O-CB 3.25Å; Q901-S905 PolarHBondContact O-N 3.15Å; Q901-S905 PolarHBondContact O-OG 2.7Å
902	Y	98.6	Very high	96.2	Very high	52 Å²	52	57.2 Å²	57.2	20%	0.204	29%	0.294	C	S	.	.	H	α-helix	trans	-65.4	-47.5	174.2	168.5	-100.7	0	0	0	112.5	K898 Y899 A900 A904 S905 S906 I946 K947 V1002	K898-Y902 PolarHBondContact O-N 3.11Å; Y899-Y902 HydrophobicContact CD2-CD1 4.28Å; Y899-Y902 AromaticContact CE2-CD1 3.78Å; Y899-Y902 HydrophobicContact CE2-CD1 3.78Å; Y899-Y902 HydrophobicContact CE2-CE1 4.24Å; Y899-Y902 WeakPolarHBondContact O-CB 3.48Å; Y899-Y902 PolarHBondContact O-N 3.03Å; Y899-Y902 VanDerWaalsContact O-N 3.12Å; A900-Y902 VanDerWaalsContact C-N 3.32Å; A900-Y902 PolarHBondContact O-N 3.37Å; Y902-A904 VanDerWaalsContact C-N 3.34Å; Y902-A904 PolarHBondContact O-N 3.45Å; Y902-S905 WeakPolarHBondContact CA-OG 3.41Å; Y902-S905 PolarHBondContact O-N 3.34Å; Y902-S905 PolarHBondContact O-OG 3.32Å; Y902-S906 VanDerWaalsContact O-CB 3.23Å; Y902-S906 WeakPolarHBondContact O-CB 3.49Å; Y902-S906 PolarHBondContact O-N 3.17Å; Y902-I946 WeakPolarHBondContact OH-CA 3.45Å; Y902-K947 HydrophobicContact CD1-CB 4.14Å; Y902-K947 HydrophobicContact CD2-CD 4.5Å; Y902-K947 HydrophobicContact CE1-CB 3.63Å; Y902-K947 HydrophobicContact CE1-CG 4.46Å; Y902-K947 WeakPolarHBondContact CE1-O 3.49Å; Y902-K947 HydrophobicContact CE2-CD 4.45Å; Y902-K947 PolarHBondContact OH-N 3.38Å; Y902-V1002 HydrophobicContact CD1-CG1 4.35Å; Y902-V1002 HydrophobicContact CE1-CG1 3.69Å; Y902-V1002 HydrophobicContact CE1-CG2 4.22Å
903	Q	98.3	Very high	95.7	Very high	14 Å²	14	58 Å²	58	7%	0.065	29%	0.292	C	S	.	.	H	α-helix	trans	-60.4	-43.4	179.7	-166.3	-174.9	34.3	0	0	111.3	T850 Y899 A900 F907 K1001 V1002 C1098 N1099	T850-Q903 PolarHBondContact OG1-OE1 3.33Å; Y899-Q903 HydrophobicContact CE1-CB 4.17Å; Y899-Q903 PolarHBondContact O-N 2.68Å; A900-Q903 PolarHBondContact O-N 3.41Å; Q903-F907 PolarHBondContact O-N 3.12Å; Q903-K1001 PolarHBondContact NE2-O 3.21Å; Q903-V1002 HydrophobicContact CB-CG1 4.47Å; Q903-V1002 HydrophobicContact CG-CG1 4.14Å; Q903-C1098 PolarHBondContact NE2-O 3.28Å; Q903-N1099 PolarHBondContact NE2-OD1 3.25Å
904	A	96.1	Very high	95	Very high	50 Å²	50	57 Å²	57	41%	0.413	29%	0.287	S	S	.	.	H	α-helix	trans	-71.5	-41.5	178.9	0	0	0	0	0	113.3	A900 Y902 F907 Q908	A900-A904 WeakPolarHBondContact O-CB 3.34Å; A900-A904 PolarHBondContact O-N 3.13Å; Y902-A904 VanDerWaalsContact C-N 3.34Å; Y902-A904 PolarHBondContact O-N 3.45Å; A904-F907 PolarHBondContact O-N 3.43Å; A904-Q908 WeakPolarHBondContact O-CG 3.46Å; A904-Q908 PolarHBondContact O-N 2.82Å
905	S	97	Very high	94.3	Very high	56 Å²	56	59.1 Å²	59.1	39%	0.392	30%	0.298	S	S	.	.	H	α-helix	trans	-69.2	-35.1	177.2	54.5	0	0	0	0	112.4	Q901 Y902 Q908 E909	Q901-S905 VanDerWaalsContact O-CB 3.3Å; Q901-S905 WeakPolarHBondContact O-CB 3.25Å; Q901-S905 PolarHBondContact O-N 3.15Å; Q901-S905 PolarHBondContact O-OG 2.7Å; Y902-S905 WeakPolarHBondContact CA-OG 3.41Å; Y902-S905 PolarHBondContact O-N 3.34Å; Y902-S905 PolarHBondContact O-OG 3.32Å; S905-Q908 PolarHBondContact O-N 3.17Å; S905-E909 VanDerWaalsContact O-CB 3.3Å; S905-E909 WeakPolarHBondContact O-CB 3.29Å; S905-E909 PolarHBondContact O-N 3.13Å
906	S	97.3	Very high	93.7	Very high	16 Å²	16	63.2 Å²	63.2	11%	0.112	32%	0.315	C	S	.	.	H	α-helix	trans	-59	-42.4	169.6	168.2	0	0	0	0	112.4	Y902 E909 S910 W1097	Y902-S906 VanDerWaalsContact O-CB 3.23Å; Y902-S906 WeakPolarHBondContact O-CB 3.49Å; Y902-S906 PolarHBondContact O-N 3.17Å; S906-E909 PolarHBondContact O-N 2.87Å; S906-S910 PolarHBondContact O-N 3.1Å; S906-W1097 PolarHBondContact OG-NE1 3.49Å
907	F	93.7	Very high	92.9	Very high	96 Å²	96	68.4 Å²	68.4	42%	0.421	34%	0.338	S	S	.	.	H	α-helix	trans	-65.4	-46.4	176.2	178.8	-117.8	0	0	0	111.8	Q903 A904 E909 S910 L911 W1097	Q903-F907 PolarHBondContact O-N 3.12Å; A904-F907 PolarHBondContact O-N 3.43Å; F907-E909 VanDerWaalsContact C-N 3.32Å; F907-E909 PolarHBondContact O-N 3.05Å; F907-S910 PolarHBondContact O-N 3.37Å; F907-L911 HydrophobicContact CD1-CD1 4.11Å; F907-L911 HydrophobicContact CE1-CD1 3.67Å; F907-L911 HydrophobicContact CE2-CD1 4.22Å; F907-L911 HydrophobicContact CE2-CG 4.4Å; F907-L911 HydrophobicContact CZ-CD1 3.74Å; F907-L911 HydrophobicContact CZ-CG 4.38Å; F907-L911 WeakPolarHBondContact O-CG 3.33Å; F907-L911 PolarHBondContact O-N 2.91Å; F907-L911 VanDerWaalsContact O-N 3.09Å; F907-W1097 HydrophobicContact CB-CD2 4.1Å; F907-W1097 HydrophobicContact CB-CG 4.21Å; F907-W1097 HydrophobicContact CB-CZ2 4.46Å; F907-W1097 AromaticContact CD2-CD2 3.71Å; F907-W1097 HydrophobicContact CD2-CD2 3.71Å; F907-W1097 AromaticContact CD2-CE3 3.56Å; F907-W1097 HydrophobicContact CD2-CE3 3.56Å; F907-W1097 HydrophobicContact CD2-CG 4.31Å; F907-W1097 HydrophobicContact CD2-CH2 4.27Å; F907-W1097 HydrophobicContact CD2-CZ2 4.37Å; F907-W1097 AromaticContact CD2-CZ3 3.87Å; F907-W1097 HydrophobicContact CD2-CZ3 3.87Å; F907-W1097 HydrophobicContact CE2-CE3 4.14Å; F907-W1097 HydrophobicContact CE2-CZ3 4.35Å; F907-W1097 HydrophobicContact CG-CD2 4.35Å
908	Q	93.4	Very high	91.5	Very high	114 Å²	114	75.4 Å²	75.4	53%	0.533	36%	0.361	S	S	.	.	H	α-helix	trans	-63.1	-35.9	176.2	-69.8	178.4	-6	0	0	113	A904 S905 L911 R912	A904-Q908 WeakPolarHBondContact O-CG 3.46Å; A904-Q908 PolarHBondContact O-N 2.82Å; S905-Q908 PolarHBondContact O-N 3.17Å; Q908-L911 PolarHBondContact O-N 3.2Å; Q908-R912 WeakPolarHBondContact O-CG 3.35Å; Q908-R912 PolarHBondContact O-N 3.47Å; Q908-R912 VanDerWaalsContact O-N 3.1Å; Q908-R912 PolarHBondContact O-NH1 3.48Å
909	E	92.3	Very high	90.1	Very high	74 Å²	74	73.8 Å²	73.8	35%	0.346	36%	0.361	S	S	.	.	H	α-helix	trans	-63.5	-48.9	174.8	-174	-170.1	-135.7	0	0	111.2	S905 S906 F907 L911 R912 E913 K944	S905-E909 VanDerWaalsContact O-CB 3.3Å; S905-E909 WeakPolarHBondContact O-CB 3.29Å; S905-E909 PolarHBondContact O-N 3.13Å; S906-E909 PolarHBondContact O-N 2.87Å; F907-E909 VanDerWaalsContact C-N 3.32Å; F907-E909 PolarHBondContact O-N 3.05Å; E909-L911 VanDerWaalsContact C-N 3.27Å; E909-L911 PolarHBondContact O-N 3.35Å; E909-R912 PolarHBondContact O-N 3.27Å; E909-E913 PolarHBondContact O-N 3.49Å; E909-K944 VanDerWaalsContact CD-NZ 3.26Å; E909-K944 IonicContact OE1-NZ 3.83Å; E909-K944 WeakPolarHBondContact OE2-CE 3.15Å; E909-K944 IonicContact OE2-NZ 2.71Å; E909-K944 PolarHBondContact OE2-NZ 3.46Å
910	S	91.6	Very high	88.2	Confident	42 Å²	42	79.1 Å²	79.1	29%	0.294	39%	0.386	S	S	.	.	H	α-helix	trans	-61.5	-34.5	177.6	-168.6	0	0	0	0	112.9	S906 F907 E914 W1097	S906-S910 PolarHBondContact O-N 3.1Å; F907-S910 PolarHBondContact O-N 3.37Å; S910-E914 WeakPolarHBondContact O-CB 3.36Å; S910-E914 PolarHBondContact O-N 3.36Å; S910-W1097 VanDerWaalsContact CB-CH2 3.44Å
911	L	87.5	Confident	86.1	Confident	71 Å²	71	86.8 Å²	86.8	37%	0.372	42%	0.419	S	S	.	.	H	α-helix	trans	-69.7	-33.1	174.6	-71.3	174.3	0	0	0	112.6	F907 Q908 E909 N915	F907-L911 HydrophobicContact CD1-CD1 4.11Å; F907-L911 HydrophobicContact CE1-CD1 3.67Å; F907-L911 HydrophobicContact CE2-CD1 4.22Å; F907-L911 HydrophobicContact CE2-CG 4.4Å; F907-L911 HydrophobicContact CZ-CD1 3.74Å; F907-L911 HydrophobicContact CZ-CG 4.38Å; F907-L911 WeakPolarHBondContact O-CG 3.33Å; F907-L911 PolarHBondContact O-N 2.91Å; F907-L911 VanDerWaalsContact O-N 3.09Å; Q908-L911 PolarHBondContact O-N 3.2Å; E909-L911 VanDerWaalsContact C-N 3.27Å; E909-L911 PolarHBondContact O-N 3.35Å; L911-N915 WeakPolarHBondContact O-CB 3.35Å; L911-N915 VanDerWaalsContact O-CG 3.31Å; L911-N915 PolarHBondContact O-N 3.17Å; L911-N915 VanDerWaalsContact O-N 3.13Å; L911-N915 PolarHBondContact O-ND2 3.21Å
912	R	90.3	Very high	83.7	Confident	122 Å²	122	88.1 Å²	88.1	46%	0.46	42%	0.423	S	S	.	.	H	α-helix	trans	-68.7	-50	170.9	-71.5	-172.2	-58.2	-88.2	1.4	110.8	Q908 E909 E914 N915 E916	Q908-R912 WeakPolarHBondContact O-CG 3.35Å; Q908-R912 PolarHBondContact O-N 3.47Å; Q908-R912 VanDerWaalsContact O-N 3.1Å; Q908-R912 PolarHBondContact O-NH1 3.48Å; E909-R912 PolarHBondContact O-N 3.27Å; R912-E914 PolarHBondContact O-N 2.98Å; R912-N915 PolarHBondContact O-N 3.37Å; R912-N915 VanDerWaalsContact O-N 3.11Å; R912-E916 WeakPolarHBondContact O-CB 3.42Å; R912-E916 WeakPolarHBondContact O-CG 3.46Å; R912-E916 PolarHBondContact O-N 3.36Å
913	E	87.8	Confident	81.2	Confident	65 Å²	65	91.4 Å²	91.4	30%	0.304	44%	0.444	S	S	.	.	H	α-helix	trans	-53.6	-37.4	176.2	-81.2	-164.7	-136.9	0	0	112.9	E909 K917 K944	E909-E913 PolarHBondContact O-N 3.49Å; E913-K917 WeakPolarHBondContact O-CD 3.46Å; E913-K917 WeakPolarHBondContact O-CE 3.46Å; E913-K917 WeakPolarHBondContact O-CG 3.42Å; E913-K917 PolarHBondContact O-N 3.46Å; E913-K917 PolarHBondContact O-NZ 3.23Å; E913-K917 IonicContact OE2-NZ 2.91Å; E913-K917 PolarHBondContact OE2-NZ 2.85Å; E913-K944 IonicContact OE1-NZ 3.07Å; E913-K944 PolarHBondContact OE1-NZ 2.94Å
914	E	83.5	Confident	78.8	Confident	87 Å²	87	98.2 Å²	98.2	41%	0.407	48%	0.476	S	S	.	.	H	α-helix	trans	-74.7	-43.5	177.2	-162.8	-168.8	158.6	0	0	112.1	S910 R912 K917 R918	S910-E914 WeakPolarHBondContact O-CB 3.36Å; S910-E914 PolarHBondContact O-N 3.36Å; R912-E914 PolarHBondContact O-N 2.98Å; E914-K917 PolarHBondContact O-N 2.95Å; E914-R918 WeakPolarHBondContact O-CG 3.47Å; E914-R918 PolarHBondContact O-N 3.49Å; E914-R918 VanDerWaalsContact O-N 3.1Å; E914-R918 IonicContact OE1-CZ 3.38Å; E914-R918 VanDerWaalsContact OE1-CZ 3.31Å; E914-R918 IonicContact OE1-NE 2.7Å; E914-R918 PolarHBondContact OE1-NE 3.13Å; E914-R918 IonicContact OE1-NH2 3.96Å; E914-R918 PolarHBondContact OE1-NH2 3.3Å
915	N	83.6	Confident	76.1	Confident	89 Å²	89	100.4 Å²	100.4	48%	0.476	49%	0.488	S	S	.	.	H	α-helix	trans	-64.3	-41.6	177.1	-76.4	-44.2	0	0	0	112	L911 R912 K917 R918 T919	L911-N915 WeakPolarHBondContact O-CB 3.35Å; L911-N915 VanDerWaalsContact O-CG 3.31Å; L911-N915 PolarHBondContact O-N 3.17Å; L911-N915 VanDerWaalsContact O-N 3.13Å; L911-N915 PolarHBondContact O-ND2 3.21Å; R912-N915 PolarHBondContact O-N 3.37Å; R912-N915 VanDerWaalsContact O-N 3.11Å; N915-K917 VanDerWaalsContact C-N 3.32Å; N915-K917 PolarHBondContact O-N 2.93Å; N915-R918 CarbonylContact O-C 3.57Å; N915-R918 WeakPolarHBondContact O-CA 3.45Å; N915-R918 WeakPolarHBondContact O-CB 3.42Å; N915-R918 PolarHBondContact O-N 2.85Å; N915-R918 VanDerWaalsContact O-N 3.08Å; N915-T919 PolarHBondContact O-N 2.76Å; N915-T919 PolarHBondContact O-OG1 3.34Å
916	E	87	Confident	73.5	Confident	107 Å²	107	104.1 Å²	104.1	50%	0.5	50%	0.503	S	S	.	.	H	α-helix	trans	-59.5	-41.2	176.5	-73.5	164.2	-156.3	0	0	112	R912 R918 T919 Q920	R912-E916 WeakPolarHBondContact O-CB 3.42Å; R912-E916 WeakPolarHBondContact O-CG 3.46Å; R912-E916 PolarHBondContact O-N 3.36Å; E916-R918 VanDerWaalsContact C-N 3.35Å; E916-R918 PolarHBondContact O-N 2.7Å; E916-T919 PolarHBondContact O-N 3.29Å; E916-Q920 WeakPolarHBondContact O-CG 3.49Å; E916-Q920 PolarHBondContact O-N 3.24Å
917	K	79.6	Confident	70.6	Confident	109 Å²	109	110.9 Å²	110.9	47%	0.474	54%	0.538	S	S	.	.	H	α-helix	trans	-63.7	-39	173.9	-68.7	159.7	-162.7	152.1	0	111.5	E913 E914 N915 H921	E913-K917 WeakPolarHBondContact O-CD 3.46Å; E913-K917 WeakPolarHBondContact O-CE 3.46Å; E913-K917 WeakPolarHBondContact O-CG 3.42Å; E913-K917 PolarHBondContact O-N 3.46Å; E913-K917 PolarHBondContact O-NZ 3.23Å; E913-K917 IonicContact OE2-NZ 2.91Å; E913-K917 PolarHBondContact OE2-NZ 2.85Å; E914-K917 PolarHBondContact O-N 2.95Å; N915-K917 VanDerWaalsContact C-N 3.32Å; N915-K917 PolarHBondContact O-N 2.93Å; K917-H921 PolarHBondContact O-CD2 3.07Å; K917-H921 PolarHBondContact O-N 2.98Å
918	R	70.5	Confident	67.8	Low	160 Å²	160	115.2 Å²	115.2	60%	0.604	56%	0.56	S	S	*	*	H	α-helix	trans	-66.9	-33.1	174.5	-66.5	167.7	178	-139.2	4.6	112.6	E914 N915 E916	E914-R918 WeakPolarHBondContact O-CG 3.47Å; E914-R918 PolarHBondContact O-N 3.49Å; E914-R918 VanDerWaalsContact O-N 3.1Å; E914-R918 IonicContact OE1-CZ 3.38Å; E914-R918 VanDerWaalsContact OE1-CZ 3.31Å; E914-R918 IonicContact OE1-NE 2.7Å; E914-R918 PolarHBondContact OE1-NE 3.13Å; E914-R918 IonicContact OE1-NH2 3.96Å; E914-R918 PolarHBondContact OE1-NH2 3.3Å; N915-R918 CarbonylContact O-C 3.57Å; N915-R918 WeakPolarHBondContact O-CA 3.45Å; N915-R918 WeakPolarHBondContact O-CB 3.42Å; N915-R918 PolarHBondContact O-N 2.85Å; N915-R918 VanDerWaalsContact O-N 3.08Å; E916-R918 VanDerWaalsContact C-N 3.35Å; E916-R918 PolarHBondContact O-N 2.7Å
919	T	69.4	Low	65.1	Low	76 Å²	76	114.6 Å²	114.6	47%	0.466	57%	0.568	S	S	.	*	H	α-helix	trans	-76.5	-45.4	176.3	-47.5	0	0	0	0	111.9	N915 E916 H921 K922 D923	N915-T919 PolarHBondContact O-N 2.76Å; N915-T919 PolarHBondContact O-OG1 3.34Å; E916-T919 PolarHBondContact O-N 3.29Å; T919-H921 VanDerWaalsContact C-N 3.25Å; T919-H921 PolarHBondContact O-N 3.28Å; T919-K922 WeakPolarHBondContact O-CA 3.25Å; T919-K922 WeakPolarHBondContact O-CB 3.3Å; T919-K922 PolarHBondContact O-N 3.29Å; T919-D923 PolarHBondContact O-N 3.02Å
920	Q	58.7	Low	62.4	Low	117 Å²	117	117.5 Å²	117.5	55%	0.547	59%	0.591	S	S	.	*	H	α-helix	trans	-60.3	-34.6	179.7	-73.9	173.9	4	0	0	112.7	E916 K922 D923 H924	E916-Q920 WeakPolarHBondContact O-CG 3.49Å; E916-Q920 PolarHBondContact O-N 3.24Å; Q920-K922 PolarHBondContact O-N 2.73Å; Q920-K922 VanDerWaalsContact O-N 3.16Å; Q920-D923 PolarHBondContact O-N 2.98Å; Q920-H924 PolarHBondContact O-ND1 2.82Å
921	H	54.7	Low	59.3	Low	171 Å²	171	121.6 Å²	121.6	79%	0.792	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65	-8.3	171.2	-92.3	-64.1	0	0	0	114.9	K917 T919	K917-H921 PolarHBondContact O-CD2 3.07Å; K917-H921 PolarHBondContact O-N 2.98Å; T919-H921 VanDerWaalsContact C-N 3.25Å; T919-H921 PolarHBondContact O-N 3.28Å
922	K	47.8	Very low	56.8	Low	163 Å²	163	123.2 Å²	123.2	71%	0.709	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104	-25.1	-178.1	-148.2	-179.4	-176.6	-171.1	0	113.4	T919 Q920	T919-K922 WeakPolarHBondContact O-CA 3.25Å; T919-K922 WeakPolarHBondContact O-CB 3.3Å; T919-K922 PolarHBondContact O-N 3.29Å; Q920-K922 PolarHBondContact O-N 2.73Å; Q920-K922 VanDerWaalsContact O-N 3.16Å
923	D	45.4	Very low	54.1	Low	120 Å²	120	125.8 Å²	125.8	64%	0.642	65%	0.654	S	S	*	*	S	Bend	trans	-94.5	3.5	-176.9	-56	-34.4	0	0	0	113.5	T919 Q920	T919-D923 PolarHBondContact O-N 3.02Å; Q920-D923 PolarHBondContact O-N 2.98Å
924	H	47.3	Very low	51.4	Low	158 Å²	158	130.4 Å²	130.4	73%	0.731	68%	0.681	S	S	*	*			trans	-116.2	21.8	-174.3	-76.6	73.1	0	0	0	114.1	Q920	Q920-H924 PolarHBondContact O-ND1 2.82Å
925	S	40.3	Very low	48.9	Very low	96 Å²	96	132.1 Å²	132.1	67%	0.671	70%	0.703	S	S	*	*	S	Bend	trans	-80	-24.5	177	55.3	0	0	0	0	114.2
926	D	42.6	Very low	46.3	Very low	133 Å²	133	130.5 Å²	130.5	71%	0.711	71%	0.707	S	S	*	*	S	Bend	trans	-122.7	56.9	-159.4	-69.2	31.7	0	0	0	113
927	N	35.6	Very low	44	Very low	158 Å²	158	137.3 Å²	137.3	85%	0.845	73%	0.728	S	S	*	*	S	Bend	trans	-176.5	156.1	139.7	-103.8	-50.6	0	0	0	116.9
928	E	34.1	Very low	42	Very low	188 Å²	188	143.9 Å²	143.9	88%	0.879	75%	0.75	S	S	*	*			trans	58.7	133.7	165.5	-65.9	-158.6	130.9	0	0	121.4
929	S	38	Very low	40.7	Very low	101 Å²	101	147.4 Å²	147.4	71%	0.706	76%	0.763	S	S	*	*			trans	-98.7	175.3	172.9	56.7	0	0	0	0	112.2
930	T	34.2	Very low	40.1	Very low	134 Å²	134	148.2 Å²	148.2	82%	0.822	76%	0.76	S	S	*	*			trans	62.3	95.8	161.7	50.6	0	0	0	0	118.5
931	S	28.3	Very low	39.9	Very low	128 Å²	128	144.8 Å²	144.8	90%	0.895	76%	0.757	S	S	*	*				-152.2	152.7	124.2	51.2	0	0	0	0	110.5
932	S	33.2	Very low	40.9	Very low	105 Å²	105	142.8 Å²	142.8	73%	0.734	76%	0.759	S	S	*	*			trans	-105.5	157.9	-169.9	54.2	0	0	0	0	113.3
933	E	35.3	Very low	42.9	Very low	176 Å²	176	136.8 Å²	136.8	82%	0.822	73%	0.733	S	S	*	*			trans	43.8	87.8	156.5	-63.2	-171.2	133.7	0	0	118.2
934	N	30.3	Very low	45.2	Very low	162 Å²	162	135.1 Å²	135.1	87%	0.866	72%	0.72	S	S	*	*			trans	-162.9	110.5	132.5	-112.1	-69.2	0	0	0	112.5
935	S	30.3	Very low	47.6	Very low	124 Å²	124	131.7 Å²	131.7	87%	0.867	71%	0.71	S	S	*	*			trans	-126.7	47.1	168	58.6	0	0	0	0	111.9
936	G	30.5	Very low	50.3	Low	55 Å²	55	127.5 Å²	127.5	57%	0.567	68%	0.68	S	S	*	*			trans	-51.8	147.8	165.8	0	0	0	0	0	111.6	R938	G936-R938 PolarHBondContact O-N 2.81Å
937	R	38.7	Very low	53	Low	250 Å²	250	125.9 Å²	125.9	94%	0.943	67%	0.667	S	S	*	*			trans	-40.4	101.7	-172.5	-66.5	175.3	177.3	167.3	-2.1	112.9	R939	R937-R939 PolarHBondContact O-N 3.3Å
938	R	36.9	Very low	56	Low	247 Å²	247	118.6 Å²	118.6	93%	0.932	63%	0.628	S	S	*	*			trans	-59.6	112.4	163.5	-78.1	-174.2	174.8	-179	-1.2	107.3	G936 K940	G936-R938 PolarHBondContact O-N 2.81Å; R938-K940 PolarHBondContact O-N 3.02Å
939	R	43.9	Very low	59.1	Low	234 Å²	234	109.6 Å²	109.6	88%	0.883	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-55.1	132.6	167.6	-70.3	179.3	173.7	172.2	-3	107.6	R937 G941	R937-R939 PolarHBondContact O-N 3.3Å; R939-G941 PolarHBondContact O-N 2.96Å
940	K	56	Low	61.9	Low	92 Å²	92	105.1 Å²	105.1	40%	0.4	55%	0.554	S	S	.	*	P	Polyproline II helix	trans	-55.9	124.7	164.3	-74.3	-176.5	175.2	-178.6	0	106	E874 R938	E874-K940 IonicContact OE2-NZ 2.76Å; E874-K940 PolarHBondContact OE2-NZ 3.33Å; R938-K940 PolarHBondContact O-N 3.02Å
941	G	54.9	Low	64.7	Low	46 Å²	46	101.9 Å²	101.9	47%	0.474	53%	0.531	S	S	.	.	P	Polyproline II helix	trans	-67.5	171.9	-178	0	0	0	0	0	111.9	R939 F943	R939-G941 PolarHBondContact O-N 2.96Å; G941-F943 PolarHBondContact O-N 3.29Å
942	P	75.3	Confident	68.1	Low	129 Å²	129	95.8 Å²	95.8	84%	0.838	49%	0.489	S	S	*	.	P	Polyproline II helix	trans	-56.3	127.3	173.5	25.5	-34	0	0	0	110
943	F	90.1	Very high	71.1	Confident	36 Å²	36	92.4 Å²	92.4	16%	0.158	46%	0.463	C	S	.	.	P	Polyproline II helix	trans	-65.1	140.9	-178	-62.8	-76.7	0	0	0	111.2	L868 L869 Q870 W876 G941 T945	L868-F943 HydrophobicContact CB-CB 3.98Å; L868-F943 HydrophobicContact CD1-CD2 4.43Å; L868-F943 HydrophobicContact CD2-CB 4.39Å; L869-F943 WeakPolarHBondContact O-CD1 3.36Å; Q870-F943 HydrophobicContact CG-CD1 3.96Å; Q870-F943 HydrophobicContact CG-CE1 4.1Å; Q870-F943 HydrophobicContact CG-CG 4.27Å; W876-F943 HydrophobicContact CB-CE2 3.83Å; W876-F943 HydrophobicContact CB-CZ 3.74Å; W876-F943 AromaticContact CD1-CZ 4Å; W876-F943 HydrophobicContact CG-CE2 4.47Å; W876-F943 AromaticContact CG-CZ 3.89Å; W876-F943 HydrophobicContact CG-CZ 3.89Å; G941-F943 PolarHBondContact O-N 3.29Å; F943-T945 PolarHBondContact O-N 3.29Å
944	K	93.7	Very high	74.1	Confident	86 Å²	86	84 Å²	84	37%	0.374	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-66.5	124.7	178.7	-170.2	173.1	-174.2	179	0	109.7	L869 E909 E913	L869-K944 HydrophobicContact CB-CB 4.29Å; L869-K944 WeakPolarHBondContact CB-O 3.23Å; L869-K944 HydrophobicContact CD2-CB 4.21Å; L869-K944 PolarHBondContact N-O 3.08Å; E909-K944 VanDerWaalsContact CD-NZ 3.26Å; E909-K944 IonicContact OE1-NZ 3.83Å; E909-K944 WeakPolarHBondContact OE2-CE 3.15Å; E909-K944 IonicContact OE2-NZ 2.71Å; E909-K944 PolarHBondContact OE2-NZ 3.46Å; E913-K944 IonicContact OE1-NZ 3.07Å; E913-K944 PolarHBondContact OE1-NZ 2.94Å
945	T	96.6	Very high	77.3	Confident	86 Å²	86	78.4 Å²	78.4	53%	0.528	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	132.5	175.7	-49.5	0	0	0	0	110.6	T866 Q867 F943	T866-T945 HydrophobicContact CG2-CG2 3.42Å; T866-T945 VanDerWaalsContact CG2-CG2 3.42Å; Q867-T945 WeakPolarHBondContact O-CA 3.45Å; F943-T945 PolarHBondContact O-N 3.29Å
946	I	98.3	Very high	80.4	Confident	8 Å²	8	74.7 Å²	74.7	4%	0.041	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	164.1	177.2	53.8	168.7	0	0	0	110.7	T866 Q867 L869 Y902 V1002 G1004	T866-I946 WeakPolarHBondContact CA-O 3.37Å; Q867-I946 HydrophobicContact CB-CD1 4.42Å; Q867-I946 HydrophobicContact CB-CG1 4.05Å; Q867-I946 PolarHBondContact N-O 3.26Å; Q867-I946 WeakPolarHBondContact O-CG1 3.31Å; Q867-I946 PolarHBondContact O-N 3.04Å; L869-I946 HydrophobicContact CB-CD1 4.37Å; L869-I946 HydrophobicContact CB-CG1 4.49Å; L869-I946 HydrophobicContact CB-CG2 4.04Å; Y902-I946 WeakPolarHBondContact OH-CA 3.45Å; I946-V1002 HydrophobicContact CB-CG2 4.06Å; I946-V1002 HydrophobicContact CG2-CG2 4.26Å; I946-G1004 WeakPolarHBondContact CD1-O 3.41Å
947	K	98.7	Very high	83.5	Confident	99 Å²	99	76.8 Å²	76.8	43%	0.43	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	140.3	174.7	-61.7	176.6	-177.9	178	0	109	V864 R865 Y899 Y902 V1002	V864-K947 HydrophobicContact CG1-CB 3.78Å; V864-K947 HydrophobicContact CG1-CD 4.34Å; V864-K947 HydrophobicContact CG1-CG 4.17Å; R865-K947 CarbonylContact O-C 3.57Å; R865-K947 WeakPolarHBondContact O-CA 3.39Å; Y899-K947 HydrophobicContact CE2-CB 4.22Å; Y899-K947 PolarHBondContact OH-O 2.85Å; Y902-K947 HydrophobicContact CD1-CB 4.14Å; Y902-K947 HydrophobicContact CD2-CD 4.5Å; Y902-K947 HydrophobicContact CE1-CB 3.63Å; Y902-K947 HydrophobicContact CE1-CG 4.46Å; Y902-K947 WeakPolarHBondContact CE1-O 3.49Å; Y902-K947 HydrophobicContact CE2-CD 4.45Å; Y902-K947 PolarHBondContact OH-N 3.38Å; K947-V1002 WeakPolarHBondContact O-CG2 3.38Å
948	F	98.8	Very high	86.2	Confident	4 Å²	4	74.3 Å²	74.3	2%	0.018	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	116.8	178.7	168.1	-153	0	0	0	109	V864 R865 Y899 Y999 K1001 R1006	V864-F948 CarbonylContact C-O 3.58Å; V864-F948 WeakPolarHBondContact CA-O 3.32Å; R865-F948 HydrophobicContact CB-CB 4.37Å; R865-F948 HydrophobicContact CB-CD1 4.4Å; R865-F948 PolarHBondContact N-O 3.42Å; R865-F948 PolarHBondContact O-N 3.37Å; Y899-F948 WeakPolarHBondContact OH-CA 3.49Å; F948-Y999 HydrophobicContact CE2-CD1 4.1Å; F948-Y999 AromaticContact CZ-CD1 3.79Å; F948-Y999 HydrophobicContact CZ-CD1 3.79Å; F948-K1001 HydrophobicContact CD2-CG 3.94Å; F948-K1001 HydrophobicContact CE2-CD 4.23Å; F948-K1001 HydrophobicContact CE2-CG 3.68Å; F948-R1006 WeakPolarHBondContact CD1-O 3.48Å; F948-R1006 VanDerWaalsContact CE1-O 3.32Å; F948-R1006 WeakPolarHBondContact CE1-O 3.15Å
949	G	98.6	Very high	89	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	118.3	173.7	0	0	0	0	0	110	Y899 Y999 M1000	Y899-G949 VanDerWaalsContact CE2-N 3.25Å; Y899-G949 PolarHBondContact OH-N 3.19Å; Y899-G949 VanDerWaalsContact OH-N 3.09Å; G949-Y999 CarbonylContact O-C 3.58Å; G949-Y999 WeakPolarHBondContact O-CA 3.33Å; G949-M1000 PolarHBondContact N-O 2.86Å; G949-M1000 VanDerWaalsContact N-O 3.08Å; G949-M1000 PolarHBondContact O-N 3.03Å
950	T	97.1	Very high	91.6	Very high	6 Å²	6	56 Å²	56	4%	0.037	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	157.4	-167.1	-171.5	0	0	0	0	111.8	E863 R865 I952 Y999	E863-T950 HydrophobicContact CB-CG2 4.19Å; E863-T950 HydrophobicContact CG-CG2 4.42Å; E863-T950 PolarHBondContact O-N 3.21Å; R865-T950 HydrophobicContact CG-CG2 3.79Å; T950-I952 PolarHBondContact O-N 3.1Å; T950-I952 VanDerWaalsContact O-N 3.09Å; T950-Y999 WeakPolarHBondContact OG1-CD1 3.38Å; T950-Y999 VanDerWaalsContact OG1-CE1 3.32Å; T950-Y999 WeakPolarHBondContact OG1-CE1 3.3Å
951	N	94.3	Very high	93.6	Very high	66 Å²	66	58.4 Å²	58.4	35%	0.353	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	53.7	32.2	172.2	-52.4	96.2	0	0	0	114.1	D953 Q997 L998	N951-D953 PolarHBondContact O-N 2.94Å; N951-Q997 PolarHBondContact ND2-OE1 3.24Å; N951-L998 PolarHBondContact N-O 3.39Å
952	I	98.3	Very high	95.7	Very high	1 Å²	1	61.6 Å²	61.6	1%	0.005	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	124.7	-179.2	-52	169	0	0	0	108	V862 I896 T950 Q997 L998 M1000	V862-I952 HydrophobicContact CB-CD1 4.37Å; V862-I952 HydrophobicContact CB-CG1 4.22Å; V862-I952 HydrophobicContact CG1-CD1 3.85Å; V862-I952 HydrophobicContact CG1-CG1 3.88Å; V862-I952 HydrophobicContact CG2-CD1 3.8Å; V862-I952 HydrophobicContact CG2-CG1 3.95Å; V862-I952 HydrophobicContact CG2-CG2 4.4Å; I896-I952 HydrophobicContact CD1-CG2 3.94Å; I896-I952 HydrophobicContact CG1-CG2 4.28Å; T950-I952 PolarHBondContact O-N 3.1Å; T950-I952 VanDerWaalsContact O-N 3.09Å; I952-Q997 CarbonylContact O-C 3.56Å; I952-Q997 WeakPolarHBondContact O-CA 3.37Å; I952-L998 HydrophobicContact CB-CB 4.06Å; I952-L998 HydrophobicContact CB-CD2 4.27Å; I952-L998 HydrophobicContact CB-CG 4.47Å; I952-L998 WeakPolarHBondContact CB-O 3.35Å; I952-L998 HydrophobicContact CD1-CD2 3.97Å; I952-L998 HydrophobicContact CD1-CG 4.27Å; I952-L998 WeakPolarHBondContact CG1-O 3.29Å; I952-L998 HydrophobicContact CG2-CD2 4.2Å; I952-L998 PolarHBondContact N-O 2.64Å; I952-L998 PolarHBondContact O-N 3.27Å; I952-M1000 HydrophobicContact CD1-CB 4.39Å; I952-M1000 HydrophobicContact CD1-CG 3.72Å; I952-M1000 HydrophobicContact CD1-SD 3.6Å; I952-M1000 VanDerWaalsContact CD1-SD 3.6Å
953	D	97.7	Very high	96.8	Very high	34 Å²	34	55.8 Å²	55.8	18%	0.182	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	120	-168.1	-179.7	39.8	0	0	0	113.6	H860 N951 S955 W960 T995	H860-D953 PolarHBondContact CE1-O 3.13Å; H860-D953 PolarHBondContact NE2-O 2.98Å; H860-D953 VanDerWaalsContact NE2-O 3.17Å; N951-D953 PolarHBondContact O-N 2.94Å; D953-S955 VanDerWaalsContact OD1-CB 3.22Å; D953-S955 WeakPolarHBondContact OD1-CB 3.46Å; D953-S955 PolarHBondContact OD1-N 3.18Å; D953-S955 PolarHBondContact OD1-OG 3.39Å; D953-S955 VanDerWaalsContact OD2-CB 3.3Å; D953-S955 WeakPolarHBondContact OD2-CB 3.35Å; D953-S955 PolarHBondContact OD2-OG 2.93Å; D953-W960 PolarHBondContact O-NE1 2.93Å; D953-T995 PolarHBondContact OD1-OG1 2.96Å
954	L	98	Very high	97.2	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.275	C	S	.	.			trans	-99.2	15.2	173.9	-53.4	-173.1	0	0	0	113.3	F848 D956 W960 L964 V996 L998 I1101	F848-L954 HydrophobicContact CD1-CD1 4.25Å; F848-L954 HydrophobicContact CE1-CD1 4.13Å; L954-D956 VanDerWaalsContact C-N 3.32Å; L954-D956 PolarHBondContact O-N 2.95Å; L954-W960 VanDerWaalsContact CA-CD1 3.42Å; L954-W960 HydrophobicContact CB-CG 4.21Å; L954-W960 HydrophobicContact CD2-CD2 3.65Å; L954-W960 VanDerWaalsContact CD2-CE2 3.4Å; L954-W960 HydrophobicContact CD2-CE3 4.12Å; L954-W960 HydrophobicContact CD2-CG 4.04Å; L954-W960 HydrophobicContact CD2-CH2 4.11Å; L954-W960 HydrophobicContact CD2-CZ2 3.65Å; L954-W960 HydrophobicContact CD2-CZ3 4.33Å; L954-L964 WeakPolarHBondContact O-CD1 3.45Å; L954-V996 HydrophobicContact CB-CB 4.1Å; L954-V996 HydrophobicContact CB-CG1 4.34Å; L954-V996 WeakPolarHBondContact CB-O 3.33Å; L954-V996 HydrophobicContact CD1-CG1 3.92Å; L954-V996 HydrophobicContact CG-CG1 4.45Å; L954-V996 PolarHBondContact N-O 3.31Å; L954-L998 HydrophobicContact CD1-CB 3.98Å; L954-L998 HydrophobicContact CD2-CB 4.28Å; L954-L998 HydrophobicContact CD2-CD2 4.46Å; L954-L998 HydrophobicContact CG-CB 4.03Å; L954-I1101 HydrophobicContact CD1-CG2 4.32Å
955	S	96.3	Very high	97.4	Very high	43 Å²	43	57.6 Å²	57.6	30%	0.301	28%	0.284	S	S	.	.			trans	-59.3	-33.6	-178.3	72.7	0	0	0	0	115.4	D953 N957	D953-S955 VanDerWaalsContact OD1-CB 3.22Å; D953-S955 WeakPolarHBondContact OD1-CB 3.46Å; D953-S955 PolarHBondContact OD1-N 3.18Å; D953-S955 PolarHBondContact OD1-OG 3.39Å; D953-S955 VanDerWaalsContact OD2-CB 3.3Å; D953-S955 WeakPolarHBondContact OD2-CB 3.35Å; D953-S955 PolarHBondContact OD2-OG 2.93Å; S955-N957 PolarHBondContact O-N 3.43Å
956	D	96.6	Very high	97.5	Very high	47 Å²	47	54.2 Å²	54.2	25%	0.251	26%	0.262	S	S	.	.			trans	-73.4	95.7	-173.3	-173.2	-18.1	0	0	0	111.8	L954 K958 K959 W960	L954-D956 VanDerWaalsContact C-N 3.32Å; L954-D956 PolarHBondContact O-N 2.95Å; D956-K958 PolarHBondContact O-N 3.35Å; D956-K958 VanDerWaalsContact O-N 3.09Å; D956-K958 WeakPolarHBondContact OD1-CA 3.47Å; D956-K958 VanDerWaalsContact OD1-CB 3.27Å; D956-K958 WeakPolarHBondContact OD1-CB 3.17Å; D956-K958 PolarHBondContact OD1-N 3.25Å; D956-K959 HydrophobicContact CB-CB 4.08Å; D956-K959 HydrophobicContact CB-CD 4.16Å; D956-K959 HydrophobicContact CB-CG 4.17Å; D956-K959 PolarHBondContact O-N 3.3Å; D956-K959 PolarHBondContact OD1-N 3.38Å; D956-K959 WeakPolarHBondContact OD2-CD 3.32Å; D956-K959 WeakPolarHBondContact OD2-CE 3.41Å; D956-K959 WeakPolarHBondContact OD2-CG 3.34Å; D956-K959 IonicContact OD2-NZ 3.81Å; D956-K959 PolarHBondContact OD2-NZ 3.3Å; D956-W960 PolarHBondContact O-N 3.22Å
957	N	94.2	Very high	97.5	Very high	99 Å²	99	54.3 Å²	54.3	53%	0.529	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-11.3	177.8	-174.4	49.9	0	0	0	114.7	S955 K961 L964	S955-N957 PolarHBondContact O-N 3.43Å; N957-K961 WeakPolarHBondContact O-CB 3.34Å; N957-L964 HydrophobicContact CB-CD1 4.01Å
958	K	96.1	Very high	97.5	Very high	198 Å²	198	52.8 Å²	52.8	86%	0.861	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-39.8	168.5	-59	178.7	-179.2	176.1	0	110.8	D956	D956-K958 PolarHBondContact O-N 3.35Å; D956-K958 VanDerWaalsContact O-N 3.09Å; D956-K958 WeakPolarHBondContact OD1-CA 3.47Å; D956-K958 VanDerWaalsContact OD1-CB 3.27Å; D956-K958 WeakPolarHBondContact OD1-CB 3.17Å; D956-K958 PolarHBondContact OD1-N 3.25Å
959	K	96.8	Very high	97.5	Very high	97 Å²	97	56.3 Å²	56.3	42%	0.422	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-33	179.5	-69.8	-174.6	-177.5	95.9	0	113.8	N857 D956	N857-K959 PolarHBondContact ND2-O 2.95Å; N857-K959 VanDerWaalsContact ND2-O 3.11Å; N857-K959 WeakPolarHBondContact OD1-CB 3.35Å; N857-K959 WeakPolarHBondContact OD1-CD 3.25Å; N857-K959 VanDerWaalsContact OD1-CG 3.3Å; N857-K959 WeakPolarHBondContact OD1-CG 3.4Å; D956-K959 HydrophobicContact CB-CB 4.08Å; D956-K959 HydrophobicContact CB-CD 4.16Å; D956-K959 HydrophobicContact CB-CG 4.17Å; D956-K959 PolarHBondContact O-N 3.3Å; D956-K959 PolarHBondContact OD1-N 3.38Å; D956-K959 WeakPolarHBondContact OD2-CD 3.32Å; D956-K959 WeakPolarHBondContact OD2-CE 3.41Å; D956-K959 WeakPolarHBondContact OD2-CG 3.34Å; D956-K959 IonicContact OD2-NZ 3.81Å; D956-K959 PolarHBondContact OD2-NZ 3.3Å
960	W	98.1	Very high	97.5	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.277	C	S	.	.	S	Bend	trans	-123	24.3	-167.1	-54.9	121.2	0	0	0	113.5	L853 A856 N857 H860 I896 D953 L954 D956 L962 Q963 L964	L853-W960 HydrophobicContact CD2-CE3 4.5Å; L853-W960 HydrophobicContact CD2-CH2 4.05Å; L853-W960 HydrophobicContact CD2-CZ3 3.71Å; A856-W960 HydrophobicContact CB-CE3 4.41Å; A856-W960 HydrophobicContact CB-CZ3 3.88Å; N857-W960 HydrophobicContact CB-CH2 3.67Å; N857-W960 HydrophobicContact CB-CZ2 3.87Å; N857-W960 HydrophobicContact CB-CZ3 4.32Å; N857-W960 VanDerWaalsContact ND2-CH2 3.34Å; N857-W960 WeakPolarHBondContact ND2-CH2 3.32Å; N857-W960 WeakPolarHBondContact ND2-CZ3 3.44Å; H860-W960 HydrophobicContact CB-CZ2 4.43Å; H860-W960 AromaticContact CE1-NE1 3.78Å; H860-W960 AromaticContact CG-CZ2 3.98Å; H860-W960 AromaticContact ND1-CZ2 3.75Å; I896-W960 HydrophobicContact CD1-CH2 3.87Å; I896-W960 HydrophobicContact CD1-CZ2 4.13Å; D953-W960 PolarHBondContact O-NE1 2.93Å; L954-W960 VanDerWaalsContact CA-CD1 3.42Å; L954-W960 HydrophobicContact CB-CG 4.21Å; L954-W960 HydrophobicContact CD2-CD2 3.65Å; L954-W960 VanDerWaalsContact CD2-CE2 3.4Å; L954-W960 HydrophobicContact CD2-CE3 4.12Å; L954-W960 HydrophobicContact CD2-CG 4.04Å; L954-W960 HydrophobicContact CD2-CH2 4.11Å; L954-W960 HydrophobicContact CD2-CZ2 3.65Å; L954-W960 HydrophobicContact CD2-CZ3 4.33Å; D956-W960 PolarHBondContact O-N 3.22Å; W960-L962 VanDerWaalsContact C-N 3.3Å; W960-L962 PolarHBondContact O-N 3.29Å; W960-Q963 HydrophobicContact CB-CB 4.47Å; W960-Q963 PolarHBondContact O-N 3.11Å; W960-Q963 PolarHBondContact O-OE1 3.05Å; W960-L964 HydrophobicContact CB-CG 4.27Å; W960-L964 PolarHBondContact O-N 3.4Å
961	K	97.9	Very high	97.5	Very high	142 Å²	142	56.3 Å²	56.3	62%	0.617	28%	0.277	S	S	*	.	H	α-helix	trans	-50.1	-44.6	-173.4	-171.5	-178.3	176.5	-175.8	0	113.8	N957 H965	N957-K961 WeakPolarHBondContact O-CB 3.34Å; K961-H965 WeakPolarHBondContact O-CB 3.36Å; K961-H965 PolarHBondContact O-N 3.27Å
962	L	98.1	Very high	97.6	Very high	113 Å²	113	55.7 Å²	55.7	59%	0.592	28%	0.281	S	S	*	.	H	α-helix	trans	-70.5	-46.9	-177.6	-62.8	178.4	0	0	0	110.9	L847 W960 H965 E966	L847-L962 HydrophobicContact CD1-CB 4.41Å; L847-L962 HydrophobicContact CD2-CB 4.3Å; W960-L962 VanDerWaalsContact C-N 3.3Å; W960-L962 PolarHBondContact O-N 3.29Å; L962-H965 PolarHBondContact O-N 3.4Å; L962-E966 WeakPolarHBondContact O-CB 3.36Å; L962-E966 PolarHBondContact O-N 3.16Å
963	Q	98.5	Very high	97.6	Very high	7 Å²	7	57 Å²	57	3%	0.033	29%	0.287	C	S	.	.	H	α-helix	trans	-57.3	-51.2	176.8	-69.7	77.2	9.1	0	0	111.4	L847 F848 W960 E966	L847-Q963 HydrophobicContact CB-CG 4.26Å; L847-Q963 WeakPolarHBondContact O-CG 3.46Å; L847-Q963 PolarHBondContact O-NE2 2.94Å; F848-Q963 HydrophobicContact CD1-CB 4.27Å; F848-Q963 HydrophobicContact CD1-CG 4.04Å; F848-Q963 HydrophobicContact CE1-CB 3.59Å; F848-Q963 HydrophobicContact CE1-CG 3.88Å; F848-Q963 HydrophobicContact CZ-CB 3.76Å; F848-Q963 HydrophobicContact CZ-CG 4.22Å; F848-Q963 WeakPolarHBondContact CZ-O 2.92Å; W960-Q963 HydrophobicContact CB-CB 4.47Å; W960-Q963 PolarHBondContact O-N 3.11Å; W960-Q963 PolarHBondContact O-OE1 3.05Å; Q963-E966 PolarHBondContact O-N 3.48Å
964	L	98.4	Very high	97.6	Very high	37 Å²	37	55.5 Å²	55.5	19%	0.194	28%	0.279	C	S	.	.	H	α-helix	trans	-68.7	-37	-179.9	-63.9	-176.7	0	0	0	112.6	L954 N957 W960 E966 L967 V996	L954-L964 WeakPolarHBondContact O-CD1 3.45Å; N957-L964 HydrophobicContact CB-CD1 4.01Å; W960-L964 HydrophobicContact CB-CG 4.27Å; W960-L964 PolarHBondContact O-N 3.4Å; L964-E966 VanDerWaalsContact C-N 3.32Å; L964-E966 PolarHBondContact O-N 3.35Å; L964-L967 PolarHBondContact O-N 3.42Å; L964-V996 HydrophobicContact CD2-CB 4.27Å; L964-V996 HydrophobicContact CD2-CG2 3.84Å
965	H	98.4	Very high	97.6	Very high	123 Å²	123	59.1 Å²	59.1	57%	0.569	29%	0.293	S	S	*	.	H	α-helix	trans	-63.3	-39.5	175.5	-178	62	0	0	0	111.8	K961 L962 L967 T968	K961-H965 WeakPolarHBondContact O-CB 3.36Å; K961-H965 PolarHBondContact O-N 3.27Å; L962-H965 PolarHBondContact O-N 3.4Å; H965-L967 VanDerWaalsContact C-N 3.27Å; H965-L967 PolarHBondContact O-N 3Å; H965-T968 VanDerWaalsContact O-CB 3.3Å; H965-T968 WeakPolarHBondContact O-CB 3.48Å; H965-T968 WeakPolarHBondContact O-CG2 3.5Å; H965-T968 PolarHBondContact O-N 3.42Å; H965-T968 PolarHBondContact O-OG1 2.93Å
966	E	98.6	Very high	97.7	Very high	15 Å²	15	58.1 Å²	58.1	7%	0.07	29%	0.285	C	S	.	.	H	α-helix	trans	-59.5	-37.9	-179.8	-172.2	62.5	-172.3	0	0	112.5	L843 D844 L847 L962 Q963 L964 T968 K969	L843-E966 WeakPolarHBondContact CA-OE1 3.1Å; D844-E966 PolarHBondContact N-OE1 3.13Å; L847-E966 HydrophobicContact CD1-CB 3.91Å; L847-E966 HydrophobicContact CD1-CG 4.01Å; L962-E966 WeakPolarHBondContact O-CB 3.36Å; L962-E966 PolarHBondContact O-N 3.16Å; Q963-E966 PolarHBondContact O-N 3.48Å; L964-E966 VanDerWaalsContact C-N 3.32Å; L964-E966 PolarHBondContact O-N 3.35Å; E966-T968 PolarHBondContact O-N 3.39Å; E966-K969 VanDerWaalsContact O-CB 3.29Å; E966-K969 WeakPolarHBondContact O-CB 3.34Å; E966-K969 WeakPolarHBondContact O-CG 3.35Å; E966-K969 PolarHBondContact O-N 3.06Å; E966-K969 VanDerWaalsContact O-N 3.13Å; E966-K969 WeakPolarHBondContact OE1-CD 3.5Å; E966-K969 WeakPolarHBondContact OE1-CE 3.38Å; E966-K969 IonicContact OE1-NZ 3.57Å; E966-K969 PolarHBondContact OE1-NZ 2.99Å; E966-K969 WeakPolarHBondContact OE2-CE 3.26Å; E966-K969 IonicContact OE2-NZ 3.52Å; E966-K969 PolarHBondContact OE2-NZ 3.34Å
967	L	98.6	Very high	97.7	Very high	9 Å²	9	60.5 Å²	60.5	5%	0.047	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-69.5	-13.1	177.9	-57.4	176.2	0	0	0	113.6	F848 L964 H965 K969 L970 V996 I1101 W1103	F848-L967 HydrophobicContact CE2-CD2 4.42Å; F848-L967 HydrophobicContact CZ-CD1 4.16Å; F848-L967 HydrophobicContact CZ-CD2 3.98Å; F848-L967 HydrophobicContact CZ-CG 4Å; L964-L967 PolarHBondContact O-N 3.42Å; H965-L967 VanDerWaalsContact C-N 3.27Å; H965-L967 PolarHBondContact O-N 3Å; L967-K969 PolarHBondContact O-N 3.05Å; L967-L970 HydrophobicContact CB-CD1 4.29Å; L967-L970 HydrophobicContact CD2-CD1 4.3Å; L967-L970 WeakPolarHBondContact O-CB 3.44Å; L967-L970 WeakPolarHBondContact O-CG 3.48Å; L967-L970 PolarHBondContact O-N 3.39Å; L967-V996 HydrophobicContact CD1-CG1 4.41Å; L967-V996 HydrophobicContact CD1-CG2 3.66Å; L967-I1101 HydrophobicContact CD1-CD1 4.23Å; L967-I1101 HydrophobicContact CD2-CD1 3.69Å; L967-W1103 HydrophobicContact CD1-CH2 4Å; L967-W1103 HydrophobicContact CD1-CZ3 3.79Å; L967-W1103 HydrophobicContact CD2-CH2 4Å; L967-W1103 HydrophobicContact CD2-CZ3 4.38Å; L967-W1103 HydrophobicContact CG-CH2 4.46Å
968	T	97.9	Very high	97.8	Very high	68 Å²	68	56.6 Å²	56.6	42%	0.417	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-67	-17.2	171.3	71.6	0	0	0	0	112.7	H965 E966 L970 R975	H965-T968 VanDerWaalsContact O-CB 3.3Å; H965-T968 WeakPolarHBondContact O-CB 3.48Å; H965-T968 WeakPolarHBondContact O-CG2 3.5Å; H965-T968 PolarHBondContact O-N 3.42Å; H965-T968 PolarHBondContact O-OG1 2.93Å; E966-T968 PolarHBondContact O-N 3.39Å; T968-L970 PolarHBondContact O-N 2.99Å; T968-R975 PolarHBondContact O-NE 2.88Å; T968-R975 PolarHBondContact O-NH2 2.84Å
969	K	98.3	Very high	97.7	Very high	78 Å²	78	50.9 Å²	50.9	34%	0.339	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-66.9	-20.6	173.6	-67.7	174.7	175.1	174.8	0	113.7	F816 K842 L843 E966 L967	F816-K969 WeakPolarHBondContact CZ-O 3.42Å; K842-K969 PolarHBondContact O-NZ 3.39Å; L843-K969 HydrophobicContact CD2-CB 3.65Å; L843-K969 HydrophobicContact CD2-CD 3.79Å; L843-K969 HydrophobicContact CD2-CG 4.35Å; E966-K969 VanDerWaalsContact O-CB 3.29Å; E966-K969 WeakPolarHBondContact O-CB 3.34Å; E966-K969 WeakPolarHBondContact O-CG 3.35Å; E966-K969 PolarHBondContact O-N 3.06Å; E966-K969 VanDerWaalsContact O-N 3.13Å; E966-K969 WeakPolarHBondContact OE1-CD 3.5Å; E966-K969 WeakPolarHBondContact OE1-CE 3.38Å; E966-K969 IonicContact OE1-NZ 3.57Å; E966-K969 PolarHBondContact OE1-NZ 2.99Å; E966-K969 WeakPolarHBondContact OE2-CE 3.26Å; E966-K969 IonicContact OE2-NZ 3.52Å; E966-K969 PolarHBondContact OE2-NZ 3.34Å; L967-K969 PolarHBondContact O-N 3.05Å
970	L	98.6	Very high	97.5	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	27%	0.27	C	S	.	.	S	Bend	trans	-62.9	157.9	179.9	-67.7	172.6	0	0	0	112.6	L837 L841 L843 L967 T968 R975 I1021 W1103	L837-L970 HydrophobicContact CD2-CD2 3.9Å; L841-L970 HydrophobicContact CD1-CD2 3.83Å; L843-L970 HydrophobicContact CD1-CD2 4.1Å; L967-L970 HydrophobicContact CB-CD1 4.29Å; L967-L970 HydrophobicContact CD2-CD1 4.3Å; L967-L970 WeakPolarHBondContact O-CB 3.44Å; L967-L970 WeakPolarHBondContact O-CG 3.48Å; L967-L970 PolarHBondContact O-N 3.39Å; T968-L970 PolarHBondContact O-N 2.99Å; L970-R975 HydrophobicContact CB-CG 4.1Å; L970-R975 VanDerWaalsContact O-CZ 3.28Å; L970-R975 PolarHBondContact O-NE 3.4Å; L970-R975 PolarHBondContact O-NH2 2.83Å; L970-I1021 HydrophobicContact CD1-CD1 4.4Å; L970-I1021 HydrophobicContact CD2-CD1 4.27Å; L970-W1103 HydrophobicContact CD1-CH2 3.76Å; L970-W1103 HydrophobicContact CD1-CZ2 3.51Å
971	P	97.7	Very high	97.5	Very high	6 Å²	6	48.2 Å²	48.2	4%	0.039	27%	0.27	C	S	.	.			trans	-66	149.1	168.6	29.7	-36.6	0	0	0	111.7	A815 F816 F973 A974 R975	A815-P971 WeakPolarHBondContact O-CB 3.31Å; A815-P971 WeakPolarHBondContact O-CG 3.29Å; F816-P971 HydrophobicContact CD1-CB 4.3Å; F816-P971 HydrophobicContact CE1-CB 4.35Å; P971-F973 HydrophobicContact CB-CD1 3.86Å; P971-F973 HydrophobicContact CB-CE1 3.7Å; P971-F973 HydrophobicContact CG-CD1 4.01Å; P971-F973 HydrophobicContact CG-CE1 3.49Å; P971-F973 VanDerWaalsContact CG-CE1 3.49Å; P971-F973 HydrophobicContact CG-CZ 4.11Å; P971-F973 PolarHBondContact O-N 2.86Å; P971-A974 HydrophobicContact CG-CB 4.35Å; P971-A974 PolarHBondContact O-N 2.84Å; P971-R975 PolarHBondContact O-N 3.17Å
972	A	97.4	Very high	97.5	Very high	53 Å²	53	41.5 Å²	41.5	44%	0.438	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-25.6	-166.6	0	0	0	0	0	115.3	A974 S978	A972-A974 VanDerWaalsContact C-N 3.33Å; A972-S978 VanDerWaalsContact O-CB 3.23Å; A972-S978 WeakPolarHBondContact O-CB 3.32Å; A972-S978 PolarHBondContact O-OG 3.26Å
973	F	97.6	Very high	97.5	Very high	29 Å²	29	36.1 Å²	36.1	13%	0.127	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-21.6	177.9	76.7	-88.8	0	0	0	113.8	L820 H821 C824 P971 W1083	L820-F973 HydrophobicContact CD2-CE1 4.13Å; L820-F973 HydrophobicContact CD2-CZ 4.05Å; L820-F973 HydrophobicContact CG-CE1 4.14Å; L820-F973 HydrophobicContact CG-CZ 3.87Å; H821-F973 HydrophobicContact CB-CB 4.19Å; H821-F973 HydrophobicContact CB-CD1 3.83Å; H821-F973 HydrophobicContact CB-CD2 4.35Å; H821-F973 HydrophobicContact CB-CE1 4.31Å; H821-F973 HydrophobicContact CB-CG 3.87Å; H821-F973 WeakPolarHBondContact CD2-CB 3.46Å; H821-F973 AromaticContact CD2-CD2 3.68Å; H821-F973 AromaticContact CD2-CG 3.57Å; H821-F973 AromaticContact CG-CG 3.79Å; C824-F973 HydrophobicContact CB-CE2 4.3Å; P971-F973 HydrophobicContact CB-CD1 3.86Å; P971-F973 HydrophobicContact CB-CE1 3.7Å; P971-F973 HydrophobicContact CG-CD1 4.01Å; P971-F973 HydrophobicContact CG-CE1 3.49Å; P971-F973 VanDerWaalsContact CG-CE1 3.49Å; P971-F973 HydrophobicContact CG-CZ 4.11Å; P971-F973 PolarHBondContact O-N 2.86Å; F973-W1083 HydrophobicContact CD2-CE3 4.1Å; F973-W1083 AromaticContact CD2-CH2 3.8Å; F973-W1083 HydrophobicContact CD2-CH2 3.8Å; F973-W1083 AromaticContact CD2-CZ3 3.47Å; F973-W1083 HydrophobicContact CD2-CZ3 3.47Å; F973-W1083 VanDerWaalsContact CD2-CZ3 3.47Å; F973-W1083 AromaticContact CE2-CE3 3.91Å; F973-W1083 HydrophobicContact CE2-CE3 3.91Å; F973-W1083 HydrophobicContact CE2-CH2 4.39Å; F973-W1083 AromaticContact CE2-CZ3 3.77Å; F973-W1083 HydrophobicContact CE2-CZ3 3.77Å
974	A	98.2	Very high	97.4	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.008	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.9	-2.7	-179.7	0	0	0	0	0	113.2	P971 A972 V1019 W1103	P971-A974 HydrophobicContact CG-CB 4.35Å; P971-A974 PolarHBondContact O-N 2.84Å; A972-A974 VanDerWaalsContact C-N 3.33Å; A974-V1019 HydrophobicContact CB-CG2 4.24Å; A974-W1103 VanDerWaalsContact O-CZ2 3.31Å; A974-W1103 WeakPolarHBondContact O-CZ2 3.28Å; A974-W1103 PolarHBondContact O-NE1 2.83Å
975	R	98.4	Very high	97.4	Very high	77 Å²	77	37.8 Å²	37.8	29%	0.291	22%	0.223	S	C	.	.	S	Bend	trans	-73.8	143.8	178.8	-70.1	-179.3	-169	179	2	111.8	T968 L970 P971 V977 V1105	T968-R975 PolarHBondContact O-NE 2.88Å; T968-R975 PolarHBondContact O-NH2 2.84Å; L970-R975 HydrophobicContact CB-CG 4.1Å; L970-R975 VanDerWaalsContact O-CZ 3.28Å; L970-R975 PolarHBondContact O-NE 3.4Å; L970-R975 PolarHBondContact O-NH2 2.83Å; P971-R975 PolarHBondContact O-N 3.17Å; R975-V977 WeakPolarHBondContact CB-O 3.47Å; R975-V977 PolarHBondContact O-N 3.21Å; R975-V1105 WeakPolarHBondContact O-CG1 3.18Å
976	V	97.6	Very high	97.3	Very high	22 Å²	22	31.9 Å²	31.9	13%	0.133	20%	0.196	C	C	.	.	S	Bend	trans	-47.9	-45.8	168.9	-168.8	0	0	0	0	111.4	N981 N994 V996 W1103	V976-N981 PolarHBondContact O-ND2 2.98Å; V976-N994 WeakPolarHBondContact CG1-O 3.38Å; V976-V996 HydrophobicContact CG2-CG2 3.52Å; V976-W1103 HydrophobicContact CB-CG 4.47Å; V976-W1103 HydrophobicContact CG2-CD2 3.71Å; V976-W1103 HydrophobicContact CG2-CE3 4.23Å; V976-W1103 HydrophobicContact CG2-CG 3.86Å; V976-W1103 HydrophobicContact CG2-CZ2 4.36Å
977	V	96.4	Very high	97	Very high	96 Å²	96	32.8 Å²	32.8	58%	0.582	21%	0.209	S	C	*	.	S	Bend	trans	-123.8	123.7	179.7	-178	0	0	0	0	109.9	R975 T984	R975-V977 WeakPolarHBondContact CB-O 3.47Å; R975-V977 PolarHBondContact O-N 3.21Å; V977-T984 WeakPolarHBondContact CA-OG1 3.42Å; V977-T984 HydrophobicContact CG1-CG2 3.8Å
978	S	96.6	Very high	96.9	Very high	17 Å²	17	33.9 Å²	33.9	12%	0.119	21%	0.214	C	C	.	.			trans	-161.7	154.1	169.7	78.6	0	0	0	0	111.3	A972 G980 N981 T984	A972-S978 VanDerWaalsContact O-CB 3.23Å; A972-S978 WeakPolarHBondContact O-CB 3.32Å; A972-S978 PolarHBondContact O-OG 3.26Å; S978-G980 PolarHBondContact O-N 3.14Å; S978-G980 VanDerWaalsContact O-N 3.11Å; S978-N981 WeakPolarHBondContact O-CB 3.18Å; S978-N981 PolarHBondContact O-N 2.86Å; S978-N981 PolarHBondContact OG-N 2.93Å; S978-T984 PolarHBondContact N-OG1 3.04Å; S978-T984 VanDerWaalsContact N-OG1 3.16Å; S978-T984 WeakPolarHBondContact O-CB 3.39Å; S978-T984 PolarHBondContact O-OG1 2.88Å
979	A	93.3	Very high	96.8	Very high	79 Å²	79	34.9 Å²	34.9	65%	0.653	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-15.5	-179.2	0	0	0	0	0	114.4
980	G	93	Very high	96.7	Very high	38 Å²	38	32 Å²	32	39%	0.392	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.1	-1.9	174.1	0	0	0	0	0	114.2	S978 L1108	S978-G980 PolarHBondContact O-N 3.14Å; S978-G980 VanDerWaalsContact O-N 3.11Å; G980-L1108 PolarHBondContact O-N 2.87Å
981	N	97.6	Very high	96.6	Very high	2 Å²	2	36.6 Å²	36.6	1%	0.011	23%	0.232	C	C	.	.	B	Isolated β-bridge	trans	-96.4	111.8	177	177.8	3.4	0	0	0	109.7	V976 S978 L983 T984 H985 G1106	V976-N981 PolarHBondContact O-ND2 2.98Å; S978-N981 WeakPolarHBondContact O-CB 3.18Å; S978-N981 PolarHBondContact O-N 2.86Å; S978-N981 PolarHBondContact OG-N 2.93Å; N981-L983 PolarHBondContact O-N 3.08Å; N981-L983 VanDerWaalsContact O-N 3.09Å; N981-L983 WeakPolarHBondContact OD1-CB 3.11Å; N981-L983 PolarHBondContact OD1-N 2.95Å; N981-T984 VanDerWaalsContact O-CB 3.25Å; N981-T984 WeakPolarHBondContact O-CB 3.46Å; N981-T984 PolarHBondContact O-N 2.96Å; N981-H985 PolarHBondContact O-CD2 3.4Å; N981-G1106 CarbonylContact C-O 3.6Å; N981-G1106 WeakPolarHBondContact CA-O 3.29Å; N981-G1106 PolarHBondContact OD1-N 3.16Å
982	L	98.1	Very high	96.4	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.005	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-51.5	-35.4	177.9	-61.4	-171.2	0	0	0	112.9	T984 H985 F1016 G1106 L1108 Q1112 Y1113 L1137 M1141 I1145	L982-T984 PolarHBondContact O-N 2.85Å; L982-H985 WeakPolarHBondContact O-CB 3.39Å; L982-H985 PolarHBondContact O-N 3.49Å; L982-F1016 HydrophobicContact CB-CE1 4.16Å; L982-G1106 WeakPolarHBondContact CG-O 3.42Å; L982-G1106 PolarHBondContact N-O 3.11Å; L982-L1108 HydrophobicContact CD2-CB 4.5Å; L982-L1108 HydrophobicContact CD2-CD1 3.62Å; L982-Q1112 HydrophobicContact CD1-CG 4.39Å; L982-Y1113 HydrophobicContact CD1-CD2 4.49Å; L982-L1137 HydrophobicContact CB-CD2 4.44Å; L982-L1137 WeakPolarHBondContact O-CD1 3.17Å; L982-M1141 HydrophobicContact CD1-CE 4.19Å; L982-M1141 HydrophobicContact CD1-SD 4.22Å; L982-M1141 HydrophobicContact CD2-CE 3.55Å; L982-M1141 HydrophobicContact CD2-CG 4.21Å; L982-M1141 HydrophobicContact CD2-SD 3.76Å; L982-M1141 HydrophobicContact CG-CE 4.49Å; L982-M1141 HydrophobicContact CG-SD 4.43Å; L982-I1145 HydrophobicContact CD2-CD1 4.35Å
983	L	98.2	Very high	96.5	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-68.1	-14.7	-179.8	-62.4	173.4	0	0	0	113.8	N981 H985 V986 M993 N994 F1016 N1104 V1132	N981-L983 PolarHBondContact O-N 3.08Å; N981-L983 VanDerWaalsContact O-N 3.09Å; N981-L983 WeakPolarHBondContact OD1-CB 3.11Å; N981-L983 PolarHBondContact OD1-N 2.95Å; L983-H985 VanDerWaalsContact C-N 3.34Å; L983-V986 HydrophobicContact CD2-CG2 4.34Å; L983-M993 HydrophobicContact CD1-CB 4.3Å; L983-M993 HydrophobicContact CD1-CE 4.36Å; L983-M993 HydrophobicContact CD2-CE 4.36Å; L983-N994 HydrophobicContact CB-CB 4.14Å; L983-N994 PolarHBondContact O-ND2 3.34Å; L983-N994 VanDerWaalsContact O-ND2 3.07Å; L983-F1016 HydrophobicContact CD1-CD1 3.71Å; L983-F1016 HydrophobicContact CD1-CE1 4.27Å; L983-F1016 HydrophobicContact CD1-CG 4.22Å; L983-F1016 HydrophobicContact CD2-CD1 3.67Å; L983-F1016 HydrophobicContact CD2-CD2 4.45Å; L983-F1016 HydrophobicContact CD2-CE1 3.45Å; L983-F1016 VanDerWaalsContact CD2-CE1 3.45Å; L983-F1016 HydrophobicContact CD2-CE2 4.29Å; L983-F1016 HydrophobicContact CD2-CG 4.18Å; L983-F1016 HydrophobicContact CD2-CZ 3.8Å; L983-F1016 HydrophobicContact CG-CD1 3.58Å; L983-F1016 HydrophobicContact CG-CE1 3.6Å; L983-F1016 HydrophobicContact CG-CG 4.39Å; L983-F1016 HydrophobicContact CG-CZ 4.43Å; L983-N1104 HydrophobicContact CD1-CB 3.51Å; L983-V1132 HydrophobicContact CD2-CG1 4.2Å; L983-V1132 HydrophobicContact CD2-CG2 3.85Å
984	T	97.4	Very high	96.5	Very high	49 Å²	49	34 Å²	34	30%	0.301	21%	0.214	S	C	.	.	G	3₁₀ helix	trans	-73.2	-26.3	168.5	-61.2	0	0	0	0	111.8	V977 S978 N981 L982 V986	V977-T984 WeakPolarHBondContact CA-OG1 3.42Å; V977-T984 HydrophobicContact CG1-CG2 3.8Å; S978-T984 PolarHBondContact N-OG1 3.04Å; S978-T984 VanDerWaalsContact N-OG1 3.16Å; S978-T984 WeakPolarHBondContact O-CB 3.39Å; S978-T984 PolarHBondContact O-OG1 2.88Å; N981-T984 VanDerWaalsContact O-CB 3.25Å; N981-T984 WeakPolarHBondContact O-CB 3.46Å; N981-T984 PolarHBondContact O-N 2.96Å; L982-T984 PolarHBondContact O-N 2.85Å; T984-V986 VanDerWaalsContact C-N 3.35Å
985	H	97.1	Very high	96.5	Very high	30 Å²	30	34.6 Å²	34.6	14%	0.139	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.3	2.5	-178.8	-61.4	-95.8	0	0	0	113.7	N981 L982 L983 G987 L1137 N1140 M1141 N1144	N981-H985 PolarHBondContact O-CD2 3.4Å; L982-H985 WeakPolarHBondContact O-CB 3.39Å; L982-H985 PolarHBondContact O-N 3.49Å; L983-H985 VanDerWaalsContact C-N 3.34Å; H985-G987 PolarHBondContact O-N 3Å; H985-L1137 HydrophobicContact CB-CD1 3.92Å; H985-N1140 WeakPolarHBondContact O-CB 3.5Å; H985-N1140 PolarHBondContact O-ND2 3.12Å; H985-M1141 HydrophobicContact CB-CG 4.44Å; H985-N1144 WeakPolarHBondContact CE1-CB 3.19Å; H985-N1144 PolarHBondContact CE1-ND2 2.8Å; H985-N1144 WeakPolarHBondContact ND1-CB 3.43Å
986	V	97	Very high	96.5	Very high	0 Å²	0	31 Å²	31	0%	0	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-27.4	173.1	170.1	0	0	0	0	112	L983 T984 H988 I990 V1132 P1133 H1136 L1137	L983-V986 HydrophobicContact CD2-CG2 4.34Å; T984-V986 VanDerWaalsContact C-N 3.35Å; V986-H988 VanDerWaalsContact CG1-CE1 3.41Å; V986-H988 WeakPolarHBondContact CG1-CE1 3.39Å; V986-H988 PolarHBondContact O-N 3.1Å; V986-H988 PolarHBondContact O-ND1 2.92Å; V986-I990 HydrophobicContact CG1-CD1 3.75Å; V986-I990 HydrophobicContact CG1-CG1 4.15Å; V986-I990 HydrophobicContact CG2-CD1 4.17Å; V986-V1132 HydrophobicContact CG2-CG1 4.46Å; V986-P1133 HydrophobicContact CG1-CG 4.46Å; V986-H1136 PolarHBondContact O-CD2 2.91Å; V986-H1136 PolarHBondContact O-NE2 3.02Å; V986-L1137 HydrophobicContact CG2-CD1 4.07Å; V986-L1137 HydrophobicContact CG2-CD2 4.31Å
987	G	92.6	Very high	96.5	Very high	34 Å²	34	31.1 Å²	31.1	35%	0.351	20%	0.203	S	C	.	.			trans	73.3	7.3	177.1	0	0	0	0	0	115.3	H985 D1189	H985-G987 PolarHBondContact O-N 3Å; G987-D1189 WeakPolarHBondContact O-CA 3.27Å
988	H	94.9	Very high	96.6	Very high	32 Å²	32	26.5 Å²	26.5	15%	0.148	18%	0.175	C	C	.	.	S	Bend	trans	-157.2	167	173.2	57.5	-79.9	0	0	0	110.7	V986 N994 A1192	V986-H988 VanDerWaalsContact CG1-CE1 3.41Å; V986-H988 WeakPolarHBondContact CG1-CE1 3.39Å; V986-H988 PolarHBondContact O-N 3.1Å; V986-H988 PolarHBondContact O-ND1 2.92Å; H988-N994 PolarHBondContact O-ND2 3.44Å; H988-A1192 PolarHBondContact CE1-N 3.27Å; H988-A1192 PolarHBondContact NE2-N 3.2Å
989	T	96.5	Very high	96.7	Very high	89 Å²	89	27.4 Å²	27.4	55%	0.546	18%	0.176	S	C	.	.			trans	-72.3	127.6	-179.3	-62.5	0	0	0	0	112.3	L991 T995	T989-L991 HydrophobicContact CG2-CD2 3.54Å; T989-L991 HydrophobicContact CG2-CG 4.07Å; T989-T995 HydrophobicContact CG2-CG2 3.65Å
990	I	97.4	Very high	97	Very high	17 Å²	17	23.6 Å²	23.6	9%	0.087	15%	0.145	C	C	.	.			trans	-117.6	103.8	162.2	-54.7	168.3	0	0	0	106.8	V986 G992 M993 N994 P1131 V1132	V986-I990 HydrophobicContact CG1-CD1 3.75Å; V986-I990 HydrophobicContact CG1-CG1 4.15Å; V986-I990 HydrophobicContact CG2-CD1 4.17Å; I990-G992 PolarHBondContact O-N 2.86Å; I990-M993 HydrophobicContact CB-CB 4.05Å; I990-M993 HydrophobicContact CB-CG 4.44Å; I990-M993 HydrophobicContact CG2-CB 3.81Å; I990-M993 HydrophobicContact CG2-CG 3.65Å; I990-M993 HydrophobicContact CG2-SD 3.72Å; I990-M993 PolarHBondContact O-N 2.9Å; I990-N994 PolarHBondContact N-OD1 2.81Å; I990-N994 PolarHBondContact O-N 3.35Å; I990-N994 PolarHBondContact O-OD1 2.88Å; I990-P1131 VanDerWaalsContact CD1-O 3.24Å; I990-P1131 WeakPolarHBondContact CD1-O 3.37Å; I990-P1131 HydrophobicContact CG2-CB 4.12Å; I990-V1132 HydrophobicContact CD1-CG2 4.2Å
991	L	95.8	Very high	97.3	Very high	96 Å²	96	22 Å²	22	50%	0.503	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59	127.8	-171.3	-64.8	175.8	0	0	0	112.2	T989 M993 T995	T989-L991 HydrophobicContact CG2-CD2 3.54Å; T989-L991 HydrophobicContact CG2-CG 4.07Å; L991-M993 PolarHBondContact O-N 2.88Å; L991-T995 WeakPolarHBondContact CA-OG1 3.33Å; L991-T995 HydrophobicContact CD2-CG2 4.35Å
992	G	93.9	Very high	97.3	Very high	9 Å²	9	22 Å²	22	9%	0.093	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.3	-13.8	-175.5	0	0	0	0	0	115.3	I990 T995 Q997 W1103	I990-G992 PolarHBondContact O-N 2.86Å; G992-T995 CarbonylContact C-O 3.59Å; G992-T995 VanDerWaalsContact C-O 3.28Å; G992-T995 VanDerWaalsContact CA-O 3.23Å; G992-T995 WeakPolarHBondContact CA-O 3.44Å; G992-T995 PolarHBondContact N-OG1 3.31Å; G992-Q997 VanDerWaalsContact CA-CD 3.46Å; G992-W1103 WeakPolarHBondContact O-CA 3.45Å
993	M	98.3	Very high	97.4	Very high	2 Å²	2	23.1 Å²	23.1	1%	0.01	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-59.7	174	-59	-160	70.4	0	0	111.1	L983 I990 L991 N1013 F1016 N1104 P1131 V1132	L983-M993 HydrophobicContact CD1-CB 4.3Å; L983-M993 HydrophobicContact CD1-CE 4.36Å; L983-M993 HydrophobicContact CD2-CE 4.36Å; I990-M993 HydrophobicContact CB-CB 4.05Å; I990-M993 HydrophobicContact CB-CG 4.44Å; I990-M993 HydrophobicContact CG2-CB 3.81Å; I990-M993 HydrophobicContact CG2-CG 3.65Å; I990-M993 HydrophobicContact CG2-SD 3.72Å; I990-M993 PolarHBondContact O-N 2.9Å; L991-M993 PolarHBondContact O-N 2.88Å; M993-N1013 HydrophobicContact CE-CB 3.62Å; M993-N1013 WeakPolarHBondContact CE-O 3.49Å; M993-N1013 HydrophobicContact SD-CB 3.52Å; M993-N1013 VanDerWaalsContact SD-CB 3.52Å; M993-F1016 HydrophobicContact CE-CB 4.09Å; M993-F1016 HydrophobicContact CE-CD2 4.13Å; M993-F1016 HydrophobicContact CE-CG 4.17Å; M993-N1104 WeakPolarHBondContact CA-OD1 3.27Å; M993-N1104 HydrophobicContact CB-CB 4.22Å; M993-N1104 HydrophobicContact CE-CB 4.06Å; M993-N1104 VanDerWaalsContact CG-OD1 3.31Å; M993-N1104 WeakPolarHBondContact CG-OD1 3.42Å; M993-N1104 CarbonylContact O-C 3.49Å; M993-N1104 PolarHBondContact O-N 2.85Å; M993-P1131 HydrophobicContact SD-CB 4.15Å; M993-V1132 HydrophobicContact CE-CG2 3.51Å; M993-V1132 HydrophobicContact SD-CG2 3.64Å
994	N	97.9	Very high	97.3	Very high	22 Å²	22	23.2 Å²	23.2	12%	0.118	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.8	15	172.6	68.2	10	0	0	0	113.3	V976 L983 H988 I990	V976-N994 WeakPolarHBondContact CG1-O 3.38Å; L983-N994 HydrophobicContact CB-CB 4.14Å; L983-N994 PolarHBondContact O-ND2 3.34Å; L983-N994 VanDerWaalsContact O-ND2 3.07Å; H988-N994 PolarHBondContact O-ND2 3.44Å; I990-N994 PolarHBondContact N-OD1 2.81Å; I990-N994 PolarHBondContact O-N 3.35Å; I990-N994 PolarHBondContact O-OD1 2.88Å
995	T	98.4	Very high	97.4	Very high	14 Å²	14	21 Å²	21	9%	0.086	12%	0.122	C	C	.	.	S	Bend	trans	-127.1	158.8	162.5	72.6	0	0	0	0	109.4	D953 T989 L991 G992	D953-T995 PolarHBondContact OD1-OG1 2.96Å; T989-T995 HydrophobicContact CG2-CG2 3.65Å; L991-T995 WeakPolarHBondContact CA-OG1 3.33Å; L991-T995 HydrophobicContact CD2-CG2 4.35Å; G992-T995 CarbonylContact C-O 3.59Å; G992-T995 VanDerWaalsContact C-O 3.28Å; G992-T995 VanDerWaalsContact CA-O 3.23Å; G992-T995 WeakPolarHBondContact CA-O 3.44Å; G992-T995 PolarHBondContact N-OG1 3.31Å
996	V	98.7	Very high	97.4	Very high	1 Å²	1	19.6 Å²	19.6	1%	0.006	12%	0.116	C	C	.	.			trans	-78.9	130.6	178.8	-179.4	0	0	0	0	109.9	L954 L964 L967 V976 I1101 W1103	L954-V996 HydrophobicContact CB-CB 4.1Å; L954-V996 HydrophobicContact CB-CG1 4.34Å; L954-V996 WeakPolarHBondContact CB-O 3.33Å; L954-V996 HydrophobicContact CD1-CG1 3.92Å; L954-V996 HydrophobicContact CG-CG1 4.45Å; L954-V996 PolarHBondContact N-O 3.31Å; L964-V996 HydrophobicContact CD2-CB 4.27Å; L964-V996 HydrophobicContact CD2-CG2 3.84Å; L967-V996 HydrophobicContact CD1-CG1 4.41Å; L967-V996 HydrophobicContact CD1-CG2 3.66Å; V976-V996 HydrophobicContact CG2-CG2 3.52Å; V996-I1101 HydrophobicContact CG1-CB 3.95Å; V996-I1101 HydrophobicContact CG1-CG2 4.19Å; V996-W1103 HydrophobicContact CB-CE3 4.27Å; V996-W1103 HydrophobicContact CG1-CE3 3.94Å; V996-W1103 HydrophobicContact CG1-CZ3 4.23Å; V996-W1103 HydrophobicContact CG2-CD2 4.31Å; V996-W1103 HydrophobicContact CG2-CE3 3.73Å; V996-W1103 HydrophobicContact CG2-CZ3 4.22Å
997	Q	98.1	Very high	97.5	Very high	25 Å²	25	21.1 Å²	21.1	12%	0.117	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	144.3	163	-85.8	176	11.1	0	0	111.3	N951 I952 G992 Y999 I1101 A1102	N951-Q997 PolarHBondContact ND2-OE1 3.24Å; I952-Q997 CarbonylContact O-C 3.56Å; I952-Q997 WeakPolarHBondContact O-CA 3.37Å; G992-Q997 VanDerWaalsContact CA-CD 3.46Å; Q997-Y999 HydrophobicContact CB-CE2 4.14Å; Q997-Y999 PolarHBondContact OE1-OH 3.04Å; Q997-I1101 CarbonylContact O-C 3.49Å; Q997-I1101 WeakPolarHBondContact O-CA 3.26Å; Q997-A1102 PolarHBondContact N-O 3.24Å; Q997-A1102 PolarHBondContact O-N 3.06Å
998	L	98.8	Very high	97.8	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	145.3	175.7	169.2	84	0	0	0	110.1	L853 N951 I952 L954 M1000 N1099 N1100 I1101	L853-L998 HydrophobicContact CD1-CD1 3.98Å; L853-L998 HydrophobicContact CD1-CD2 3.48Å; L853-L998 VanDerWaalsContact CD1-CD2 3.48Å; L853-L998 HydrophobicContact CD1-CG 4.37Å; L853-L998 HydrophobicContact CD2-CD2 3.89Å; L853-L998 HydrophobicContact CG-CD2 4.28Å; N951-L998 PolarHBondContact N-O 3.39Å; I952-L998 HydrophobicContact CB-CB 4.06Å; I952-L998 HydrophobicContact CB-CD2 4.27Å; I952-L998 HydrophobicContact CB-CG 4.47Å; I952-L998 WeakPolarHBondContact CB-O 3.35Å; I952-L998 HydrophobicContact CD1-CD2 3.97Å; I952-L998 HydrophobicContact CD1-CG 4.27Å; I952-L998 WeakPolarHBondContact CG1-O 3.29Å; I952-L998 HydrophobicContact CG2-CD2 4.2Å; I952-L998 PolarHBondContact N-O 2.64Å; I952-L998 PolarHBondContact O-N 3.27Å; L954-L998 HydrophobicContact CD1-CB 3.98Å; L954-L998 HydrophobicContact CD2-CB 4.28Å; L954-L998 HydrophobicContact CD2-CD2 4.46Å; L954-L998 HydrophobicContact CG-CB 4.03Å; L998-M1000 HydrophobicContact CD2-CG 4.14Å; L998-M1000 HydrophobicContact CD2-SD 4.34Å; L998-M1000 HydrophobicContact CG-CG 4.32Å; L998-N1099 HydrophobicContact CD1-CB 4.24Å; L998-N1100 WeakPolarHBondContact CA-O 3.42Å; L998-I1101 HydrophobicContact CB-CG2 4.4Å; L998-I1101 HydrophobicContact CD1-CG2 3.82Å
999	Y	98.8	Very high	98	Very high	35 Å²	35	19.5 Å²	19.5	14%	0.137	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	128.5	177.6	-57.2	-89.5	0	0	0	108	F948 G949 T950 Q997 N1099 N1100 A1102	F948-Y999 HydrophobicContact CE2-CD1 4.1Å; F948-Y999 AromaticContact CZ-CD1 3.79Å; F948-Y999 HydrophobicContact CZ-CD1 3.79Å; G949-Y999 CarbonylContact O-C 3.58Å; G949-Y999 WeakPolarHBondContact O-CA 3.33Å; T950-Y999 WeakPolarHBondContact OG1-CD1 3.38Å; T950-Y999 VanDerWaalsContact OG1-CE1 3.32Å; T950-Y999 WeakPolarHBondContact OG1-CE1 3.3Å; Q997-Y999 HydrophobicContact CB-CE2 4.14Å; Q997-Y999 PolarHBondContact OE1-OH 3.04Å; Y999-N1099 CarbonylContact O-C 3.6Å; Y999-N1099 WeakPolarHBondContact O-CA 3.47Å; Y999-N1099 WeakPolarHBondContact O-CB 3.25Å; Y999-N1100 HydrophobicContact CD2-CB 4.36Å; Y999-N1100 PolarHBondContact N-O 3.05Å; Y999-N1100 PolarHBondContact O-N 3.18Å; Y999-A1102 HydrophobicContact CE2-CB 3.85Å
1000	M	98.8	Very high	98.1	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	118.8	177.9	-61.5	172.5	75.6	0	0	108.7	T850 Y899 A900 G949 I952 L998 N1099	T850-M1000 HydrophobicContact CG2-CE 3.56Å; T850-M1000 WeakPolarHBondContact OG1-CE 3.28Å; Y899-M1000 HydrophobicContact CD1-CB 3.62Å; Y899-M1000 HydrophobicContact CD1-CE 4Å; Y899-M1000 HydrophobicContact CD1-CG 4.45Å; Y899-M1000 HydrophobicContact CD1-SD 4.03Å; Y899-M1000 HydrophobicContact CE1-CB 3.38Å; Y899-M1000 WeakPolarHBondContact CE1-O 3.48Å; Y899-M1000 PolarHBondContact OH-O 3.21Å; A900-M1000 HydrophobicContact CB-CE 4.36Å; G949-M1000 PolarHBondContact N-O 2.86Å; G949-M1000 VanDerWaalsContact N-O 3.08Å; G949-M1000 PolarHBondContact O-N 3.03Å; I952-M1000 HydrophobicContact CD1-CB 4.39Å; I952-M1000 HydrophobicContact CD1-CG 3.72Å; I952-M1000 HydrophobicContact CD1-SD 3.6Å; I952-M1000 VanDerWaalsContact CD1-SD 3.6Å; L998-M1000 HydrophobicContact CD2-CG 4.14Å; L998-M1000 HydrophobicContact CD2-SD 4.34Å; L998-M1000 HydrophobicContact CG-CG 4.32Å; M1000-N1099 WeakPolarHBondContact CA-OD1 3.39Å
1001	K	98.8	Very high	98.1	Very high	4 Å²	4	17.7 Å²	17.7	2%	0.017	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	147.9	-163.1	-54.5	-176.1	-175.1	169.7	0	113.1	Q903 F948 C1028 A1094 W1097 C1098 N1100	Q903-K1001 PolarHBondContact NE2-O 3.21Å; F948-K1001 HydrophobicContact CD2-CG 3.94Å; F948-K1001 HydrophobicContact CE2-CD 4.23Å; F948-K1001 HydrophobicContact CE2-CG 3.68Å; K1001-C1028 PolarHBondContact NZ-SG 3.03Å; K1001-A1094 HydrophobicContact CB-CB 3.78Å; K1001-A1094 HydrophobicContact CD-CB 3.86Å; K1001-A1094 HydrophobicContact CG-CB 4.42Å; K1001-W1097 WeakPolarHBondContact O-CA 3.48Å; K1001-C1098 WeakPolarHBondContact CA-O 3.25Å; K1001-C1098 VanDerWaalsContact CB-O 3.32Å; K1001-C1098 WeakPolarHBondContact CB-O 3.43Å; K1001-C1098 PolarHBondContact N-O 3.23Å; K1001-C1098 PolarHBondContact O-N 3.01Å; K1001-N1100 WeakPolarHBondContact CE-OD1 3.48Å; K1001-N1100 PolarHBondContact NZ-OD1 3.28Å
1002	V	98.6	Very high	98.3	Very high	1 Å²	1	14.2 Å²	14.2	1%	0.006	8%	0.077	C	C	.	.			trans	-110.6	161.9	161.5	-57.6	0	0	0	0	109	Y902 Q903 I946 K947 G1004 S1005 A1094	Y902-V1002 HydrophobicContact CD1-CG1 4.35Å; Y902-V1002 HydrophobicContact CE1-CG1 3.69Å; Y902-V1002 HydrophobicContact CE1-CG2 4.22Å; Q903-V1002 HydrophobicContact CB-CG1 4.47Å; Q903-V1002 HydrophobicContact CG-CG1 4.14Å; I946-V1002 HydrophobicContact CB-CG2 4.06Å; I946-V1002 HydrophobicContact CG2-CG2 4.26Å; K947-V1002 WeakPolarHBondContact O-CG2 3.38Å; V1002-G1004 PolarHBondContact O-N 3.04Å; V1002-S1005 PolarHBondContact N-OG 3.03Å; V1002-S1005 VanDerWaalsContact O-CB 3.31Å; V1002-S1005 WeakPolarHBondContact O-CB 3.46Å; V1002-S1005 PolarHBondContact O-N 3.37Å; V1002-S1005 PolarHBondContact O-OG 3.05Å; V1002-A1094 WeakPolarHBondContact O-CB 3.43Å
1003	P	98.6	Very high	98.5	Very high	26 Å²	26	17.6 Å²	17.6	17%	0.169	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.2	136.2	173.8	-29	35.4	0	0	0	112.2	S1005 V1095 W1097	P1003-S1005 VanDerWaalsContact C-N 3.35Å; P1003-V1095 WeakPolarHBondContact CB-O 3.43Å; P1003-W1097 VanDerWaalsContact CD-CD2 3.43Å; P1003-W1097 HydrophobicContact CG-CD2 3.79Å; P1003-W1097 HydrophobicContact CG-CE3 3.74Å; P1003-W1097 HydrophobicContact CG-CH2 3.63Å; P1003-W1097 HydrophobicContact CG-CZ2 3.7Å; P1003-W1097 HydrophobicContact CG-CZ3 3.66Å
1004	G	97.1	Very high	98.5	Very high	2 Å²	2	17.5 Å²	17.5	2%	0.021	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.5	-6.3	-175.9	0	0	0	0	0	115.8	I946 V1002 R1006 A1094	I946-G1004 WeakPolarHBondContact CD1-O 3.41Å; V1002-G1004 PolarHBondContact O-N 3.04Å; G1004-R1006 WeakPolarHBondContact O-CG 3.27Å; G1004-R1006 PolarHBondContact O-N 3.21Å; G1004-A1094 PolarHBondContact N-O 3.48Å
1005	S	98.8	Very high	98.6	Very high	1 Å²	1	16.6 Å²	16.6	1%	0.007	9%	0.088	C	C	.	.			trans	-61.4	119.7	177.4	-57.8	0	0	0	0	110.9	V1002 P1003 Q1093 A1094	V1002-S1005 PolarHBondContact N-OG 3.03Å; V1002-S1005 VanDerWaalsContact O-CB 3.31Å; V1002-S1005 WeakPolarHBondContact O-CB 3.46Å; V1002-S1005 PolarHBondContact O-N 3.37Å; V1002-S1005 PolarHBondContact O-OG 3.05Å; P1003-S1005 VanDerWaalsContact C-N 3.35Å; S1005-Q1093 CarbonylContact O-C 3.58Å; S1005-Q1093 WeakPolarHBondContact O-CA 3.35Å; S1005-A1094 PolarHBondContact O-N 3.35Å
1006	R	98.7	Very high	98.6	Very high	2 Å²	2	15.9 Å²	15.9	1%	0.008	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	129.1	-174.4	-74.7	177.3	177.8	-163.6	-9.8	113.2	Q867 P871 E874 N875 F948 G1004 W1058 V1092 Q1093	Q867-R1006 PolarHBondContact NE2-O 3.3Å; P871-R1006 PolarHBondContact O-NH2 3.05Å; E874-R1006 PolarHBondContact O-NH1 2.95Å; E874-R1006 PolarHBondContact O-NH2 2.88Å; N875-R1006 PolarHBondContact OD1-NH1 2.82Å; F948-R1006 WeakPolarHBondContact CD1-O 3.48Å; F948-R1006 VanDerWaalsContact CE1-O 3.32Å; F948-R1006 WeakPolarHBondContact CE1-O 3.15Å; G1004-R1006 WeakPolarHBondContact O-CG 3.27Å; G1004-R1006 PolarHBondContact O-N 3.21Å; R1006-W1058 HydrophobicContact CB-CE3 4.2Å; R1006-W1058 HydrophobicContact CB-CH2 4.34Å; R1006-W1058 HydrophobicContact CB-CZ3 3.7Å; R1006-W1058 HydrophobicContact CG-CE3 4Å; R1006-W1058 HydrophobicContact CG-CH2 3.71Å; R1006-W1058 HydrophobicContact CG-CZ2 4.37Å; R1006-W1058 HydrophobicContact CG-CZ3 3.48Å; R1006-W1058 VanDerWaalsContact CG-CZ3 3.48Å; R1006-V1092 WeakPolarHBondContact CA-O 3.49Å; R1006-Q1093 HydrophobicContact CG-CB 4.31Å; R1006-Q1093 VanDerWaalsContact CZ-OE1 3.27Å
1007	T	98.6	Very high	98.6	Very high	32 Å²	32	15.9 Å²	15.9	20%	0.196	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	114.7	151.8	-57.5	0	0	0	0	107.3	W1058 V1092	T1007-W1058 WeakPolarHBondContact O-CZ3 3.28Å; T1007-V1092 PolarHBondContact N-O 3.41Å; T1007-V1092 PolarHBondContact O-N 3.24Å
1008	P	98.5	Very high	98.6	Very high	28 Å²	28	15.1 Å²	15.1	18%	0.182	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	173.8	-176.6	28.2	-35	0	0	0	113	H1010 W1057	P1008-H1010 PolarHBondContact O-N 3.25Å; P1008-H1010 PolarHBondContact O-ND1 2.91Å; P1008-W1057 WeakPolarHBondContact CA-O 3.44Å; P1008-W1057 WeakPolarHBondContact CB-O 3.3Å
1009	G	98.5	Very high	98.6	Very high	3 Å²	3	15.1 Å²	15.1	3%	0.031	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.2	129.7	175.6	0	0	0	0	0	112.3	W1057 H1090	G1009-W1057 PolarHBondContact N-O 3.31Å; G1009-W1057 VanDerWaalsContact O-CZ2 3.26Å; G1009-W1057 WeakPolarHBondContact O-CZ2 3.49Å; G1009-W1057 PolarHBondContact O-NE1 2.81Å; G1009-H1090 WeakPolarHBondContact CA-O 3.39Å
1010	H	98.8	Very high	98.7	Very high	51 Å²	51	14.1 Å²	14.1	24%	0.236	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161	171.1	176	64.3	-61.2	0	0	0	111	P1008 V1089 H1090	P1008-H1010 PolarHBondContact O-N 3.25Å; P1008-H1010 PolarHBondContact O-ND1 2.91Å; H1010-V1089 WeakPolarHBondContact O-CA 3.19Å; H1010-V1089 WeakPolarHBondContact O-CG1 3.34Å; H1010-H1090 AromaticContact CE1-CD2 3.83Å; H1010-H1090 AromaticContact CE1-CE1 3.48Å; H1010-H1090 PolarHBondContact CE1-CE1 2.85Å; H1010-H1090 VanDerWaalsContact CE1-CE1 3.48Å; H1010-H1090 AromaticContact CE1-NE2 3.28Å; H1010-H1090 PolarHBondContact CE1-NE2 3.49Å; H1010-H1090 VanDerWaalsContact CE1-NE2 3.28Å; H1010-H1090 PolarHBondContact N-O 2.84Å; H1010-H1090 VanDerWaalsContact N-O 3.1Å; H1010-H1090 PolarHBondContact ND1-O 3.15Å; H1010-H1090 AromaticContact NE2-CE1 3.38Å; H1010-H1090 PolarHBondContact NE2-CE1 2.95Å; H1010-H1090 AromaticContact NE2-NE2 3.5Å; H1010-H1090 PolarHBondContact O-N 3.19Å
1011	Q	98.8	Very high	98.7	Very high	17 Å²	17	14.2 Å²	14.2	8%	0.079	8%	0.079	C	C	.	.			trans	-110.3	155.7	154.1	-73.4	167.1	-59.4	0	0	107.7	W1038 F1052 G1087 V1089 R1119	Q1011-W1038 VanDerWaalsContact NE2-CB 3.27Å; Q1011-F1052 HydrophobicContact CG-CZ 4.34Å; Q1011-F1052 VanDerWaalsContact OE1-CE1 3.23Å; Q1011-G1087 WeakPolarHBondContact CG-O 3.47Å; Q1011-G1087 PolarHBondContact NE2-O 2.9Å; Q1011-V1089 HydrophobicContact CG-CB 4.11Å; Q1011-V1089 HydrophobicContact CG-CG1 4.19Å; Q1011-V1089 HydrophobicContact CG-CG2 3.71Å; Q1011-R1119 VanDerWaalsContact OE1-CZ 3.27Å
1012	E	98.7	Very high	98.7	Very high	23 Å²	23	14 Å²	14	11%	0.107	8%	0.078	C	C	.	.			trans	-59.3	153	177	-71.9	-66.4	172.8	0	0	113.3	N1014 N1015 F1016 S1018 H1090 N1104	E1012-N1014 PolarHBondContact O-N 2.69Å; E1012-N1015 PolarHBondContact O-N 2.98Å; E1012-F1016 WeakPolarHBondContact CB-O 3.41Å; E1012-F1016 WeakPolarHBondContact CG-O 3.35Å; E1012-S1018 WeakPolarHBondContact OE1-CB 3.46Å; E1012-S1018 PolarHBondContact OE1-OG 3.29Å; E1012-H1090 IonicContact OE1-CE1 3.97Å; E1012-N1104 PolarHBondContact OE2-ND2 3.16Å
1013	N	98.5	Very high	98.7	Very high	80 Å²	80	14.8 Å²	14.8	43%	0.428	8%	0.082	S	C	.	.	G	3₁₀ helix	trans	-55.3	126.2	176.7	-80.3	-53.1	0	0	0	110.2	M993 N1015 F1016 P1131	M993-N1013 HydrophobicContact CE-CB 3.62Å; M993-N1013 WeakPolarHBondContact CE-O 3.49Å; M993-N1013 HydrophobicContact SD-CB 3.52Å; M993-N1013 VanDerWaalsContact SD-CB 3.52Å; N1013-N1015 PolarHBondContact O-N 2.96Å; N1013-N1015 VanDerWaalsContact O-N 3.09Å; N1013-F1016 WeakPolarHBondContact O-CD2 3.44Å; N1013-F1016 PolarHBondContact O-N 3Å; N1013-P1131 HydrophobicContact CB-CG 4.31Å
1014	N	98.8	Very high	98.6	Very high	1 Å²	1	13.9 Å²	13.9	1%	0.005	8%	0.077	C	C	.	.	G	3₁₀ helix	trans	48	34	-173.5	-68.9	98.2	0	0	0	114.1	E1012 F1016 A1116 S1130 P1131 V1132	E1012-N1014 PolarHBondContact O-N 2.69Å; N1014-F1016 HydrophobicContact CB-CD2 3.81Å; N1014-F1016 HydrophobicContact CB-CE2 3.81Å; N1014-F1016 VanDerWaalsContact O-CD2 3.26Å; N1014-F1016 WeakPolarHBondContact O-CD2 3.42Å; N1014-F1016 PolarHBondContact O-N 3.2Å; N1014-F1016 VanDerWaalsContact O-N 3.12Å; N1014-A1116 WeakPolarHBondContact O-CA 3.42Å; N1014-A1116 VanDerWaalsContact O-CB 3.24Å; N1014-A1116 WeakPolarHBondContact O-CB 3.47Å; N1014-S1130 WeakPolarHBondContact ND2-CB 3.49Å; N1014-S1130 PolarHBondContact ND2-OG 2.84Å; N1014-S1130 WeakPolarHBondContact OD1-CA 3.5Å; N1014-S1130 WeakPolarHBondContact OD1-CB 3.32Å; N1014-P1131 WeakPolarHBondContact OD1-CD 3.46Å; N1014-V1132 HydrophobicContact CB-CB 4.02Å; N1014-V1132 HydrophobicContact CB-CG2 4.04Å; N1014-V1132 PolarHBondContact OD1-N 3.42Å
1015	N	98.8	Very high	98.6	Very high	2 Å²	2	19.4 Å²	19.4	1%	0.011	11%	0.113	C	C	.	.	G	3₁₀ helix	trans	54.8	25.9	178.4	-77.8	-6.6	0	0	0	114.9	E1012 N1013 A1086 G1087 Q1112 L1115 R1119	E1012-N1015 PolarHBondContact O-N 2.98Å; N1013-N1015 PolarHBondContact O-N 2.96Å; N1013-N1015 VanDerWaalsContact O-N 3.09Å; N1015-A1086 VanDerWaalsContact O-CA 3.32Å; N1015-A1086 WeakPolarHBondContact O-CA 3.42Å; N1015-A1086 WeakPolarHBondContact O-CB 3.37Å; N1015-G1087 VanDerWaalsContact CG-CA 3.43Å; N1015-G1087 PolarHBondContact O-N 2.96Å; N1015-G1087 VanDerWaalsContact O-N 3.1Å; N1015-G1087 WeakPolarHBondContact OD1-CA 3.29Å; N1015-Q1112 PolarHBondContact O-NE2 2.99Å; N1015-L1115 HydrophobicContact CB-CB 3.99Å; N1015-L1115 PolarHBondContact ND2-O 3.29Å; N1015-R1119 HydrophobicContact CB-CB 4.27Å; N1015-R1119 VanDerWaalsContact OD1-CZ 3.31Å; N1015-R1119 PolarHBondContact OD1-NH1 3.43Å
1016	F	98.9	Very high	98.4	Very high	0 Å²	0	20 Å²	20	0%	0	12%	0.118	C	C	.	.			trans	-67.1	155	174	-81.3	-99.9	0	0	0	112	L982 L983 M993 E1012 N1013 N1014 N1104 A1116 V1132 M1134 L1137	L982-F1016 HydrophobicContact CB-CE1 4.16Å; L983-F1016 HydrophobicContact CD1-CD1 3.71Å; L983-F1016 HydrophobicContact CD1-CE1 4.27Å; L983-F1016 HydrophobicContact CD1-CG 4.22Å; L983-F1016 HydrophobicContact CD2-CD1 3.67Å; L983-F1016 HydrophobicContact CD2-CD2 4.45Å; L983-F1016 HydrophobicContact CD2-CE1 3.45Å; L983-F1016 VanDerWaalsContact CD2-CE1 3.45Å; L983-F1016 HydrophobicContact CD2-CE2 4.29Å; L983-F1016 HydrophobicContact CD2-CG 4.18Å; L983-F1016 HydrophobicContact CD2-CZ 3.8Å; L983-F1016 HydrophobicContact CG-CD1 3.58Å; L983-F1016 HydrophobicContact CG-CE1 3.6Å; L983-F1016 HydrophobicContact CG-CG 4.39Å; L983-F1016 HydrophobicContact CG-CZ 4.43Å; M993-F1016 HydrophobicContact CE-CB 4.09Å; M993-F1016 HydrophobicContact CE-CD2 4.13Å; M993-F1016 HydrophobicContact CE-CG 4.17Å; E1012-F1016 WeakPolarHBondContact CB-O 3.41Å; E1012-F1016 WeakPolarHBondContact CG-O 3.35Å; N1013-F1016 WeakPolarHBondContact O-CD2 3.44Å; N1013-F1016 PolarHBondContact O-N 3Å; N1014-F1016 HydrophobicContact CB-CD2 3.81Å; N1014-F1016 HydrophobicContact CB-CE2 3.81Å; N1014-F1016 VanDerWaalsContact O-CD2 3.26Å; N1014-F1016 WeakPolarHBondContact O-CD2 3.42Å; N1014-F1016 PolarHBondContact O-N 3.2Å; N1014-F1016 VanDerWaalsContact O-N 3.12Å; F1016-N1104 HydrophobicContact CB-CB 4.17Å; F1016-A1116 HydrophobicContact CD2-CB 4.38Å; F1016-A1116 HydrophobicContact CE2-CB 3.74Å; F1016-A1116 HydrophobicContact CZ-CB 4.21Å; F1016-V1132 HydrophobicContact CD2-CG2 3.95Å; F1016-V1132 HydrophobicContact CE2-CB 3.98Å; F1016-V1132 HydrophobicContact CE2-CG1 3.84Å; F1016-V1132 HydrophobicContact CE2-CG2 3.69Å; F1016-V1132 HydrophobicContact CZ-CG1 3.9Å; F1016-V1132 HydrophobicContact CZ-CG2 4.33Å; F1016-M1134 HydrophobicContact CE2-SD 4.04Å; F1016-M1134 HydrophobicContact CZ-SD 4.15Å; F1016-L1137 HydrophobicContact CZ-CD2 4.15Å
1017	C	98.9	Very high	98.4	Very high	1 Å²	1	22.4 Å²	22.4	1%	0.007	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	156.3	170.3	-60.2	0	0	0	0	110.6	W1083 I1084 A1086 N1104 V1105 Q1112	C1017-W1083 HydrophobicContact CB-CH2 4.24Å; C1017-W1083 HydrophobicContact CB-CZ2 3.78Å; C1017-I1084 CarbonylContact C-O 3.56Å; C1017-I1084 WeakPolarHBondContact CA-O 3.37Å; C1017-I1084 VanDerWaalsContact CB-O 3.28Å; C1017-I1084 WeakPolarHBondContact CB-O 3.12Å; C1017-A1086 PolarHBondContact SG-N 2.94Å; C1017-N1104 CarbonylContact O-C 3.57Å; C1017-N1104 WeakPolarHBondContact O-CA 3.32Å; C1017-N1104 WeakPolarHBondContact O-CB 3.16Å; C1017-N1104 PolarHBondContact O-ND2 3.07Å; C1017-N1104 VanDerWaalsContact O-ND2 3.12Å; C1017-V1105 WeakPolarHBondContact CA-O 3.3Å; C1017-V1105 HydrophobicContact CB-CG2 3.94Å; C1017-V1105 VanDerWaalsContact CB-O 3.31Å; C1017-V1105 WeakPolarHBondContact CB-O 3.07Å; C1017-V1105 PolarHBondContact N-O 3.46Å; C1017-V1105 PolarHBondContact O-N 3.47Å; C1017-Q1112 PolarHBondContact SG-OE1 3.23Å; C1017-Q1112 VanDerWaalsContact SG-OE1 3.38Å
1018	S	98.9	Very high	98.4	Very high	8 Å²	8	20.9 Å²	20.9	6%	0.056	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	139.8	178.2	-147.7	0	0	0	0	111.1	E1012 W1083 I1084	E1012-S1018 WeakPolarHBondContact OE1-CB 3.46Å; E1012-S1018 PolarHBondContact OE1-OG 3.29Å; S1018-W1083 WeakPolarHBondContact O-CA 3.45Å; S1018-I1084 PolarHBondContact N-O 3.03Å; S1018-I1084 PolarHBondContact O-N 3.37Å
1019	V	98.9	Very high	98.4	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	123.4	172	172.2	0	0	0	0	107.9	A974 L1081 W1083 A1102 W1103 V1105	A974-V1019 HydrophobicContact CB-CG2 4.24Å; V1019-L1081 HydrophobicContact CG1-CD1 3.72Å; V1019-L1081 HydrophobicContact CG1-CD2 4.4Å; V1019-L1081 HydrophobicContact CG1-CG 4.11Å; V1019-W1083 HydrophobicContact CG2-CE3 3.83Å; V1019-W1083 HydrophobicContact CG2-CZ3 3.88Å; V1019-A1102 WeakPolarHBondContact O-CA 3.19Å; V1019-A1102 VanDerWaalsContact O-CB 3.29Å; V1019-A1102 WeakPolarHBondContact O-CB 3.49Å; V1019-W1103 HydrophobicContact CB-CD2 4.44Å; V1019-W1103 HydrophobicContact CB-CZ2 4.17Å; V1019-W1103 HydrophobicContact CG1-CD2 4.45Å; V1019-W1103 HydrophobicContact CG1-CH2 4.01Å; V1019-W1103 HydrophobicContact CG1-CZ2 3.45Å; V1019-W1103 VanDerWaalsContact CG1-CZ2 3.45Å; V1019-W1103 PolarHBondContact N-O 2.89Å; V1019-W1103 PolarHBondContact O-N 3.07Å; V1019-W1103 VanDerWaalsContact O-N 3.1Å; V1019-V1105 HydrophobicContact CG2-CG1 4.22Å; V1019-V1105 HydrophobicContact CG2-CG2 4.08Å
1020	N	98.9	Very high	98.4	Very high	14 Å²	14	20.9 Å²	20.9	8%	0.075	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	132.6	176.3	-173.4	-65.5	0	0	0	111.1	W1030 Q1076 L1081 V1082 N1100 I1101 A1102	N1020-W1030 HydrophobicContact CB-CH2 3.83Å; N1020-W1030 HydrophobicContact CB-CZ2 3.84Å; N1020-Q1076 PolarHBondContact O-NE2 2.86Å; N1020-Q1076 PolarHBondContact OD1-NE2 3.27Å; N1020-Q1076 VanDerWaalsContact OD1-NE2 3.17Å; N1020-Q1076 PolarHBondContact OD1-OE1 3.32Å; N1020-L1081 CarbonylContact O-C 3.59Å; N1020-L1081 VanDerWaalsContact O-CA 3.32Å; N1020-L1081 WeakPolarHBondContact O-CA 3.39Å; N1020-V1082 HydrophobicContact CB-CB 4.46Å; N1020-V1082 PolarHBondContact N-O 3.14Å; N1020-V1082 PolarHBondContact O-N 3.04Å; N1020-N1100 PolarHBondContact OD1-ND2 3.09Å; N1020-I1101 CarbonylContact C-O 3.44Å; N1020-I1101 WeakPolarHBondContact CA-O 3.39Å; N1020-A1102 HydrophobicContact CB-CB 4.19Å
1021	I	98.9	Very high	98.4	Very high	2 Å²	2	18.4 Å²	18.4	1%	0.01	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	126.8	173.9	-54.7	177.1	0	0	0	108.8	L845 L970 L1081 N1100 I1101 W1103	L845-I1021 HydrophobicContact CD2-CG2 4.31Å; L970-I1021 HydrophobicContact CD1-CD1 4.4Å; L970-I1021 HydrophobicContact CD2-CD1 4.27Å; I1021-L1081 HydrophobicContact CD1-CD1 4.17Å; I1021-L1081 HydrophobicContact CG1-CB 4.19Å; I1021-L1081 HydrophobicContact CG1-CD1 3.98Å; I1021-L1081 HydrophobicContact CG1-CG 4.05Å; I1021-N1100 VanDerWaalsContact O-CA 3.26Å; I1021-N1100 WeakPolarHBondContact O-CA 3.35Å; I1021-I1101 HydrophobicContact CB-CD1 4.43Å; I1021-I1101 HydrophobicContact CB-CG1 3.94Å; I1021-I1101 PolarHBondContact N-O 3.48Å; I1021-I1101 PolarHBondContact O-N 3.37Å; I1021-W1103 HydrophobicContact CD1-CH2 4.04Å
1022	N	98.9	Very high	98.4	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	123.5	170.6	-177	6.5	0	0	0	109.3	G1024 G1026 Q1076 G1079 D1080 N1099 N1100	N1022-G1024 WeakPolarHBondContact OD1-CA 3.46Å; N1022-G1024 PolarHBondContact OD1-N 2.99Å; N1022-G1026 PolarHBondContact ND2-O 3.2Å; N1022-G1026 PolarHBondContact OD1-O 3.28Å; N1022-Q1076 HydrophobicContact CB-CG 3.86Å; N1022-Q1076 VanDerWaalsContact N-NE2 3.16Å; N1022-Q1076 PolarHBondContact ND2-O 3.34Å; N1022-G1079 PolarHBondContact O-N 3.44Å; N1022-D1080 PolarHBondContact N-O 3.46Å; N1022-N1099 PolarHBondContact OD1-O 2.91Å; N1022-N1100 WeakPolarHBondContact CA-ND2 3.42Å
1023	I	98.8	Very high	98.4	Very high	18 Å²	18	16.5 Å²	16.5	9%	0.092	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	-25.9	176.6	-52.7	-53.5	0	0	0	110.9	L845 F848 N1099 I1101	L845-I1023 HydrophobicContact CB-CG2 4.25Å; L845-I1023 HydrophobicContact CD2-CD1 4.08Å; L845-I1023 WeakPolarHBondContact O-CG2 3.49Å; F848-I1023 HydrophobicContact CB-CD1 3.64Å; F848-I1023 HydrophobicContact CB-CG1 3.78Å; F848-I1023 HydrophobicContact CB-CG2 3.94Å; F848-I1023 HydrophobicContact CD2-CD1 4.18Å; F848-I1023 HydrophobicContact CG-CD1 3.96Å; I1023-N1099 HydrophobicContact CB-CB 4.01Å; I1023-N1099 VanDerWaalsContact CB-O 3.28Å; I1023-N1099 WeakPolarHBondContact CB-O 3.21Å; I1023-N1099 HydrophobicContact CG1-CB 4.09Å; I1023-N1099 WeakPolarHBondContact CG1-O 3.43Å; I1023-N1099 HydrophobicContact CG2-CB 4.49Å; I1023-N1099 PolarHBondContact N-O 3.42Å; I1023-I1101 HydrophobicContact CD1-CD1 4.08Å; I1023-I1101 HydrophobicContact CD1-CG1 4.04Å; I1023-I1101 HydrophobicContact CD1-CG2 4.49Å
1024	G	96.6	Very high	98.4	Very high	7 Å²	7	13.4 Å²	13.4	7%	0.072	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	79.9	-166.6	-173.1	0	0	0	0	0	113.8	N1022 C1098 N1099	N1022-G1024 WeakPolarHBondContact OD1-CA 3.46Å; N1022-G1024 PolarHBondContact OD1-N 2.99Å; G1024-C1098 WeakPolarHBondContact O-CA 3.4Å; G1024-N1099 PolarHBondContact O-N 3.14Å
1025	P	97.2	Very high	98.4	Very high	118 Å²	118	15 Å²	15	77%	0.766	9%	0.09	S	C	*	.	E	Extended strand (participates in β ladder)	cis	-75.1	-19.8	3.9	30.6	-36.8	0	0	0	114.7	P1078 W1097	P1025-P1078 VanDerWaalsContact O-CG 3.25Å; P1025-P1078 WeakPolarHBondContact O-CG 3.41Å; P1025-W1097 WeakPolarHBondContact CD-O 3.38Å
1026	G	94.6	Very high	98.3	Very high	12 Å²	12	19.4 Å²	19.4	12%	0.124	11%	0.114	C	C	.	.	S	Bend	trans	-81.3	166.8	179.8	0	0	0	0	0	115.1	N1022 W1097 C1098	N1022-G1026 PolarHBondContact ND2-O 3.2Å; N1022-G1026 PolarHBondContact OD1-O 3.28Å; G1026-W1097 WeakPolarHBondContact CA-O 3.45Å; G1026-W1097 PolarHBondContact N-O 3.01Å; G1026-C1098 VanDerWaalsContact O-CB 3.31Å; G1026-C1098 WeakPolarHBondContact O-CB 3.25Å
1027	D	98.4	Very high	98.3	Very high	54 Å²	54	19.9 Å²	19.9	29%	0.289	12%	0.116	S	C	.	.			trans	-87.5	155.9	178.1	-73.3	-21.4	0	0	0	113.1	I1075 R1077 P1078 V1095 G1096	D1027-I1075 HydrophobicContact CB-CG2 3.68Å; D1027-R1077 VanDerWaalsContact OD1-CA 3.3Å; D1027-R1077 WeakPolarHBondContact OD1-CA 3.44Å; D1027-P1078 WeakPolarHBondContact OD1-CD 3.29Å; D1027-V1095 HydrophobicContact CB-CB 4.2Å; D1027-V1095 WeakPolarHBondContact O-CB 3.31Å; D1027-V1095 PolarHBondContact O-N 3.44Å; D1027-G1096 PolarHBondContact O-N 3.22Å
1028	C	98.4	Very high	98.3	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	139.4	163.6	-79.7	0	0	0	0	110.7	K1001 I1075 Q1076 V1092 Q1093 C1098 N1100	K1001-C1028 PolarHBondContact NZ-SG 3.03Å; C1028-I1075 CarbonylContact O-C 3.44Å; C1028-I1075 WeakPolarHBondContact O-CA 3.3Å; C1028-Q1076 HydrophobicContact CB-CB 4.46Å; C1028-Q1076 PolarHBondContact N-O 2.93Å; C1028-Q1076 VanDerWaalsContact N-O 3.09Å; C1028-Q1076 PolarHBondContact O-N 3.45Å; C1028-V1092 HydrophobicContact CB-CG1 4.23Å; C1028-Q1093 CarbonylContact C-O 3.55Å; C1028-Q1093 WeakPolarHBondContact CA-O 3.44Å; C1028-C1098 VanDerWaalsContact SG-SG 3.67Å; C1028-N1100 PolarHBondContact SG-OD1 3.1Å
1029	E	98.8	Very high	98.3	Very high	26 Å²	26	20.3 Å²	20.3	12%	0.121	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	130.9	171.8	-174.6	166.6	-153.7	0	0	110	A872 F1031 R1073 I1075 V1092 Q1093 V1095	A872-E1029 WeakPolarHBondContact CB-OE2 3.45Å; E1029-F1031 HydrophobicContact CG-CE2 3.85Å; E1029-F1031 HydrophobicContact CG-CZ 3.91Å; E1029-R1073 IonicContact OE1-CZ 3.11Å; E1029-R1073 IonicContact OE1-NE 3.85Å; E1029-R1073 PolarHBondContact OE1-NE 3.46Å; E1029-R1073 IonicContact OE1-NH2 3.8Å; E1029-R1073 PolarHBondContact OE1-NH2 2.91Å; E1029-R1073 IonicContact OE2-NH2 3.65Å; E1029-I1075 HydrophobicContact CB-CD1 3.75Å; E1029-I1075 HydrophobicContact CG-CD1 3.85Å; E1029-V1092 WeakPolarHBondContact O-CA 3.35Å; E1029-V1092 WeakPolarHBondContact O-CG1 3.3Å; E1029-Q1093 PolarHBondContact N-O 2.92Å; E1029-Q1093 PolarHBondContact O-N 2.96Å; E1029-V1095 HydrophobicContact CB-CG2 3.74Å
1030	W	98.9	Very high	98.3	Very high	4 Å²	4	21.1 Å²	21.1	2%	0.015	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	140.3	-175.5	-73.4	75.1	0	0	0	110.9	N1020 R1073 F1074 V1082 I1084 H1090 V1092	N1020-W1030 HydrophobicContact CB-CH2 3.83Å; N1020-W1030 HydrophobicContact CB-CZ2 3.84Å; W1030-R1073 WeakPolarHBondContact O-CA 3.4Å; W1030-F1074 HydrophobicContact CB-CD1 3.96Å; W1030-F1074 HydrophobicContact CB-CD2 4.32Å; W1030-F1074 HydrophobicContact CB-CE1 3.47Å; W1030-F1074 VanDerWaalsContact CB-CE1 3.47Å; W1030-F1074 HydrophobicContact CB-CE2 3.86Å; W1030-F1074 HydrophobicContact CB-CG 4.37Å; W1030-F1074 HydrophobicContact CB-CZ 3.41Å; W1030-F1074 VanDerWaalsContact CB-CZ 3.41Å; W1030-F1074 HydrophobicContact CD2-CZ 4.15Å; W1030-F1074 HydrophobicContact CG-CE1 4.23Å; W1030-F1074 AromaticContact CG-CE2 3.92Å; W1030-F1074 HydrophobicContact CG-CE2 3.92Å; W1030-F1074 AromaticContact CG-CZ 3.66Å; W1030-F1074 HydrophobicContact CG-CZ 3.66Å; W1030-F1074 PolarHBondContact N-O 3.42Å; W1030-F1074 PolarHBondContact O-N 2.88Å; W1030-F1074 VanDerWaalsContact O-N 3.08Å; W1030-V1082 HydrophobicContact CD2-CG1 4.16Å; W1030-V1082 HydrophobicContact CD2-CG2 4.38Å; W1030-V1082 HydrophobicContact CE3-CG1 4Å; W1030-V1082 HydrophobicContact CH2-CB 4.28Å; W1030-V1082 HydrophobicContact CH2-CG1 4Å; W1030-V1082 HydrophobicContact CZ2-CB 4.03Å; W1030-V1082 HydrophobicContact CZ2-CG1 4.13Å; W1030-V1082 HydrophobicContact CZ2-CG2 4.21Å; W1030-V1082 HydrophobicContact CZ3-CG1 3.92Å; W1030-I1084 HydrophobicContact CE3-CD1 3.94Å; W1030-I1084 HydrophobicContact CH2-CG1 4.48Å; W1030-I1084 HydrophobicContact CZ3-CD1 3.66Å; W1030-I1084 HydrophobicContact CZ3-CG1 3.8Å; W1030-H1090 AromaticContact CZ3-CD2 3.5Å; W1030-H1090 AromaticContact CZ3-NE2 3.88Å; W1030-V1092 HydrophobicContact CD2-CB 4.45Å; W1030-V1092 HydrophobicContact CD2-CG1 3.99Å; W1030-V1092 HydrophobicContact CD2-CG2 3.63Å; W1030-V1092 HydrophobicContact CE3-CG2 3.42Å; W1030-V1092 VanDerWaalsContact CE3-CG2 3.42Å; W1030-V1092 HydrophobicContact CG-CG1 4.15Å; W1030-V1092 HydrophobicContact CG-CG2 4.35Å; W1030-V1092 HydrophobicContact CH2-CG2 3.9Å; W1030-V1092 HydrophobicContact CZ2-CG1 4.26Å; W1030-V1092 HydrophobicContact CZ2-CG2 4.09Å; W1030-V1092 HydrophobicContact CZ3-CG2 3.56Å
1031	F	98.9	Very high	98.3	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	128.2	173.5	-56.1	-96.2	0	0	0	108.3	A872 E1029 W1058 L1061 V1071 Y1072 R1073 H1090 W1091	A872-F1031 HydrophobicContact CB-CE2 3.97Å; A872-F1031 HydrophobicContact CB-CZ 3.82Å; E1029-F1031 HydrophobicContact CG-CE2 3.85Å; E1029-F1031 HydrophobicContact CG-CZ 3.91Å; F1031-W1058 HydrophobicContact CD2-CZ2 4.36Å; F1031-W1058 HydrophobicContact CE2-CZ2 4.11Å; F1031-L1061 HydrophobicContact CD1-CD1 4.26Å; F1031-L1061 HydrophobicContact CD1-CD2 4.28Å; F1031-L1061 HydrophobicContact CE1-CD1 3.93Å; F1031-V1071 HydrophobicContact CB-CG1 4.37Å; F1031-V1071 HydrophobicContact CD1-CG1 4.45Å; F1031-Y1072 WeakPolarHBondContact CA-O 3.49Å; F1031-R1073 HydrophobicContact CD1-CB 4.4Å; F1031-R1073 HydrophobicContact CD1-CG 3.96Å; F1031-R1073 HydrophobicContact CE1-CG 3.77Å; F1031-R1073 HydrophobicContact CZ-CG 4.5Å; F1031-H1090 VanDerWaalsContact O-CA 3.26Å; F1031-H1090 WeakPolarHBondContact O-CA 3.07Å; F1031-H1090 WeakPolarHBondContact O-CB 3.4Å; F1031-W1091 HydrophobicContact CB-CD2 3.73Å; F1031-W1091 HydrophobicContact CB-CE3 4.46Å; F1031-W1091 HydrophobicContact CB-CG 3.98Å; F1031-W1091 HydrophobicContact CB-CH2 4.35Å; F1031-W1091 HydrophobicContact CB-CZ2 3.64Å; F1031-W1091 VanDerWaalsContact CB-NE1 3.3Å; F1031-W1091 AromaticContact CD2-CD1 3.65Å; F1031-W1091 HydrophobicContact CD2-CG 4.48Å; F1031-W1091 AromaticContact CD2-NE1 3.66Å; F1031-W1091 AromaticContact CG-CD1 3.85Å; F1031-W1091 AromaticContact CG-CE2 3.91Å; F1031-W1091 HydrophobicContact CG-CZ2 4.38Å; F1031-W1091 AromaticContact CG-NE1 3.42Å; F1031-W1091 PolarHBondContact N-O 3.02Å; F1031-W1091 PolarHBondContact O-N 3.16Å
1032	V	98.9	Very high	98.2	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	137.4	-169.9	173.2	0	0	0	0	111.2	P830 V831 V1071 Y1072 F1074 I1084 T1088 V1089 H1090	P830-V1032 HydrophobicContact CB-CG1 4.15Å; V831-V1032 HydrophobicContact CB-CB 4.49Å; V831-V1032 HydrophobicContact CB-CG1 4.01Å; V831-V1032 HydrophobicContact CB-CG2 4.21Å; V831-V1032 HydrophobicContact CG1-CB 4.01Å; V831-V1032 HydrophobicContact CG1-CG1 3.71Å; V831-V1032 HydrophobicContact CG1-CG2 4.12Å; V831-V1032 HydrophobicContact CG2-CG2 4.4Å; V1032-V1071 WeakPolarHBondContact O-CA 3.49Å; V1032-Y1072 PolarHBondContact N-O 3.48Å; V1032-Y1072 PolarHBondContact O-N 3.09Å; V1032-F1074 HydrophobicContact CG2-CE1 4.14Å; V1032-I1084 HydrophobicContact CG2-CD1 4.08Å; V1032-T1088 HydrophobicContact CG1-CG2 3.23Å; V1032-V1089 WeakPolarHBondContact CA-O 3.26Å; V1032-H1090 HydrophobicContact CB-CB 4.5Å; V1032-H1090 HydrophobicContact CG2-CB 3.83Å
1033	V	98.9	Very high	98.2	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	137.1	178.1	170.6	0	0	0	0	109.2	Y1037 L1041 L1064 V1069 V1071 V1089 W1091	V1033-Y1037 HydrophobicContact CG1-CG 4.34Å; V1033-L1041 HydrophobicContact CB-CD2 4.35Å; V1033-L1041 HydrophobicContact CG1-CD1 4.06Å; V1033-L1041 HydrophobicContact CG1-CD2 4.3Å; V1033-L1041 HydrophobicContact CG2-CD2 4.36Å; V1033-L1064 HydrophobicContact CG2-CD1 4.45Å; V1033-V1069 HydrophobicContact CB-CG1 4.46Å; V1033-V1069 HydrophobicContact CG1-CG1 3.57Å; V1033-V1069 HydrophobicContact CG2-CG1 3.98Å; V1033-V1071 HydrophobicContact CG2-CG2 4.04Å; V1033-V1089 HydrophobicContact CB-CB 4.29Å; V1033-V1089 PolarHBondContact N-O 3.47Å; V1033-V1089 PolarHBondContact O-N 3.33Å; V1033-W1091 HydrophobicContact CG2-CH2 3.67Å; V1033-W1091 HydrophobicContact CG2-CZ3 3.87Å
1034	P	98.7	Very high	98.2	Very high	15 Å²	15	25 Å²	25	10%	0.097	14%	0.141	C	C	.	.			trans	-57.3	154.1	179.7	-20.1	29	0	0	0	114	P830 D1036 Y1037 P1070 Y1072	P830-P1034 HydrophobicContact CG-CB 3.89Å; P830-P1034 HydrophobicContact CG-CG 3.91Å; P1034-D1036 VanDerWaalsContact C-N 3.32Å; P1034-D1036 PolarHBondContact O-N 3.02Å; P1034-Y1037 HydrophobicContact CB-CD2 4.16Å; P1034-Y1037 HydrophobicContact CG-CD2 4.12Å; P1034-Y1037 HydrophobicContact CG-CE2 4.46Å; P1034-Y1037 PolarHBondContact O-N 2.94Å; P1034-P1070 HydrophobicContact CG-CG 3.97Å; P1034-Y1072 HydrophobicContact CG-CE2 4.19Å
1035	E	98.4	Very high	98.3	Very high	35 Å²	35	24.7 Å²	24.7	16%	0.164	14%	0.137	C	C	.	.	G	3₁₀ helix	trans	-53	-47	178.2	-164.9	-80.8	153.1	0	0	111.7	Y1037 W1038 G1087 L1115	E1035-Y1037 PolarHBondContact O-N 3.5Å; E1035-W1038 WeakPolarHBondContact O-CB 3.43Å; E1035-W1038 PolarHBondContact O-N 3.33Å; E1035-W1038 PolarHBondContact OE1-NE1 3.32Å; E1035-G1087 WeakPolarHBondContact CG-O 3.42Å; E1035-L1115 VanDerWaalsContact CD-CD2 3.47Å; E1035-L1115 HydrophobicContact CG-CD1 4.24Å; E1035-L1115 HydrophobicContact CG-CD2 3.98Å; E1035-L1115 WeakPolarHBondContact OE1-CD2 3.38Å
1036	D	97.3	Very high	98.3	Very high	93 Å²	93	23.1 Å²	23.1	50%	0.497	12%	0.12	S	C	.	.	G	3₁₀ helix	trans	-56.2	-20.8	-174.9	-48.1	-91	0	0	0	114.2	P788 P791 P1034	P788-D1036 WeakPolarHBondContact CG-O 3.41Å; P791-D1036 HydrophobicContact CB-CB 4.39Å; P791-D1036 HydrophobicContact CG-CB 3.49Å; P791-D1036 VanDerWaalsContact CG-CB 3.49Å; P1034-D1036 VanDerWaalsContact C-N 3.32Å; P1034-D1036 PolarHBondContact O-N 3.02Å
1037	Y	98.6	Very high	98.5	Very high	11 Å²	11	29.4 Å²	29.4	4%	0.043	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	-90.6	-2.1	178.9	-76	-91	0	0	0	114.4	P791 V1033 P1034 E1035 G1039 V1040 L1041 N1068 V1069 P1070	P791-Y1037 HydrophobicContact CB-CE2 4.26Å; P791-Y1037 HydrophobicContact CG-CD1 4.27Å; P791-Y1037 HydrophobicContact CG-CD2 3.81Å; P791-Y1037 HydrophobicContact CG-CE1 4.21Å; P791-Y1037 HydrophobicContact CG-CE2 3.7Å; P791-Y1037 HydrophobicContact CG-CG 4.1Å; V1033-Y1037 HydrophobicContact CG1-CG 4.34Å; P1034-Y1037 HydrophobicContact CB-CD2 4.16Å; P1034-Y1037 HydrophobicContact CG-CD2 4.12Å; P1034-Y1037 HydrophobicContact CG-CE2 4.46Å; P1034-Y1037 PolarHBondContact O-N 2.94Å; E1035-Y1037 PolarHBondContact O-N 3.5Å; Y1037-G1039 PolarHBondContact O-N 3.3Å; Y1037-G1039 VanDerWaalsContact O-N 3.14Å; Y1037-V1040 HydrophobicContact CD1-CG2 4.27Å; Y1037-V1040 WeakPolarHBondContact O-CB 3.49Å; Y1037-V1040 PolarHBondContact O-N 2.94Å; Y1037-L1041 PolarHBondContact O-N 3.28Å; Y1037-N1068 WeakPolarHBondContact CE1-O 3.42Å; Y1037-N1068 PolarHBondContact OH-O 3.13Å; Y1037-V1069 HydrophobicContact CD1-CB 4.16Å; Y1037-V1069 HydrophobicContact CD1-CG1 3.99Å; Y1037-V1069 HydrophobicContact CD1-CG2 3.84Å; Y1037-V1069 HydrophobicContact CE1-CB 4.39Å; Y1037-V1069 HydrophobicContact CE1-CG2 4.24Å; Y1037-V1069 HydrophobicContact CG-CG1 4.23Å; Y1037-P1070 HydrophobicContact CD2-CG 4.24Å; Y1037-P1070 VanDerWaalsContact CE2-CD 3.42Å; Y1037-P1070 HydrophobicContact CE2-CG 3.72Å
1038	W	98.6	Very high	98.4	Very high	17 Å²	17	29.5 Å²	29.5	6%	0.064	14%	0.144	C	C	.	.	H	α-helix	trans	-60.7	-29.3	-174.2	80.7	-103.3	0	0	0	113.6	P787 P788 Q1011 E1035 L1041 N1042 F1052 V1089 W1122	P787-W1038 HydrophobicContact CB-CE3 4.43Å; P787-W1038 HydrophobicContact CB-CH2 3.88Å; P787-W1038 HydrophobicContact CB-CZ2 4.44Å; P787-W1038 HydrophobicContact CB-CZ3 3.88Å; P787-W1038 HydrophobicContact CG-CH2 4.09Å; P787-W1038 HydrophobicContact CG-CZ3 4.12Å; P788-W1038 VanDerWaalsContact CD-CE2 3.44Å; P788-W1038 HydrophobicContact CG-CG 4.37Å; Q1011-W1038 VanDerWaalsContact NE2-CB 3.27Å; E1035-W1038 WeakPolarHBondContact O-CB 3.43Å; E1035-W1038 PolarHBondContact O-N 3.33Å; E1035-W1038 PolarHBondContact OE1-NE1 3.32Å; W1038-L1041 PolarHBondContact O-N 2.89Å; W1038-N1042 HydrophobicContact CE3-CB 4.3Å; W1038-N1042 HydrophobicContact CZ3-CB 4.4Å; W1038-N1042 WeakPolarHBondContact O-CB 3.44Å; W1038-N1042 PolarHBondContact O-N 3.18Å; W1038-F1052 HydrophobicContact CB-CZ 4.11Å; W1038-F1052 HydrophobicContact CE3-CD1 4.27Å; W1038-F1052 AromaticContact CE3-CE1 3.74Å; W1038-F1052 HydrophobicContact CE3-CE1 3.74Å; W1038-F1052 HydrophobicContact CE3-CZ 4.19Å; W1038-F1052 HydrophobicContact CZ3-CE1 4.34Å; W1038-V1089 HydrophobicContact CB-CG2 3.64Å; W1038-W1122 HydrophobicContact CH2-CD2 4.08Å; W1038-W1122 AromaticContact CH2-CE2 3.68Å; W1038-W1122 HydrophobicContact CH2-CG 4.24Å; W1038-W1122 HydrophobicContact CH2-CZ2 4.07Å; W1038-W1122 AromaticContact CH2-NE1 3.62Å; W1038-W1122 HydrophobicContact CZ3-CZ2 4.2Å; W1038-W1122 AromaticContact CZ3-NE1 3.78Å
1039	G	98.4	Very high	98.4	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-66.3	-34.8	173.1	0	0	0	0	0	113.6	P788 Y1037 N1042 D1043	P788-G1039 WeakPolarHBondContact O-CA 3.32Å; Y1037-G1039 PolarHBondContact O-N 3.3Å; Y1037-G1039 VanDerWaalsContact O-N 3.14Å; G1039-N1042 WeakPolarHBondContact O-CB 3.42Å; G1039-N1042 PolarHBondContact O-N 3.21Å; G1039-D1043 VanDerWaalsContact O-CG 3.31Å; G1039-D1043 PolarHBondContact O-N 3.48Å
1040	V	98.5	Very high	98.4	Very high	17 Å²	17	35 Å²	35	10%	0.103	17%	0.174	C	C	.	.	H	α-helix	trans	-67.1	-39.3	174.4	-173.2	0	0	0	0	110.6	Y1037 D1043 F1044 A1067 V1069	Y1037-V1040 HydrophobicContact CD1-CG2 4.27Å; Y1037-V1040 WeakPolarHBondContact O-CB 3.49Å; Y1037-V1040 PolarHBondContact O-N 2.94Å; V1040-D1043 PolarHBondContact O-N 3.36Å; V1040-F1044 HydrophobicContact CG1-CD2 4.2Å; V1040-F1044 HydrophobicContact CG1-CE2 4.05Å; V1040-F1044 VanDerWaalsContact O-CD2 3.27Å; V1040-F1044 WeakPolarHBondContact O-CD2 3.42Å; V1040-F1044 PolarHBondContact O-N 2.98Å; V1040-A1067 HydrophobicContact CG1-CB 4.31Å; V1040-V1069 HydrophobicContact CB-CG2 4.41Å; V1040-V1069 HydrophobicContact CG1-CG2 3.84Å
1041	L	98.7	Very high	98.3	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-72.1	-34.3	176.2	-84.3	65.8	0	0	0	112	V1033 Y1037 W1038 F1044 C1045 F1052 W1057 L1064 V1069 V1089 W1091	V1033-L1041 HydrophobicContact CB-CD2 4.35Å; V1033-L1041 HydrophobicContact CG1-CD1 4.06Å; V1033-L1041 HydrophobicContact CG1-CD2 4.3Å; V1033-L1041 HydrophobicContact CG2-CD2 4.36Å; Y1037-L1041 PolarHBondContact O-N 3.28Å; W1038-L1041 PolarHBondContact O-N 2.89Å; L1041-F1044 PolarHBondContact O-N 2.83Å; L1041-C1045 PolarHBondContact O-N 2.97Å; L1041-C1045 PolarHBondContact O-SG 3.39Å; L1041-F1052 HydrophobicContact CB-CD2 4.43Å; L1041-F1052 HydrophobicContact CB-CE2 3.9Å; L1041-W1057 HydrophobicContact CD2-CH2 4.26Å; L1041-W1057 HydrophobicContact CD2-CZ3 4.19Å; L1041-L1064 HydrophobicContact CD1-CD2 3.82Å; L1041-L1064 HydrophobicContact CG-CD2 4.16Å; L1041-V1069 HydrophobicContact CD1-CG1 4.06Å; L1041-V1069 HydrophobicContact CD1-CG2 4.43Å; L1041-V1089 HydrophobicContact CD2-CB 4.16Å; L1041-V1089 HydrophobicContact CD2-CG1 3.64Å; L1041-W1091 HydrophobicContact CD2-CZ3 4.22Å
1042	N	98.4	Very high	98.3	Very high	11 Å²	11	37.7 Å²	37.7	6%	0.059	19%	0.189	C	C	.	.	H	α-helix	trans	-56.9	-49.9	168.2	170	99.9	0	0	0	110.8	W1038 G1039 F1044 C1045 E1046 F1052	W1038-N1042 HydrophobicContact CE3-CB 4.3Å; W1038-N1042 HydrophobicContact CZ3-CB 4.4Å; W1038-N1042 WeakPolarHBondContact O-CB 3.44Å; W1038-N1042 PolarHBondContact O-N 3.18Å; G1039-N1042 WeakPolarHBondContact O-CB 3.42Å; G1039-N1042 PolarHBondContact O-N 3.21Å; N1042-F1044 VanDerWaalsContact C-N 3.29Å; N1042-F1044 PolarHBondContact O-N 2.87Å; N1042-C1045 WeakPolarHBondContact O-CB 3.49Å; N1042-C1045 PolarHBondContact O-N 2.94Å; N1042-E1046 WeakPolarHBondContact O-CG 3.5Å; N1042-E1046 PolarHBondContact O-N 2.68Å; N1042-F1052 HydrophobicContact CB-CB 4.15Å; N1042-F1052 HydrophobicContact CB-CD1 4.38Å; N1042-F1052 HydrophobicContact CB-CD2 4.16Å; N1042-F1052 HydrophobicContact CB-CG 3.97Å
1043	D	98.4	Very high	98.1	Very high	79 Å²	79	39.9 Å²	39.9	42%	0.422	20%	0.2	S	C	.	.	H	α-helix	trans	-63.8	-33.5	-179.8	-71	2.6	0	0	0	112.4	G1039 V1040 K1047	G1039-D1043 VanDerWaalsContact O-CG 3.31Å; G1039-D1043 PolarHBondContact O-N 3.48Å; V1040-D1043 PolarHBondContact O-N 3.36Å; D1043-K1047 WeakPolarHBondContact O-CB 3.26Å; D1043-K1047 VanDerWaalsContact O-CD 3.24Å; D1043-K1047 WeakPolarHBondContact O-CD 3.16Å; D1043-K1047 WeakPolarHBondContact O-CG 3.47Å; D1043-K1047 PolarHBondContact O-N 3.18Å
1044	F	98.6	Very high	97.9	Very high	26 Å²	26	46.2 Å²	46.2	11%	0.114	23%	0.232	C	C	.	.	H	α-helix	trans	-67.2	-39.2	170.7	-86.5	-64.7	0	0	0	113.3	W885 V1040 L1041 N1042 N1048 D1063 L1064 A1067	W885-F1044 HydrophobicContact CD2-CB 4.4Å; W885-F1044 HydrophobicContact CE3-CB 4.18Å; W885-F1044 HydrophobicContact CH2-CB 3.34Å; W885-F1044 HydrophobicContact CH2-CD1 4.28Å; W885-F1044 AromaticContact CH2-CD2 3.9Å; W885-F1044 HydrophobicContact CH2-CD2 3.9Å; W885-F1044 AromaticContact CH2-CG 3.61Å; W885-F1044 HydrophobicContact CH2-CG 3.61Å; W885-F1044 HydrophobicContact CZ2-CB 3.58Å; W885-F1044 AromaticContact CZ2-CD1 3.7Å; W885-F1044 HydrophobicContact CZ2-CD1 3.7Å; W885-F1044 HydrophobicContact CZ2-CD2 4.03Å; W885-F1044 HydrophobicContact CZ2-CE1 4.34Å; W885-F1044 AromaticContact CZ2-CG 3.52Å; W885-F1044 HydrophobicContact CZ2-CG 3.52Å; W885-F1044 HydrophobicContact CZ3-CB 3.67Å; W885-F1044 HydrophobicContact CZ3-CG 4.42Å; V1040-F1044 HydrophobicContact CG1-CD2 4.2Å; V1040-F1044 HydrophobicContact CG1-CE2 4.05Å; V1040-F1044 VanDerWaalsContact O-CD2 3.27Å; V1040-F1044 WeakPolarHBondContact O-CD2 3.42Å; V1040-F1044 PolarHBondContact O-N 2.98Å; L1041-F1044 PolarHBondContact O-N 2.83Å; N1042-F1044 VanDerWaalsContact C-N 3.29Å; N1042-F1044 PolarHBondContact O-N 2.87Å; F1044-N1048 WeakPolarHBondContact O-CB 3.44Å; F1044-N1048 PolarHBondContact O-N 2.98Å; F1044-N1048 VanDerWaalsContact O-N 3.13Å; F1044-N1048 PolarHBondContact O-ND2 3.18Å; F1044-D1063 HydrophobicContact CD1-CB 4.47Å; F1044-D1063 HydrophobicContact CE1-CB 3.78Å; F1044-D1063 HydrophobicContact CZ-CB 3.95Å; F1044-D1063 WeakPolarHBondContact CZ-O 3.23Å; F1044-L1064 HydrophobicContact CD2-CD2 4.25Å; F1044-L1064 HydrophobicContact CE2-CD2 4.21Å; F1044-A1067 HydrophobicContact CE2-CB 3.58Å; F1044-A1067 HydrophobicContact CZ-CB 3.72Å
1045	C	98.6	Very high	97.7	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-63.3	-49.8	175.6	-66.8	0	0	0	0	110.8	L1041 N1042 K1047 N1048 N1049 L1050 F1052	L1041-C1045 PolarHBondContact O-N 2.97Å; L1041-C1045 PolarHBondContact O-SG 3.39Å; N1042-C1045 WeakPolarHBondContact O-CB 3.49Å; N1042-C1045 PolarHBondContact O-N 2.94Å; C1045-K1047 PolarHBondContact O-N 3.13Å; C1045-N1048 CarbonylContact O-C 3.57Å; C1045-N1048 WeakPolarHBondContact O-CA 3.37Å; C1045-N1048 PolarHBondContact O-N 3.09Å; C1045-N1049 PolarHBondContact O-N 3.32Å; C1045-N1049 VanDerWaalsContact O-N 3.16Å; C1045-L1050 CarbonylContact C-O 3.57Å; C1045-L1050 HydrophobicContact CB-CB 4.12Å; C1045-L1050 VanDerWaalsContact CB-O 3.29Å; C1045-L1050 WeakPolarHBondContact CB-O 3.36Å; C1045-L1050 WeakPolarHBondContact O-CB 3.37Å; C1045-L1050 PolarHBondContact O-N 3.41Å; C1045-L1050 VanDerWaalsContact O-O 3.1Å; C1045-F1052 HydrophobicContact CB-CB 4.08Å
1046	E	97.6	Very high	97.7	Very high	85 Å²	85	47.2 Å²	47.2	40%	0.397	24%	0.242	S	C	.	.	H	α-helix	trans	-60.6	-44	178.8	-62.7	-73.3	177.8	0	0	111	N1042 N1048 N1049 L1050 K1126	N1042-E1046 WeakPolarHBondContact O-CG 3.5Å; N1042-E1046 PolarHBondContact O-N 2.68Å; E1046-N1048 PolarHBondContact O-N 3.3Å; E1046-N1049 PolarHBondContact O-N 3.49Å; E1046-L1050 PolarHBondContact N-O 3Å; E1046-K1126 IonicContact OE1-NZ 3.21Å
1047	K	98	Very high	97.8	Very high	144 Å²	144	42.8 Å²	42.8	63%	0.626	22%	0.219	S	C	*	.	H	α-helix	trans	-57.6	-28.1	172.4	-74.2	163.6	-166	163.5	0	113.8	D1043 C1045	D1043-K1047 WeakPolarHBondContact O-CB 3.26Å; D1043-K1047 VanDerWaalsContact O-CD 3.24Å; D1043-K1047 WeakPolarHBondContact O-CD 3.16Å; D1043-K1047 WeakPolarHBondContact O-CG 3.47Å; D1043-K1047 PolarHBondContact O-N 3.18Å; C1045-K1047 PolarHBondContact O-N 3.13Å
1048	N	97.7	Very high	97.8	Very high	56 Å²	56	42.3 Å²	42.3	30%	0.299	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.2	8.2	177.6	-80.1	-92.6	0	0	0	113.4	W885 F1044 C1045 E1046 L1050	W885-N1048 HydrophobicContact CB-CB 3.89Å; W885-N1048 VanDerWaalsContact CD1-CG 3.48Å; W885-N1048 VanDerWaalsContact CD1-ND2 3.27Å; W885-N1048 HydrophobicContact CG-CB 4.26Å; F1044-N1048 WeakPolarHBondContact O-CB 3.44Å; F1044-N1048 PolarHBondContact O-N 2.98Å; F1044-N1048 VanDerWaalsContact O-N 3.13Å; F1044-N1048 PolarHBondContact O-ND2 3.18Å; C1045-N1048 CarbonylContact O-C 3.57Å; C1045-N1048 WeakPolarHBondContact O-CA 3.37Å; C1045-N1048 PolarHBondContact O-N 3.09Å; E1046-N1048 PolarHBondContact O-N 3.3Å; N1048-L1050 HydrophobicContact CB-CD1 3.79Å; N1048-L1050 HydrophobicContact CB-CG 4.36Å
1049	N	97.8	Very high	97.8	Very high	137 Å²	137	41.5 Å²	41.5	73%	0.733	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.8	47.7	-174.8	-54.1	-90.8	0	0	0	112.2	R886 C1045 E1046	R886-N1049 PolarHBondContact NH2-O 3.2Å; C1045-N1049 PolarHBondContact O-N 3.32Å; C1045-N1049 VanDerWaalsContact O-N 3.16Å; E1046-N1049 PolarHBondContact O-N 3.49Å
1050	L	98	Very high	97.8	Very high	4 Å²	4	42.3 Å²	42.3	2%	0.021	22%	0.218	C	C	.	.			trans	-129.4	134.8	178.7	-66.6	160.4	0	0	0	109.1	W885 R886 C1045 E1046 N1048 W1057	W885-L1050 HydrophobicContact CB-CD1 3.63Å; R886-L1050 HydrophobicContact CB-CD1 4.26Å; R886-L1050 HydrophobicContact CB-CD2 4.07Å; R886-L1050 HydrophobicContact CG-CD2 4.07Å; R886-L1050 VanDerWaalsContact CZ-CD2 3.49Å; C1045-L1050 CarbonylContact C-O 3.57Å; C1045-L1050 HydrophobicContact CB-CB 4.12Å; C1045-L1050 VanDerWaalsContact CB-O 3.29Å; C1045-L1050 WeakPolarHBondContact CB-O 3.36Å; C1045-L1050 WeakPolarHBondContact O-CB 3.37Å; C1045-L1050 PolarHBondContact O-N 3.41Å; C1045-L1050 VanDerWaalsContact O-O 3.1Å; E1046-L1050 PolarHBondContact N-O 3Å; N1048-L1050 HydrophobicContact CB-CD1 3.79Å; N1048-L1050 HydrophobicContact CB-CG 4.36Å; L1050-W1057 HydrophobicContact CD1-CB 4.13Å
1051	N	97.1	Very high	97.7	Very high	56 Å²	56	43.3 Å²	43.3	30%	0.299	22%	0.223	S	C	.	.			trans	-81.4	120	171.9	179.3	-78.4	0	0	0	109.5	L1053 M1054 S1055	N1051-L1053 VanDerWaalsContact C-N 3.3Å; N1051-L1053 PolarHBondContact O-N 3.15Å; N1051-L1053 PolarHBondContact OD1-N 3.43Å; N1051-M1054 PolarHBondContact O-N 2.93Å; N1051-M1054 PolarHBondContact OD1-N 2.87Å; N1051-S1055 PolarHBondContact N-OG 3.49Å; N1051-S1055 WeakPolarHBondContact O-CB 3.17Å; N1051-S1055 PolarHBondContact O-N 3.35Å; N1051-S1055 PolarHBondContact O-OG 3.06Å
1052	F	98.3	Very high	97.7	Very high	5 Å²	5	48.3 Å²	48.3	2%	0.022	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55	-38	-176.4	174.1	-99.6	0	0	0	114.5	Q1011 W1038 L1041 N1042 C1045 W1057 V1089	Q1011-F1052 HydrophobicContact CG-CZ 4.34Å; Q1011-F1052 VanDerWaalsContact OE1-CE1 3.23Å; W1038-F1052 HydrophobicContact CB-CZ 4.11Å; W1038-F1052 HydrophobicContact CE3-CD1 4.27Å; W1038-F1052 AromaticContact CE3-CE1 3.74Å; W1038-F1052 HydrophobicContact CE3-CE1 3.74Å; W1038-F1052 HydrophobicContact CE3-CZ 4.19Å; W1038-F1052 HydrophobicContact CZ3-CE1 4.34Å; L1041-F1052 HydrophobicContact CB-CD2 4.43Å; L1041-F1052 HydrophobicContact CB-CE2 3.9Å; N1042-F1052 HydrophobicContact CB-CB 4.15Å; N1042-F1052 HydrophobicContact CB-CD1 4.38Å; N1042-F1052 HydrophobicContact CB-CD2 4.16Å; N1042-F1052 HydrophobicContact CB-CG 3.97Å; C1045-F1052 HydrophobicContact CB-CB 4.08Å; F1052-W1057 HydrophobicContact CD2-CH2 4Å; F1052-W1057 AromaticContact CD2-CZ2 3.46Å; F1052-W1057 HydrophobicContact CD2-CZ2 3.46Å; F1052-W1057 VanDerWaalsContact CD2-CZ2 3.46Å; F1052-W1057 AromaticContact CE2-CH2 3.6Å; F1052-W1057 HydrophobicContact CE2-CH2 3.6Å; F1052-W1057 AromaticContact CE2-CZ2 3.4Å; F1052-W1057 HydrophobicContact CE2-CZ2 3.4Å; F1052-W1057 HydrophobicContact CG-CZ2 4.36Å; F1052-W1057 HydrophobicContact CZ-CZ2 4.25Å; F1052-W1057 PolarHBondContact O-NE1 3.22Å; F1052-V1089 HydrophobicContact CE2-CG1 4.41Å; F1052-V1089 HydrophobicContact CZ-CG1 4.44Å
1053	L	95.4	Very high	97.7	Very high	47 Å²	47	50.3 Å²	50.3	25%	0.246	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-33	-176.8	-62.5	174.6	0	0	0	113.2	N1051 K1126 V1128	N1051-L1053 VanDerWaalsContact C-N 3.3Å; N1051-L1053 PolarHBondContact O-N 3.15Å; N1051-L1053 PolarHBondContact OD1-N 3.43Å; L1053-K1126 HydrophobicContact CD1-CB 4.22Å; L1053-K1126 HydrophobicContact CD1-CG 4.41Å; L1053-V1128 HydrophobicContact CD1-CB 4.41Å; L1053-V1128 HydrophobicContact CD1-CG2 3.97Å
1054	M	94.1	Very high	97.7	Very high	133 Å²	133	46.6 Å²	46.6	66%	0.655	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-121.7	-11.8	-164.1	-56.2	-57.1	-66.3	0	0	115.1	N1051 V1128	N1051-M1054 PolarHBondContact O-N 2.93Å; N1051-M1054 PolarHBondContact OD1-N 2.87Å; M1054-V1128 HydrophobicContact CG-CG2 4.03Å; M1054-V1128 HydrophobicContact SD-CG1 3.71Å; M1054-V1128 HydrophobicContact SD-CG2 4.08Å
1055	S	95.9	Very high	97.6	Very high	37 Å²	37	49.8 Å²	49.8	26%	0.259	25%	0.249	S	C	.	.	S	Bend	trans	-91.4	155.8	178.9	-61.4	0	0	0	0	112.4	N1051	N1051-S1055 PolarHBondContact N-OG 3.49Å; N1051-S1055 WeakPolarHBondContact O-CB 3.17Å; N1051-S1055 PolarHBondContact O-N 3.35Å; N1051-S1055 PolarHBondContact O-OG 3.06Å
1056	S	98	Very high	97.6	Very high	33 Å²	33	55.7 Å²	55.7	23%	0.231	28%	0.277	C	S	.	.			trans	-86.3	109.3	170.3	177.4	0	0	0	0	109.8	C887 S889	C887-S1056 PolarHBondContact N-O 3.36Å; C887-S1056 VanDerWaalsContact O-CB 3.24Å; C887-S1056 WeakPolarHBondContact O-CB 3.31Å; C887-S1056 PolarHBondContact O-OG 2.78Å; S889-S1056 WeakPolarHBondContact CB-OG 3.34Å
1057	W	98.6	Very high	97.6	Very high	1 Å²	1	53 Å²	53	0%	0.004	27%	0.269	C	S	.	.	B	Isolated β-bridge	trans	-128.9	151.4	-177.9	50.2	-89.1	0	0	0	113.6	W885 P1008 G1009 L1041 L1050 F1052 P1059 V1089	W885-W1057 HydrophobicContact CE3-CE3 4.34Å; W885-W1057 HydrophobicContact CZ3-CE3 4.21Å; W885-W1057 CarbonylContact O-C 3.48Å; W885-W1057 WeakPolarHBondContact O-CA 3.31Å; W885-W1057 WeakPolarHBondContact O-CB 3.36Å; P1008-W1057 WeakPolarHBondContact CA-O 3.44Å; P1008-W1057 WeakPolarHBondContact CB-O 3.3Å; G1009-W1057 PolarHBondContact N-O 3.31Å; G1009-W1057 VanDerWaalsContact O-CZ2 3.26Å; G1009-W1057 WeakPolarHBondContact O-CZ2 3.49Å; G1009-W1057 PolarHBondContact O-NE1 2.81Å; L1041-W1057 HydrophobicContact CD2-CH2 4.26Å; L1041-W1057 HydrophobicContact CD2-CZ3 4.19Å; L1050-W1057 HydrophobicContact CD1-CB 4.13Å; F1052-W1057 HydrophobicContact CD2-CH2 4Å; F1052-W1057 AromaticContact CD2-CZ2 3.46Å; F1052-W1057 HydrophobicContact CD2-CZ2 3.46Å; F1052-W1057 VanDerWaalsContact CD2-CZ2 3.46Å; F1052-W1057 AromaticContact CE2-CH2 3.6Å; F1052-W1057 HydrophobicContact CE2-CH2 3.6Å; F1052-W1057 AromaticContact CE2-CZ2 3.4Å; F1052-W1057 HydrophobicContact CE2-CZ2 3.4Å; F1052-W1057 HydrophobicContact CG-CZ2 4.36Å; F1052-W1057 HydrophobicContact CZ-CZ2 4.25Å; F1052-W1057 PolarHBondContact O-NE1 3.22Å; W1057-P1059 HydrophobicContact CE3-CG 3.77Å; W1057-P1059 HydrophobicContact CZ3-CG 3.64Å; W1057-V1089 HydrophobicContact CH2-CG1 3.76Å
1058	W	98.8	Very high	97.6	Very high	1 Å²	1	48.6 Å²	48.6	0%	0.004	25%	0.252	C	S	.	.			trans	-133.9	111.5	175.6	-165.4	-88.1	0	0	0	108.1	A872 N875 W885 C887 R1006 T1007 F1031 W1091 Q1093	A872-W1058 VanDerWaalsContact O-CE2 3.31Å; A872-W1058 WeakPolarHBondContact O-CZ2 3.32Å; A872-W1058 PolarHBondContact O-NE1 3.12Å; N875-W1058 HydrophobicContact CB-CB 3.81Å; N875-W1058 HydrophobicContact CB-CG 3.91Å; W885-W1058 PolarHBondContact O-N 2.71Å; C887-W1058 HydrophobicContact CB-CB 3.98Å; R1006-W1058 HydrophobicContact CB-CE3 4.2Å; R1006-W1058 HydrophobicContact CB-CH2 4.34Å; R1006-W1058 HydrophobicContact CB-CZ3 3.7Å; R1006-W1058 HydrophobicContact CG-CE3 4Å; R1006-W1058 HydrophobicContact CG-CH2 3.71Å; R1006-W1058 HydrophobicContact CG-CZ2 4.37Å; R1006-W1058 HydrophobicContact CG-CZ3 3.48Å; R1006-W1058 VanDerWaalsContact CG-CZ3 3.48Å; T1007-W1058 WeakPolarHBondContact O-CZ3 3.28Å; F1031-W1058 HydrophobicContact CD2-CZ2 4.36Å; F1031-W1058 HydrophobicContact CE2-CZ2 4.11Å; W1058-W1091 AromaticContact CD2-CD1 3.82Å; W1058-W1091 AromaticContact CE2-CD1 3.61Å; W1058-W1091 HydrophobicContact CE3-CB 4.22Å; W1058-W1091 AromaticContact CE3-CD1 3.94Å; W1058-W1091 HydrophobicContact CE3-CG 4.41Å; W1058-W1091 HydrophobicContact CH2-CB 4.39Å; W1058-W1091 AromaticContact CH2-CD1 3.68Å; W1058-W1091 HydrophobicContact CH2-CG 4.46Å; W1058-W1091 AromaticContact CZ2-CD1 3.57Å; W1058-W1091 HydrophobicContact CZ3-CB 3.95Å; W1058-W1091 AromaticContact CZ3-CD1 3.87Å; W1058-W1091 HydrophobicContact CZ3-CG 4.33Å; W1058-Q1093 HydrophobicContact CH2-CB 3.8Å; W1058-Q1093 HydrophobicContact CZ2-CB 4.21Å
1059	P	98.6	Very high	97.7	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.238	C	C	.	.			trans	-60.5	140.3	-176.2	-28.4	38.3	0	0	0	113.4	W885 W1057 L1064 W1091	W885-P1059 HydrophobicContact CE3-CB 4.33Å; W885-P1059 HydrophobicContact CE3-CG 4.4Å; W885-P1059 HydrophobicContact CH2-CB 3.71Å; W885-P1059 HydrophobicContact CH2-CG 4.2Å; W885-P1059 HydrophobicContact CZ2-CB 4.22Å; W885-P1059 HydrophobicContact CZ3-CB 3.78Å; W885-P1059 HydrophobicContact CZ3-CG 3.82Å; W1057-P1059 HydrophobicContact CE3-CG 3.77Å; W1057-P1059 HydrophobicContact CZ3-CG 3.64Å; P1059-L1064 HydrophobicContact CB-CD1 3.73Å; P1059-L1064 HydrophobicContact CB-CG 4.23Å; P1059-W1091 HydrophobicContact CB-CH2 4.08Å; P1059-W1091 HydrophobicContact CB-CZ2 3.82Å; P1059-W1091 HydrophobicContact CG-CD2 3.97Å; P1059-W1091 HydrophobicContact CG-CE3 3.92Å; P1059-W1091 HydrophobicContact CG-CH2 3.75Å; P1059-W1091 HydrophobicContact CG-CZ2 3.73Å; P1059-W1091 HydrophobicContact CG-CZ3 3.84Å
1060	N	98.3	Very high	97.7	Very high	16 Å²	16	39.7 Å²	39.7	9%	0.086	21%	0.205	C	C	.	.			trans	-76.3	121	162.6	-173.1	22.7	0	0	0	108.6	K883 E1062 D1063 L1064	K883-N1060 WeakPolarHBondContact CD-OD1 3.32Å; N1060-E1062 PolarHBondContact ND2-OE2 2.96Å; N1060-E1062 PolarHBondContact O-N 3.18Å; N1060-D1063 HydrophobicContact CB-CB 4.2Å; N1060-D1063 PolarHBondContact ND2-OD1 3.45Å; N1060-D1063 PolarHBondContact O-N 2.99Å; N1060-L1064 PolarHBondContact O-N 3.06Å
1061	L	98	Very high	97.7	Very high	38 Å²	38	40 Å²	40	20%	0.199	21%	0.207	C	C	.	.	H	α-helix	trans	-66.1	-27.9	-177.8	-58.4	-174.3	0	0	0	112.5	D873 F1031 L1064 Y1065 V1071 W1091	D873-L1061 HydrophobicContact CB-CD1 3.62Å; F1031-L1061 HydrophobicContact CD1-CD1 4.26Å; F1031-L1061 HydrophobicContact CD1-CD2 4.28Å; F1031-L1061 HydrophobicContact CE1-CD1 3.93Å; L1061-L1064 HydrophobicContact CD2-CD1 4.45Å; L1061-L1064 PolarHBondContact O-N 3.35Å; L1061-Y1065 WeakPolarHBondContact O-CB 3.4Å; L1061-Y1065 PolarHBondContact O-N 3.4Å; L1061-V1071 HydrophobicContact CD2-CG1 4.37Å; L1061-W1091 HydrophobicContact CD2-CZ2 3.84Å
1062	E	97.8	Very high	97.8	Very high	106 Å²	106	39 Å²	39	50%	0.495	20%	0.199	S	C	.	.	H	α-helix	trans	-63.2	-45.8	174.8	-62.7	155.7	-166.4	0	0	110.9	K883 N1060 L1064 Y1065 E1066	K883-E1062 IonicContact NZ-OE1 3.88Å; K883-E1062 PolarHBondContact NZ-OE1 3.37Å; N1060-E1062 PolarHBondContact ND2-OE2 2.96Å; N1060-E1062 PolarHBondContact O-N 3.18Å; E1062-L1064 VanDerWaalsContact C-N 3.34Å; E1062-L1064 PolarHBondContact O-N 3.06Å; E1062-Y1065 PolarHBondContact O-N 2.85Å; E1062-E1066 PolarHBondContact O-N 3.47Å
1063	D	98.2	Very high	97.8	Very high	53 Å²	53	43.5 Å²	43.5	28%	0.283	22%	0.216	S	C	.	.	H	α-helix	trans	-62.5	-40.7	178.2	-61.5	9.6	0	0	0	111.6	W885 F1044 N1060 E1066 A1067	W885-D1063 HydrophobicContact CZ2-CB 4.08Å; W885-D1063 PolarHBondContact NE1-OD2 2.9Å; F1044-D1063 HydrophobicContact CD1-CB 4.47Å; F1044-D1063 HydrophobicContact CE1-CB 3.78Å; F1044-D1063 HydrophobicContact CZ-CB 3.95Å; F1044-D1063 WeakPolarHBondContact CZ-O 3.23Å; N1060-D1063 HydrophobicContact CB-CB 4.2Å; N1060-D1063 PolarHBondContact ND2-OD1 3.45Å; N1060-D1063 PolarHBondContact O-N 2.99Å; D1063-E1066 PolarHBondContact O-N 3.37Å; D1063-A1067 WeakPolarHBondContact O-CB 3.45Å; D1063-A1067 PolarHBondContact O-N 2.96Å
1064	L	98.3	Very high	98	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-66.4	-42.9	176.6	-68.1	-174.6	0	0	0	112	W885 V1033 L1041 F1044 P1059 N1060 L1061 E1062 E1066 A1067 N1068 V1069 V1071 W1091	W885-L1064 HydrophobicContact CH2-CD2 3.93Å; W885-L1064 HydrophobicContact CH2-CG 4.47Å; W885-L1064 HydrophobicContact CZ2-CD2 4.41Å; V1033-L1064 HydrophobicContact CG2-CD1 4.45Å; L1041-L1064 HydrophobicContact CD1-CD2 3.82Å; L1041-L1064 HydrophobicContact CG-CD2 4.16Å; F1044-L1064 HydrophobicContact CD2-CD2 4.25Å; F1044-L1064 HydrophobicContact CE2-CD2 4.21Å; P1059-L1064 HydrophobicContact CB-CD1 3.73Å; P1059-L1064 HydrophobicContact CB-CG 4.23Å; N1060-L1064 PolarHBondContact O-N 3.06Å; L1061-L1064 HydrophobicContact CD2-CD1 4.45Å; L1061-L1064 PolarHBondContact O-N 3.35Å; E1062-L1064 VanDerWaalsContact C-N 3.34Å; E1062-L1064 PolarHBondContact O-N 3.06Å; L1064-E1066 VanDerWaalsContact C-N 3.34Å; L1064-E1066 PolarHBondContact O-N 2.95Å; L1064-A1067 CarbonylContact O-C 3.28Å; L1064-A1067 PolarHBondContact O-N 2.95Å; L1064-N1068 PolarHBondContact O-N 2.86Å; L1064-V1069 HydrophobicContact CB-CB 4.14Å; L1064-V1069 HydrophobicContact CD2-CB 4.19Å; L1064-V1069 HydrophobicContact CD2-CG1 4.2Å; L1064-V1069 HydrophobicContact CD2-CG2 4.14Å; L1064-V1069 WeakPolarHBondContact O-CB 3.46Å; L1064-V1069 PolarHBondContact O-N 3.3Å; L1064-V1071 HydrophobicContact CB-CG2 4.25Å; L1064-V1071 HydrophobicContact CD1-CG2 3.74Å; L1064-W1091 HydrophobicContact CD1-CH2 3.64Å; L1064-W1091 HydrophobicContact CD1-CZ2 4.01Å
1065	Y	97.8	Very high	98.2	Very high	94 Å²	94	38.4 Å²	38.4	37%	0.369	19%	0.19	S	C	.	.	H	α-helix	trans	-64.9	-36.2	177.3	-179.6	-101.9	0	0	0	112.1	K797 L800 L1061 E1062 N1068	K797-Y1065 HydrophobicContact CB-CE2 4.3Å; K797-Y1065 HydrophobicContact CD-CD1 4.39Å; K797-Y1065 HydrophobicContact CD-CD2 4.49Å; K797-Y1065 HydrophobicContact CD-CE1 3.9Å; K797-Y1065 HydrophobicContact CD-CE2 4Å; K797-Y1065 PolarHBondContact NZ-O 2.91Å; L800-Y1065 HydrophobicContact CB-CD2 4.05Å; L800-Y1065 HydrophobicContact CB-CE2 4.37Å; L800-Y1065 HydrophobicContact CD1-CD2 3.7Å; L800-Y1065 HydrophobicContact CD1-CE2 4.05Å; L800-Y1065 HydrophobicContact CD1-CG 4.35Å; L800-Y1065 WeakPolarHBondContact CD1-O 3.43Å; L1061-Y1065 WeakPolarHBondContact O-CB 3.4Å; L1061-Y1065 PolarHBondContact O-N 3.4Å; E1062-Y1065 PolarHBondContact O-N 2.85Å; Y1065-N1068 PolarHBondContact O-N 3.1Å
1066	E	97.8	Very high	98.3	Very high	124 Å²	124	36.6 Å²	36.6	58%	0.579	18%	0.178	S	C	*	.	H	α-helix	trans	-75.6	-24.1	172.7	-67.8	-46.2	124.4	0	0	114.4	K797 E1062 D1063 L1064 N1068	K797-E1066 IonicContact NZ-OE1 3.88Å; K797-E1066 PolarHBondContact NZ-OE1 3.23Å; K797-E1066 IonicContact NZ-OE2 2.88Å; K797-E1066 PolarHBondContact NZ-OE2 2.83Å; E1062-E1066 PolarHBondContact O-N 3.47Å; D1063-E1066 PolarHBondContact O-N 3.37Å; L1064-E1066 VanDerWaalsContact C-N 3.34Å; L1064-E1066 PolarHBondContact O-N 2.95Å; E1066-N1068 VanDerWaalsContact C-N 3.28Å; E1066-N1068 PolarHBondContact O-N 3.07Å
1067	A	97.6	Very high	98.4	Very high	29 Å²	29	39.2 Å²	39.2	24%	0.24	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	9.2	170.3	0	0	0	0	0	114.8	V1040 F1044 D1063 L1064 V1069	V1040-A1067 HydrophobicContact CG1-CB 4.31Å; F1044-A1067 HydrophobicContact CE2-CB 3.58Å; F1044-A1067 HydrophobicContact CZ-CB 3.72Å; D1063-A1067 WeakPolarHBondContact O-CB 3.45Å; D1063-A1067 PolarHBondContact O-N 2.96Å; L1064-A1067 CarbonylContact O-C 3.28Å; L1064-A1067 PolarHBondContact O-N 2.95Å; A1067-V1069 HydrophobicContact CB-CG2 3.96Å; A1067-V1069 PolarHBondContact O-N 2.68Å
1068	N	98.3	Very high	98.4	Very high	51 Å²	51	41.7 Å²	41.7	27%	0.273	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.4	34.5	-175.8	-66.6	89.3	0	0	0	114	L795 L800 Y1037 L1064 Y1065 E1066	L795-N1068 PolarHBondContact O-ND2 3.22Å; L800-N1068 VanDerWaalsContact CD2-C 3.48Å; L800-N1068 HydrophobicContact CD2-CB 4.42Å; L800-N1068 WeakPolarHBondContact CD2-O 3.41Å; Y1037-N1068 WeakPolarHBondContact CE1-O 3.42Å; Y1037-N1068 PolarHBondContact OH-O 3.13Å; L1064-N1068 PolarHBondContact O-N 2.86Å; Y1065-N1068 PolarHBondContact O-N 3.1Å; E1066-N1068 VanDerWaalsContact C-N 3.28Å; E1066-N1068 PolarHBondContact O-N 3.07Å
1069	V	98.6	Very high	98.3	Very high	1 Å²	1	42 Å²	42	1%	0.006	20%	0.202	C	C	.	.			trans	-90.2	125.6	175.3	-179.6	0	0	0	0	109.5	V1033 Y1037 V1040 L1041 L1064 A1067	V1033-V1069 HydrophobicContact CB-CG1 4.46Å; V1033-V1069 HydrophobicContact CG1-CG1 3.57Å; V1033-V1069 HydrophobicContact CG2-CG1 3.98Å; Y1037-V1069 HydrophobicContact CD1-CB 4.16Å; Y1037-V1069 HydrophobicContact CD1-CG1 3.99Å; Y1037-V1069 HydrophobicContact CD1-CG2 3.84Å; Y1037-V1069 HydrophobicContact CE1-CB 4.39Å; Y1037-V1069 HydrophobicContact CE1-CG2 4.24Å; Y1037-V1069 HydrophobicContact CG-CG1 4.23Å; V1040-V1069 HydrophobicContact CB-CG2 4.41Å; V1040-V1069 HydrophobicContact CG1-CG2 3.84Å; L1041-V1069 HydrophobicContact CD1-CG1 4.06Å; L1041-V1069 HydrophobicContact CD1-CG2 4.43Å; L1064-V1069 HydrophobicContact CB-CB 4.14Å; L1064-V1069 HydrophobicContact CD2-CB 4.19Å; L1064-V1069 HydrophobicContact CD2-CG1 4.2Å; L1064-V1069 HydrophobicContact CD2-CG2 4.14Å; L1064-V1069 WeakPolarHBondContact O-CB 3.46Å; L1064-V1069 PolarHBondContact O-N 3.3Å; A1067-V1069 HydrophobicContact CB-CG2 3.96Å; A1067-V1069 PolarHBondContact O-N 2.68Å
1070	P	98.6	Very high	98.3	Very high	4 Å²	4	42.1 Å²	42.1	3%	0.026	20%	0.203	C	C	.	.			trans	-79.5	132.3	176.7	32.9	-34.7	0	0	0	111.3	L795 L800 P802 P1034 Y1037	L795-P1070 HydrophobicContact CD1-CB 3.82Å; L795-P1070 HydrophobicContact CD1-CG 3.64Å; L800-P1070 WeakPolarHBondContact O-CA 3.44Å; P802-P1070 HydrophobicContact CG-CB 4.23Å; P1034-P1070 HydrophobicContact CG-CG 3.97Å; Y1037-P1070 HydrophobicContact CD2-CG 4.24Å; Y1037-P1070 VanDerWaalsContact CE2-CD 3.42Å; Y1037-P1070 HydrophobicContact CE2-CG 3.72Å
1071	V	98.9	Very high	98.3	Very high	12 Å²	12	41.4 Å²	41.4	7%	0.073	20%	0.199	C	C	.	.			trans	-118	112.5	177.4	-173.9	0	0	0	0	109.5	L800 F1031 V1032 V1033 L1061 L1064 W1091	L800-V1071 PolarHBondContact O-N 2.94Å; F1031-V1071 HydrophobicContact CB-CG1 4.37Å; F1031-V1071 HydrophobicContact CD1-CG1 4.45Å; V1032-V1071 WeakPolarHBondContact O-CA 3.49Å; V1033-V1071 HydrophobicContact CG2-CG2 4.04Å; L1061-V1071 HydrophobicContact CD2-CG1 4.37Å; L1064-V1071 HydrophobicContact CB-CG2 4.25Å; L1064-V1071 HydrophobicContact CD1-CG2 3.74Å; V1071-W1091 HydrophobicContact CG1-CH2 4.48Å; V1071-W1091 HydrophobicContact CG1-CZ2 4.41Å
1072	Y	98.8	Very high	98.4	Very high	33 Å²	33	39.6 Å²	39.6	13%	0.129	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	124	165.6	-62.4	-97.5	0	0	0	108	P802 P803 P830 V831 F1031 V1032 P1034	P802-Y1072 HydrophobicContact CB-CD1 3.98Å; P802-Y1072 HydrophobicContact CB-CE1 3.57Å; P802-Y1072 HydrophobicContact CG-CD1 3.59Å; P802-Y1072 HydrophobicContact CG-CD2 3.8Å; P802-Y1072 HydrophobicContact CG-CE1 3.49Å; P802-Y1072 VanDerWaalsContact CG-CE1 3.49Å; P802-Y1072 HydrophobicContact CG-CE2 3.67Å; P802-Y1072 HydrophobicContact CG-CG 3.76Å; P803-Y1072 WeakPolarHBondContact O-CD1 3.3Å; P803-Y1072 WeakPolarHBondContact O-CE1 3.11Å; P830-Y1072 HydrophobicContact CG-CE2 3.85Å; V831-Y1072 HydrophobicContact CG1-CG 4.35Å; F1031-Y1072 WeakPolarHBondContact CA-O 3.49Å; V1032-Y1072 PolarHBondContact N-O 3.48Å; V1032-Y1072 PolarHBondContact O-N 3.09Å; P1034-Y1072 HydrophobicContact CG-CE2 4.19Å
1073	R	98.6	Very high	98.4	Very high	100 Å²	100	34.5 Å²	34.5	38%	0.377	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	127.1	179	-177	-178.5	179.4	167	5.2	109.7	D873 E1029 W1030 F1031	D873-R1073 IonicContact OD2-CZ 2.74Å; D873-R1073 IonicContact OD2-NH1 3.71Å; D873-R1073 PolarHBondContact OD2-NH1 3.33Å; D873-R1073 IonicContact OD2-NH2 2.66Å; D873-R1073 PolarHBondContact OD2-NH2 3.06Å; E1029-R1073 IonicContact OE1-CZ 3.11Å; E1029-R1073 IonicContact OE1-NE 3.85Å; E1029-R1073 PolarHBondContact OE1-NE 3.46Å; E1029-R1073 IonicContact OE1-NH2 3.8Å; E1029-R1073 PolarHBondContact OE1-NH2 2.91Å; E1029-R1073 IonicContact OE2-NH2 3.65Å; W1030-R1073 WeakPolarHBondContact O-CA 3.4Å; F1031-R1073 HydrophobicContact CD1-CB 4.4Å; F1031-R1073 HydrophobicContact CD1-CG 3.96Å; F1031-R1073 HydrophobicContact CE1-CG 3.77Å; F1031-R1073 HydrophobicContact CZ-CG 4.5Å
1074	F	98.7	Very high	98.5	Very high	16 Å²	16	32.1 Å²	32.1	7%	0.07	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.1	161	-178.3	67.6	-81.9	0	0	0	113.9	T804 V831 V833 W1030 V1032 V1082	T804-F1074 HydrophobicContact CG2-CB 4.33Å; T804-F1074 HydrophobicContact CG2-CD1 3.57Å; T804-F1074 HydrophobicContact CG2-CD2 4.3Å; T804-F1074 HydrophobicContact CG2-CE1 3.87Å; T804-F1074 HydrophobicContact CG2-CG 3.81Å; T804-F1074 HydrophobicContact CG2-CZ 4.37Å; T804-F1074 WeakPolarHBondContact OG1-CD1 3.45Å; V831-F1074 HydrophobicContact CG1-CE1 4.26Å; V831-F1074 HydrophobicContact CG2-CE1 3.78Å; V831-F1074 HydrophobicContact CG2-CZ 3.68Å; V833-F1074 HydrophobicContact CB-CD2 4.3Å; V833-F1074 HydrophobicContact CB-CE2 4.01Å; V833-F1074 HydrophobicContact CG1-CD2 4.41Å; V833-F1074 HydrophobicContact CG2-CD2 4.43Å; V833-F1074 HydrophobicContact CG2-CE2 4.16Å; W1030-F1074 HydrophobicContact CB-CD1 3.96Å; W1030-F1074 HydrophobicContact CB-CD2 4.32Å; W1030-F1074 HydrophobicContact CB-CE1 3.47Å; W1030-F1074 VanDerWaalsContact CB-CE1 3.47Å; W1030-F1074 HydrophobicContact CB-CE2 3.86Å; W1030-F1074 HydrophobicContact CB-CG 4.37Å; W1030-F1074 HydrophobicContact CB-CZ 3.41Å; W1030-F1074 VanDerWaalsContact CB-CZ 3.41Å; W1030-F1074 HydrophobicContact CD2-CZ 4.15Å; W1030-F1074 HydrophobicContact CG-CE1 4.23Å; W1030-F1074 AromaticContact CG-CE2 3.92Å; W1030-F1074 HydrophobicContact CG-CE2 3.92Å; W1030-F1074 AromaticContact CG-CZ 3.66Å; W1030-F1074 HydrophobicContact CG-CZ 3.66Å; W1030-F1074 PolarHBondContact N-O 3.42Å; W1030-F1074 PolarHBondContact O-N 2.88Å; W1030-F1074 VanDerWaalsContact O-N 3.08Å; V1032-F1074 HydrophobicContact CG2-CE1 4.14Å; F1074-V1082 HydrophobicContact CE2-CG2 3.67Å; F1074-V1082 HydrophobicContact CZ-CG1 3.99Å; F1074-V1082 HydrophobicContact CZ-CG2 3.97Å
1075	I	98.6	Very high	98.5	Very high	57 Å²	57	32.5 Å²	32.5	29%	0.292	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	135.8	172.1	-56.8	-57.7	0	0	0	110.5	R835 D1027 C1028 E1029 R1077 V1095	R835-I1075 PolarHBondContact NH1-O 3.43Å; R835-I1075 PolarHBondContact NH2-O 3.05Å; D1027-I1075 HydrophobicContact CB-CG2 3.68Å; C1028-I1075 CarbonylContact O-C 3.44Å; C1028-I1075 WeakPolarHBondContact O-CA 3.3Å; E1029-I1075 HydrophobicContact CB-CD1 3.75Å; E1029-I1075 HydrophobicContact CG-CD1 3.85Å; I1075-R1077 HydrophobicContact CG2-CG 4.23Å; I1075-V1095 HydrophobicContact CD1-CG2 4.32Å
1076	Q	98.7	Very high	98.5	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	113.4	167.4	178.5	-165	26.1	0	0	109.2	N1020 N1022 C1028 D1080 V1082 N1100	N1020-Q1076 PolarHBondContact O-NE2 2.86Å; N1020-Q1076 PolarHBondContact OD1-NE2 3.27Å; N1020-Q1076 VanDerWaalsContact OD1-NE2 3.17Å; N1020-Q1076 PolarHBondContact OD1-OE1 3.32Å; N1022-Q1076 HydrophobicContact CB-CG 3.86Å; N1022-Q1076 VanDerWaalsContact N-NE2 3.16Å; N1022-Q1076 PolarHBondContact ND2-O 3.34Å; C1028-Q1076 HydrophobicContact CB-CB 4.46Å; C1028-Q1076 PolarHBondContact N-O 2.93Å; C1028-Q1076 VanDerWaalsContact N-O 3.09Å; C1028-Q1076 PolarHBondContact O-N 3.45Å; Q1076-D1080 HydrophobicContact CG-CB 4.01Å; Q1076-D1080 PolarHBondContact NE2-O 3.21Å; Q1076-V1082 HydrophobicContact CB-CG2 3.96Å; Q1076-V1082 HydrophobicContact CG-CG2 3.74Å; Q1076-N1100 PolarHBondContact OE1-ND2 3Å
1077	R	98.4	Very high	98.6	Very high	87 Å²	87	22.5 Å²	22.5	33%	0.328	11%	0.113	S	C	.	.			trans	-87.6	166.5	-179	-56.6	175.9	-60.6	-177.8	5.9	111.5	D1027 I1075 G1079 D1080	D1027-R1077 VanDerWaalsContact OD1-CA 3.3Å; D1027-R1077 WeakPolarHBondContact OD1-CA 3.44Å; I1075-R1077 HydrophobicContact CG2-CG 4.23Å; R1077-G1079 PolarHBondContact O-N 3.33Å; R1077-D1080 WeakPolarHBondContact CB-OD2 3.48Å; R1077-D1080 PolarHBondContact N-OD2 2.89Å; R1077-D1080 VanDerWaalsContact N-OD2 3.09Å; R1077-D1080 IonicContact NE-OD2 3.16Å; R1077-D1080 PolarHBondContact NE-OD2 2.88Å; R1077-D1080 WeakPolarHBondContact O-CB 3.41Å; R1077-D1080 PolarHBondContact O-N 2.92Å
1078	P	98.5	Very high	98.6	Very high	54 Å²	54	21.3 Å²	21.3	35%	0.351	10%	0.102	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.5	129.5	173	-26.2	35	0	0	0	111.7	P1025 D1027 D1080	P1025-P1078 VanDerWaalsContact O-CG 3.25Å; P1025-P1078 WeakPolarHBondContact O-CG 3.41Å; D1027-P1078 WeakPolarHBondContact OD1-CD 3.29Å; P1078-D1080 VanDerWaalsContact C-N 3.31Å; P1078-D1080 PolarHBondContact O-N 3.35Å
1079	G	97.3	Very high	98.6	Very high	6 Å²	6	18.9 Å²	18.9	6%	0.062	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.1	-4.2	-177.7	0	0	0	0	0	116.4	L837 A838 N1022 R1077	L837-G1079 PolarHBondContact N-O 3.29Å; A838-G1079 PolarHBondContact N-O 3.28Å; N1022-G1079 PolarHBondContact O-N 3.44Å; R1077-G1079 PolarHBondContact O-N 3.33Å
1080	D	98.7	Very high	98.7	Very high	3 Å²	3	19 Å²	19	2%	0.016	9%	0.09	C	C	.	.	P	Polyproline II helix	trans	-80.7	131.7	169.9	-65.3	-21.3	0	0	0	110.2	V833 I834 R835 G836 N1022 Q1076 R1077 P1078	V833-D1080 HydrophobicContact CG2-CB 4.29Å; I834-D1080 WeakPolarHBondContact O-CA 3.36Å; R835-D1080 VanDerWaalsContact CA-OD1 3.24Å; R835-D1080 WeakPolarHBondContact CA-OD1 3.48Å; R835-D1080 WeakPolarHBondContact CD-OD2 3.46Å; R835-D1080 IonicContact CZ-OD2 2.99Å; R835-D1080 IonicContact NE-OD2 3.58Å; R835-D1080 IonicContact NH1-OD2 2.78Å; R835-D1080 PolarHBondContact NH1-OD2 3.4Å; G836-D1080 PolarHBondContact N-OD1 3.01Å; N1022-D1080 PolarHBondContact N-O 3.46Å; Q1076-D1080 HydrophobicContact CG-CB 4.01Å; Q1076-D1080 PolarHBondContact NE2-O 3.21Å; R1077-D1080 WeakPolarHBondContact CB-OD2 3.48Å; R1077-D1080 PolarHBondContact N-OD2 2.89Å; R1077-D1080 VanDerWaalsContact N-OD2 3.09Å; R1077-D1080 IonicContact NE-OD2 3.16Å; R1077-D1080 PolarHBondContact NE-OD2 2.88Å; R1077-D1080 WeakPolarHBondContact O-CB 3.41Å; R1077-D1080 PolarHBondContact O-N 2.92Å; P1078-D1080 VanDerWaalsContact C-N 3.31Å; P1078-D1080 PolarHBondContact O-N 3.35Å
1081	L	98.8	Very high	98.7	Very high	1 Å²	1	18.9 Å²	18.9	1%	0.005	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	134.1	171.9	-177.5	157	0	0	0	109.7	V833 I834 L837 V1019 N1020 I1021 W1083	V833-L1081 CarbonylContact C-O 3.48Å; V833-L1081 WeakPolarHBondContact CA-O 3.37Å; I834-L1081 HydrophobicContact CB-CB 4.32Å; I834-L1081 HydrophobicContact CD1-CD2 4.06Å; I834-L1081 HydrophobicContact CG1-CD2 4.34Å; I834-L1081 PolarHBondContact N-O 2.72Å; I834-L1081 PolarHBondContact O-N 2.9Å; L837-L1081 HydrophobicContact CB-CB 4.46Å; L837-L1081 HydrophobicContact CD2-CB 3.53Å; L837-L1081 HydrophobicContact CD2-CD1 3.32Å; L837-L1081 HydrophobicContact CD2-CG 4.04Å; V1019-L1081 HydrophobicContact CG1-CD1 3.72Å; V1019-L1081 HydrophobicContact CG1-CD2 4.4Å; V1019-L1081 HydrophobicContact CG1-CG 4.11Å; N1020-L1081 CarbonylContact O-C 3.59Å; N1020-L1081 VanDerWaalsContact O-CA 3.32Å; N1020-L1081 WeakPolarHBondContact O-CA 3.39Å; I1021-L1081 HydrophobicContact CD1-CD1 4.17Å; I1021-L1081 HydrophobicContact CG1-CB 4.19Å; I1021-L1081 HydrophobicContact CG1-CD1 3.98Å; I1021-L1081 HydrophobicContact CG1-CG 4.05Å; L1081-W1083 HydrophobicContact CD2-CB 4.21Å
1082	V	98.9	Very high	98.7	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	125.9	167.5	176	0	0	0	0	108.9	V831 V833 N1020 W1030 F1074 Q1076 I1084	V831-V1082 HydrophobicContact CG2-CG1 3.9Å; V833-V1082 HydrophobicContact CG2-CG2 4.19Å; N1020-V1082 HydrophobicContact CB-CB 4.46Å; N1020-V1082 PolarHBondContact N-O 3.14Å; N1020-V1082 PolarHBondContact O-N 3.04Å; W1030-V1082 HydrophobicContact CD2-CG1 4.16Å; W1030-V1082 HydrophobicContact CD2-CG2 4.38Å; W1030-V1082 HydrophobicContact CE3-CG1 4Å; W1030-V1082 HydrophobicContact CH2-CB 4.28Å; W1030-V1082 HydrophobicContact CH2-CG1 4Å; W1030-V1082 HydrophobicContact CZ2-CB 4.03Å; W1030-V1082 HydrophobicContact CZ2-CG1 4.13Å; W1030-V1082 HydrophobicContact CZ2-CG2 4.21Å; W1030-V1082 HydrophobicContact CZ3-CG1 3.92Å; F1074-V1082 HydrophobicContact CE2-CG2 3.67Å; F1074-V1082 HydrophobicContact CZ-CG1 3.99Å; F1074-V1082 HydrophobicContact CZ-CG2 3.97Å; Q1076-V1082 HydrophobicContact CB-CG2 3.96Å; Q1076-V1082 HydrophobicContact CG-CG2 3.74Å; V1082-I1084 HydrophobicContact CG1-CD1 3.72Å; V1082-I1084 HydrophobicContact CG1-CG1 4.13Å
1083	W	98.9	Very high	98.7	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	115.8	169.1	176.3	-83.6	0	0	0	108.5	C824 T825 V831 T832 F973 C1017 S1018 V1019 L1081 V1105 P1107	C824-W1083 HydrophobicContact CB-CD2 3.88Å; C824-W1083 HydrophobicContact CB-CG 3.84Å; C824-W1083 HydrophobicContact CB-CZ2 4.45Å; C824-W1083 VanDerWaalsContact O-CD1 3.3Å; C824-W1083 PolarHBondContact O-NE1 2.82Å; T825-W1083 HydrophobicContact CG2-CZ2 3.89Å; V831-W1083 CarbonylContact C-O 3.54Å; V831-W1083 VanDerWaalsContact CA-O 3.29Å; V831-W1083 WeakPolarHBondContact CA-O 3.39Å; T832-W1083 PolarHBondContact N-O 2.73Å; T832-W1083 PolarHBondContact O-N 2.79Å; F973-W1083 HydrophobicContact CD2-CE3 4.1Å; F973-W1083 AromaticContact CD2-CH2 3.8Å; F973-W1083 HydrophobicContact CD2-CH2 3.8Å; F973-W1083 AromaticContact CD2-CZ3 3.47Å; F973-W1083 HydrophobicContact CD2-CZ3 3.47Å; F973-W1083 VanDerWaalsContact CD2-CZ3 3.47Å; F973-W1083 AromaticContact CE2-CE3 3.91Å; F973-W1083 HydrophobicContact CE2-CE3 3.91Å; F973-W1083 HydrophobicContact CE2-CH2 4.39Å; F973-W1083 AromaticContact CE2-CZ3 3.77Å; F973-W1083 HydrophobicContact CE2-CZ3 3.77Å; C1017-W1083 HydrophobicContact CB-CH2 4.24Å; C1017-W1083 HydrophobicContact CB-CZ2 3.78Å; S1018-W1083 WeakPolarHBondContact O-CA 3.45Å; V1019-W1083 HydrophobicContact CG2-CE3 3.83Å; V1019-W1083 HydrophobicContact CG2-CZ3 3.88Å; L1081-W1083 HydrophobicContact CD2-CB 4.21Å; W1083-V1105 HydrophobicContact CH2-CG2 3.37Å; W1083-V1105 HydrophobicContact CZ2-CG2 4.29Å; W1083-V1105 HydrophobicContact CZ3-CG2 3.51Å; W1083-P1107 HydrophobicContact CH2-CG 3.92Å; W1083-P1107 HydrophobicContact CZ2-CG 3.81Å
1084	I	98.9	Very high	98.7	Very high	2 Å²	2	12.8 Å²	12.8	1%	0.01	7%	0.066	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	121.6	169.1	-57.5	-60.2	0	0	0	107.4	V831 C1017 S1018 W1030 V1032 V1082 T1088	V831-I1084 HydrophobicContact CB-CD1 4.18Å; V831-I1084 HydrophobicContact CG2-CD1 3.89Å; C1017-I1084 CarbonylContact C-O 3.56Å; C1017-I1084 WeakPolarHBondContact CA-O 3.37Å; C1017-I1084 VanDerWaalsContact CB-O 3.28Å; C1017-I1084 WeakPolarHBondContact CB-O 3.12Å; S1018-I1084 PolarHBondContact N-O 3.03Å; S1018-I1084 PolarHBondContact O-N 3.37Å; W1030-I1084 HydrophobicContact CE3-CD1 3.94Å; W1030-I1084 HydrophobicContact CH2-CG1 4.48Å; W1030-I1084 HydrophobicContact CZ3-CD1 3.66Å; W1030-I1084 HydrophobicContact CZ3-CG1 3.8Å; V1032-I1084 HydrophobicContact CG2-CD1 4.08Å; V1082-I1084 HydrophobicContact CG1-CD1 3.72Å; V1082-I1084 HydrophobicContact CG1-CG1 4.13Å; I1084-T1088 HydrophobicContact CG2-CG2 3.99Å
1085	N	98.8	Very high	98.6	Very high	9 Å²	9	15.6 Å²	15.6	5%	0.048	8%	0.084	C	C	.	.	P	Polyproline II helix	trans	-81.3	160.1	-178.4	-160.4	6.4	0	0	0	111.1	C824 T825 N826 N829 P830 G1087 T1088	C824-N1085 PolarHBondContact O-ND2 3.19Å; T825-N1085 PolarHBondContact O-ND2 2.99Å; N826-N1085 PolarHBondContact O-ND2 3.18Å; N829-N1085 VanDerWaalsContact O-CB 3.26Å; N829-N1085 WeakPolarHBondContact O-CB 3.44Å; N829-N1085 PolarHBondContact O-ND2 3.38Å; P830-N1085 VanDerWaalsContact O-CB 3.27Å; P830-N1085 WeakPolarHBondContact O-CB 3.18Å; P830-N1085 PolarHBondContact O-N 2.92Å; N1085-G1087 PolarHBondContact O-N 3.45Å; N1085-T1088 WeakPolarHBondContact O-CB 3.38Å; N1085-T1088 PolarHBondContact O-N 3.23Å; N1085-T1088 PolarHBondContact O-OG1 3.47Å
1086	A	98.6	Very high	98.4	Very high	7 Å²	7	13.4 Å²	13.4	6%	0.058	8%	0.076	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.6	127	-168.9	0	0	0	0	0	113.1	N1015 C1017 T1088 L1115	N1015-A1086 VanDerWaalsContact O-CA 3.32Å; N1015-A1086 WeakPolarHBondContact O-CA 3.42Å; N1015-A1086 WeakPolarHBondContact O-CB 3.37Å; C1017-A1086 PolarHBondContact SG-N 2.94Å; A1086-T1088 PolarHBondContact O-N 3.41Å; A1086-L1115 HydrophobicContact CB-CD1 3.78Å; A1086-L1115 WeakPolarHBondContact O-CD1 3.43Å
1087	G	98.5	Very high	98.4	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.7	8.1	179.4	0	0	0	0	0	116.5	Q1011 N1015 E1035 N1085 V1089	Q1011-G1087 WeakPolarHBondContact CG-O 3.47Å; Q1011-G1087 PolarHBondContact NE2-O 2.9Å; N1015-G1087 VanDerWaalsContact CG-CA 3.43Å; N1015-G1087 PolarHBondContact O-N 2.96Å; N1015-G1087 VanDerWaalsContact O-N 3.1Å; N1015-G1087 WeakPolarHBondContact OD1-CA 3.29Å; E1035-G1087 WeakPolarHBondContact CG-O 3.42Å; N1085-G1087 PolarHBondContact O-N 3.45Å; G1087-V1089 PolarHBondContact O-N 3.44Å
1088	T	98.9	Very high	98.4	Very high	4 Å²	4	11.7 Å²	11.7	3%	0.025	7%	0.069	C	C	.	.			trans	-66.8	131.7	178.5	-66.5	0	0	0	0	112	P830 V1032 I1084 N1085 A1086	P830-T1088 WeakPolarHBondContact CA-OG1 3.14Å; P830-T1088 HydrophobicContact CB-CG2 3.61Å; P830-T1088 WeakPolarHBondContact CB-OG1 3.44Å; P830-T1088 WeakPolarHBondContact O-CB 3.46Å; P830-T1088 WeakPolarHBondContact O-CG2 3.38Å; P830-T1088 PolarHBondContact O-OG1 3.09Å; V1032-T1088 HydrophobicContact CG1-CG2 3.23Å; I1084-T1088 HydrophobicContact CG2-CG2 3.99Å; N1085-T1088 WeakPolarHBondContact O-CB 3.38Å; N1085-T1088 PolarHBondContact O-N 3.23Å; N1085-T1088 PolarHBondContact O-OG1 3.47Å; A1086-T1088 PolarHBondContact O-N 3.41Å
1089	V	98.9	Very high	98.4	Very high	0 Å²	0	9.2 Å²	9.2	0%	0	5%	0.053	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	130.9	-179.3	-159.6	0	0	0	0	109.4	H1010 Q1011 V1032 V1033 W1038 L1041 F1052 W1057 G1087	H1010-V1089 WeakPolarHBondContact O-CA 3.19Å; H1010-V1089 WeakPolarHBondContact O-CG1 3.34Å; Q1011-V1089 HydrophobicContact CG-CB 4.11Å; Q1011-V1089 HydrophobicContact CG-CG1 4.19Å; Q1011-V1089 HydrophobicContact CG-CG2 3.71Å; V1032-V1089 WeakPolarHBondContact CA-O 3.26Å; V1033-V1089 HydrophobicContact CB-CB 4.29Å; V1033-V1089 PolarHBondContact N-O 3.47Å; V1033-V1089 PolarHBondContact O-N 3.33Å; W1038-V1089 HydrophobicContact CB-CG2 3.64Å; L1041-V1089 HydrophobicContact CD2-CB 4.16Å; L1041-V1089 HydrophobicContact CD2-CG1 3.64Å; F1052-V1089 HydrophobicContact CE2-CG1 4.41Å; F1052-V1089 HydrophobicContact CZ-CG1 4.44Å; W1057-V1089 HydrophobicContact CH2-CG1 3.76Å; G1087-V1089 PolarHBondContact O-N 3.44Å
1090	H	98.9	Very high	98.5	Very high	5 Å²	5	9 Å²	9	2%	0.023	5%	0.05	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	160.5	-175.5	71.8	-78.4	0	0	0	114.8	G1009 H1010 E1012 W1030 F1031 V1032	G1009-H1090 WeakPolarHBondContact CA-O 3.39Å; H1010-H1090 AromaticContact CE1-CD2 3.83Å; H1010-H1090 AromaticContact CE1-CE1 3.48Å; H1010-H1090 PolarHBondContact CE1-CE1 2.85Å; H1010-H1090 VanDerWaalsContact CE1-CE1 3.48Å; H1010-H1090 AromaticContact CE1-NE2 3.28Å; H1010-H1090 PolarHBondContact CE1-NE2 3.49Å; H1010-H1090 VanDerWaalsContact CE1-NE2 3.28Å; H1010-H1090 PolarHBondContact N-O 2.84Å; H1010-H1090 VanDerWaalsContact N-O 3.1Å; H1010-H1090 PolarHBondContact ND1-O 3.15Å; H1010-H1090 AromaticContact NE2-CE1 3.38Å; H1010-H1090 PolarHBondContact NE2-CE1 2.95Å; H1010-H1090 AromaticContact NE2-NE2 3.5Å; H1010-H1090 PolarHBondContact O-N 3.19Å; E1012-H1090 IonicContact OE1-CE1 3.97Å; W1030-H1090 AromaticContact CZ3-CD2 3.5Å; W1030-H1090 AromaticContact CZ3-NE2 3.88Å; F1031-H1090 VanDerWaalsContact O-CA 3.26Å; F1031-H1090 WeakPolarHBondContact O-CA 3.07Å; F1031-H1090 WeakPolarHBondContact O-CB 3.4Å; V1032-H1090 HydrophobicContact CB-CB 4.5Å; V1032-H1090 HydrophobicContact CG2-CB 3.83Å
1091	W	98.9	Very high	98.5	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	5%	0.05	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	153.9	172.7	54.2	106.1	0	0	0	110.8	F1031 V1033 L1041 W1058 P1059 L1061 L1064 V1071	F1031-W1091 HydrophobicContact CB-CD2 3.73Å; F1031-W1091 HydrophobicContact CB-CE3 4.46Å; F1031-W1091 HydrophobicContact CB-CG 3.98Å; F1031-W1091 HydrophobicContact CB-CH2 4.35Å; F1031-W1091 HydrophobicContact CB-CZ2 3.64Å; F1031-W1091 VanDerWaalsContact CB-NE1 3.3Å; F1031-W1091 AromaticContact CD2-CD1 3.65Å; F1031-W1091 HydrophobicContact CD2-CG 4.48Å; F1031-W1091 AromaticContact CD2-NE1 3.66Å; F1031-W1091 AromaticContact CG-CD1 3.85Å; F1031-W1091 AromaticContact CG-CE2 3.91Å; F1031-W1091 HydrophobicContact CG-CZ2 4.38Å; F1031-W1091 AromaticContact CG-NE1 3.42Å; F1031-W1091 PolarHBondContact N-O 3.02Å; F1031-W1091 PolarHBondContact O-N 3.16Å; V1033-W1091 HydrophobicContact CG2-CH2 3.67Å; V1033-W1091 HydrophobicContact CG2-CZ3 3.87Å; L1041-W1091 HydrophobicContact CD2-CZ3 4.22Å; W1058-W1091 AromaticContact CD2-CD1 3.82Å; W1058-W1091 AromaticContact CE2-CD1 3.61Å; W1058-W1091 HydrophobicContact CE3-CB 4.22Å; W1058-W1091 AromaticContact CE3-CD1 3.94Å; W1058-W1091 HydrophobicContact CE3-CG 4.41Å; W1058-W1091 HydrophobicContact CH2-CB 4.39Å; W1058-W1091 AromaticContact CH2-CD1 3.68Å; W1058-W1091 HydrophobicContact CH2-CG 4.46Å; W1058-W1091 AromaticContact CZ2-CD1 3.57Å; W1058-W1091 HydrophobicContact CZ3-CB 3.95Å; W1058-W1091 AromaticContact CZ3-CD1 3.87Å; W1058-W1091 HydrophobicContact CZ3-CG 4.33Å; P1059-W1091 HydrophobicContact CB-CH2 4.08Å; P1059-W1091 HydrophobicContact CB-CZ2 3.82Å; P1059-W1091 HydrophobicContact CG-CD2 3.97Å; P1059-W1091 HydrophobicContact CG-CE3 3.92Å; P1059-W1091 HydrophobicContact CG-CH2 3.75Å; P1059-W1091 HydrophobicContact CG-CZ2 3.73Å; P1059-W1091 HydrophobicContact CG-CZ3 3.84Å; L1061-W1091 HydrophobicContact CD2-CZ2 3.84Å; L1064-W1091 HydrophobicContact CD1-CH2 3.64Å; L1064-W1091 HydrophobicContact CD1-CZ2 4.01Å; V1071-W1091 HydrophobicContact CG1-CH2 4.48Å; V1071-W1091 HydrophobicContact CG1-CZ2 4.41Å
1092	V	98.9	Very high	98.5	Very high	5 Å²	5	9.1 Å²	9.1	3%	0.03	5%	0.052	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	136.1	-166.8	-166.7	0	0	0	0	111.3	R1006 T1007 C1028 E1029 W1030	R1006-V1092 WeakPolarHBondContact CA-O 3.49Å; T1007-V1092 PolarHBondContact N-O 3.41Å; T1007-V1092 PolarHBondContact O-N 3.24Å; C1028-V1092 HydrophobicContact CB-CG1 4.23Å; E1029-V1092 WeakPolarHBondContact O-CA 3.35Å; E1029-V1092 WeakPolarHBondContact O-CG1 3.3Å; W1030-V1092 HydrophobicContact CD2-CB 4.45Å; W1030-V1092 HydrophobicContact CD2-CG1 3.99Å; W1030-V1092 HydrophobicContact CD2-CG2 3.63Å; W1030-V1092 HydrophobicContact CE3-CG2 3.42Å; W1030-V1092 VanDerWaalsContact CE3-CG2 3.42Å; W1030-V1092 HydrophobicContact CG-CG1 4.15Å; W1030-V1092 HydrophobicContact CG-CG2 4.35Å; W1030-V1092 HydrophobicContact CH2-CG2 3.9Å; W1030-V1092 HydrophobicContact CZ2-CG1 4.26Å; W1030-V1092 HydrophobicContact CZ2-CG2 4.09Å; W1030-V1092 HydrophobicContact CZ3-CG2 3.56Å
1093	Q	98.8	Very high	98.5	Very high	13 Å²	13	9.2 Å²	9.2	6%	0.061	5%	0.053	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	137.8	171.3	171.3	160.9	-38.8	0	0	111.2	Q870 A872 S1005 R1006 C1028 E1029 W1058	Q870-Q1093 PolarHBondContact O-NE2 2.88Å; Q870-Q1093 PolarHBondContact O-OE1 2.98Å; A872-Q1093 HydrophobicContact CB-CB 4.16Å; A872-Q1093 HydrophobicContact CB-CG 4.22Å; S1005-Q1093 CarbonylContact O-C 3.58Å; S1005-Q1093 WeakPolarHBondContact O-CA 3.35Å; R1006-Q1093 HydrophobicContact CG-CB 4.31Å; R1006-Q1093 VanDerWaalsContact CZ-OE1 3.27Å; C1028-Q1093 CarbonylContact C-O 3.55Å; C1028-Q1093 WeakPolarHBondContact CA-O 3.44Å; E1029-Q1093 PolarHBondContact N-O 2.92Å; E1029-Q1093 PolarHBondContact O-N 2.96Å; W1058-Q1093 HydrophobicContact CH2-CB 3.8Å; W1058-Q1093 HydrophobicContact CZ2-CB 4.21Å
1094	A	98.6	Very high	98.5	Very high	0 Å²	0	9.6 Å²	9.6	0%	0	5%	0.054	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	127.4	164.5	0	0	0	0	0	111.2	K1001 V1002 G1004 S1005	K1001-A1094 HydrophobicContact CB-CB 3.78Å; K1001-A1094 HydrophobicContact CD-CB 3.86Å; K1001-A1094 HydrophobicContact CG-CB 4.42Å; V1002-A1094 WeakPolarHBondContact O-CB 3.43Å; G1004-A1094 PolarHBondContact N-O 3.48Å; S1005-A1094 PolarHBondContact O-N 3.35Å
1095	V	97.3	Very high	98.5	Very high	74 Å²	74	9.5 Å²	9.5	45%	0.448	5%	0.054	S	C	.	.	S	Bend	trans	-86.1	-42.7	170.6	-175.3	0	0	0	0	109.7	P1003 D1027 E1029 I1075	P1003-V1095 WeakPolarHBondContact CB-O 3.43Å; D1027-V1095 HydrophobicContact CB-CB 4.2Å; D1027-V1095 WeakPolarHBondContact O-CB 3.31Å; D1027-V1095 PolarHBondContact O-N 3.44Å; E1029-V1095 HydrophobicContact CB-CG2 3.74Å; I1075-V1095 HydrophobicContact CD1-CG2 4.32Å
1096	G	94.4	Very high	98.5	Very high	12 Å²	12	9.1 Å²	9.1	12%	0.124	5%	0.052	C	C	.	.	S	Bend	trans	-117.8	176.6	176.7	0	0	0	0	0	113.9	D1027 C1098	D1027-G1096 PolarHBondContact O-N 3.22Å; G1096-C1098 PolarHBondContact O-N 3.46Å; G1096-C1098 PolarHBondContact O-SG 3.19Å
1097	W	98.3	Very high	98.4	Very high	50 Å²	50	9 Å²	9	19%	0.189	5%	0.051	C	C	.	.	S	Bend	trans	-67	116.8	166.4	-62.3	-100.1	0	0	0	109.2	S906 F907 S910 K1001 P1003 P1025 G1026	S906-W1097 PolarHBondContact OG-NE1 3.49Å; F907-W1097 HydrophobicContact CB-CD2 4.1Å; F907-W1097 HydrophobicContact CB-CG 4.21Å; F907-W1097 HydrophobicContact CB-CZ2 4.46Å; F907-W1097 AromaticContact CD2-CD2 3.71Å; F907-W1097 HydrophobicContact CD2-CD2 3.71Å; F907-W1097 AromaticContact CD2-CE3 3.56Å; F907-W1097 HydrophobicContact CD2-CE3 3.56Å; F907-W1097 HydrophobicContact CD2-CG 4.31Å; F907-W1097 HydrophobicContact CD2-CH2 4.27Å; F907-W1097 HydrophobicContact CD2-CZ2 4.37Å; F907-W1097 AromaticContact CD2-CZ3 3.87Å; F907-W1097 HydrophobicContact CD2-CZ3 3.87Å; F907-W1097 HydrophobicContact CE2-CE3 4.14Å; F907-W1097 HydrophobicContact CE2-CZ3 4.35Å; F907-W1097 HydrophobicContact CG-CD2 4.35Å; S910-W1097 VanDerWaalsContact CB-CH2 3.44Å; K1001-W1097 WeakPolarHBondContact O-CA 3.48Å; P1003-W1097 VanDerWaalsContact CD-CD2 3.43Å; P1003-W1097 HydrophobicContact CG-CD2 3.79Å; P1003-W1097 HydrophobicContact CG-CE3 3.74Å; P1003-W1097 HydrophobicContact CG-CH2 3.63Å; P1003-W1097 HydrophobicContact CG-CZ2 3.7Å; P1003-W1097 HydrophobicContact CG-CZ3 3.66Å; P1025-W1097 WeakPolarHBondContact CD-O 3.38Å; G1026-W1097 WeakPolarHBondContact CA-O 3.45Å; G1026-W1097 PolarHBondContact N-O 3.01Å
1098	C	98.5	Very high	98.3	Very high	1 Å²	1	11.8 Å²	11.8	1%	0.007	7%	0.065	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	161.2	-175.6	52.9	0	0	0	0	111.2	Q903 K1001 G1024 G1026 C1028 G1096	Q903-C1098 PolarHBondContact NE2-O 3.28Å; K1001-C1098 WeakPolarHBondContact CA-O 3.25Å; K1001-C1098 VanDerWaalsContact CB-O 3.32Å; K1001-C1098 WeakPolarHBondContact CB-O 3.43Å; K1001-C1098 PolarHBondContact N-O 3.23Å; K1001-C1098 PolarHBondContact O-N 3.01Å; G1024-C1098 WeakPolarHBondContact O-CA 3.4Å; G1026-C1098 VanDerWaalsContact O-CB 3.31Å; G1026-C1098 WeakPolarHBondContact O-CB 3.25Å; C1028-C1098 VanDerWaalsContact SG-SG 3.67Å; G1096-C1098 PolarHBondContact O-N 3.46Å; G1096-C1098 PolarHBondContact O-SG 3.19Å
1099	N	98.8	Very high	98.2	Very high	2 Å²	2	13.3 Å²	13.3	1%	0.011	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	152.6	161.4	-61.2	-12.2	0	0	0	109.2	F848 T850 Q903 L998 Y999 M1000 N1022 I1023 G1024	F848-N1099 PolarHBondContact O-ND2 3.36Å; F848-N1099 VanDerWaalsContact O-ND2 3.13Å; T850-N1099 PolarHBondContact N-ND2 2.93Å; T850-N1099 PolarHBondContact OG1-ND2 3.5Å; T850-N1099 PolarHBondContact OG1-OD1 3.34Å; Q903-N1099 PolarHBondContact NE2-OD1 3.25Å; L998-N1099 HydrophobicContact CD1-CB 4.24Å; Y999-N1099 CarbonylContact O-C 3.6Å; Y999-N1099 WeakPolarHBondContact O-CA 3.47Å; Y999-N1099 WeakPolarHBondContact O-CB 3.25Å; M1000-N1099 WeakPolarHBondContact CA-OD1 3.39Å; N1022-N1099 PolarHBondContact OD1-O 2.91Å; I1023-N1099 HydrophobicContact CB-CB 4.01Å; I1023-N1099 VanDerWaalsContact CB-O 3.28Å; I1023-N1099 WeakPolarHBondContact CB-O 3.21Å; I1023-N1099 HydrophobicContact CG1-CB 4.09Å; I1023-N1099 WeakPolarHBondContact CG1-O 3.43Å; I1023-N1099 HydrophobicContact CG2-CB 4.49Å; I1023-N1099 PolarHBondContact N-O 3.42Å; G1024-N1099 PolarHBondContact O-N 3.14Å
1100	N	98.9	Very high	98.1	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	153	165.6	-63.2	80.1	0	0	0	109.3	L998 Y999 K1001 N1020 I1021 N1022 C1028 Q1076	L998-N1100 WeakPolarHBondContact CA-O 3.42Å; Y999-N1100 HydrophobicContact CD2-CB 4.36Å; Y999-N1100 PolarHBondContact N-O 3.05Å; Y999-N1100 PolarHBondContact O-N 3.18Å; K1001-N1100 WeakPolarHBondContact CE-OD1 3.48Å; K1001-N1100 PolarHBondContact NZ-OD1 3.28Å; N1020-N1100 PolarHBondContact OD1-ND2 3.09Å; I1021-N1100 VanDerWaalsContact O-CA 3.26Å; I1021-N1100 WeakPolarHBondContact O-CA 3.35Å; N1022-N1100 WeakPolarHBondContact CA-ND2 3.42Å; C1028-N1100 PolarHBondContact SG-OD1 3.1Å; Q1076-N1100 PolarHBondContact OE1-ND2 3Å
1101	I	98.9	Very high	98	Very high	1 Å²	1	15.6 Å²	15.6	1%	0.005	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	143.8	162.5	55.1	-178.7	0	0	0	109.4	F848 L954 L967 V996 Q997 L998 N1020 I1021 I1023 W1103	F848-I1101 HydrophobicContact CD1-CD1 4.05Å; F848-I1101 HydrophobicContact CD1-CG2 3.57Å; F848-I1101 HydrophobicContact CD2-CD1 4.46Å; F848-I1101 HydrophobicContact CE1-CD1 3.73Å; F848-I1101 HydrophobicContact CE1-CG2 3.91Å; F848-I1101 HydrophobicContact CE2-CD1 4.19Å; F848-I1101 HydrophobicContact CG-CD1 4.39Å; F848-I1101 HydrophobicContact CG-CG2 4.34Å; F848-I1101 HydrophobicContact CZ-CD1 3.8Å; L954-I1101 HydrophobicContact CD1-CG2 4.32Å; L967-I1101 HydrophobicContact CD1-CD1 4.23Å; L967-I1101 HydrophobicContact CD2-CD1 3.69Å; V996-I1101 HydrophobicContact CG1-CB 3.95Å; V996-I1101 HydrophobicContact CG1-CG2 4.19Å; Q997-I1101 CarbonylContact O-C 3.49Å; Q997-I1101 WeakPolarHBondContact O-CA 3.26Å; L998-I1101 HydrophobicContact CB-CG2 4.4Å; L998-I1101 HydrophobicContact CD1-CG2 3.82Å; N1020-I1101 CarbonylContact C-O 3.44Å; N1020-I1101 WeakPolarHBondContact CA-O 3.39Å; I1021-I1101 HydrophobicContact CB-CD1 4.43Å; I1021-I1101 HydrophobicContact CB-CG1 3.94Å; I1021-I1101 PolarHBondContact N-O 3.48Å; I1021-I1101 PolarHBondContact O-N 3.37Å; I1023-I1101 HydrophobicContact CD1-CD1 4.08Å; I1023-I1101 HydrophobicContact CD1-CG1 4.04Å; I1023-I1101 HydrophobicContact CD1-CG2 4.49Å; I1101-W1103 HydrophobicContact CB-CZ3 4.37Å; I1101-W1103 HydrophobicContact CD1-CZ3 4.04Å; I1101-W1103 HydrophobicContact CG1-CZ3 4.04Å
1102	A	98.9	Very high	98	Very high	7 Å²	7	15.7 Å²	15.7	6%	0.058	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	159.6	174.9	0	0	0	0	0	113.3	Q997 Y999 V1019 N1020	Q997-A1102 PolarHBondContact N-O 3.24Å; Q997-A1102 PolarHBondContact O-N 3.06Å; Y999-A1102 HydrophobicContact CE2-CB 3.85Å; V1019-A1102 WeakPolarHBondContact O-CA 3.19Å; V1019-A1102 VanDerWaalsContact O-CB 3.29Å; V1019-A1102 WeakPolarHBondContact O-CB 3.49Å; N1020-A1102 HydrophobicContact CB-CB 4.19Å
1103	W	98.9	Very high	97.9	Very high	2 Å²	2	15.6 Å²	15.6	1%	0.008	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	164.7	170.5	55.7	90.9	0	0	0	109.3	L967 L970 A974 V976 G992 V996 V1019 I1021 I1101	L967-W1103 HydrophobicContact CD1-CH2 4Å; L967-W1103 HydrophobicContact CD1-CZ3 3.79Å; L967-W1103 HydrophobicContact CD2-CH2 4Å; L967-W1103 HydrophobicContact CD2-CZ3 4.38Å; L967-W1103 HydrophobicContact CG-CH2 4.46Å; L970-W1103 HydrophobicContact CD1-CH2 3.76Å; L970-W1103 HydrophobicContact CD1-CZ2 3.51Å; A974-W1103 VanDerWaalsContact O-CZ2 3.31Å; A974-W1103 WeakPolarHBondContact O-CZ2 3.28Å; A974-W1103 PolarHBondContact O-NE1 2.83Å; V976-W1103 HydrophobicContact CB-CG 4.47Å; V976-W1103 HydrophobicContact CG2-CD2 3.71Å; V976-W1103 HydrophobicContact CG2-CE3 4.23Å; V976-W1103 HydrophobicContact CG2-CG 3.86Å; V976-W1103 HydrophobicContact CG2-CZ2 4.36Å; G992-W1103 WeakPolarHBondContact O-CA 3.45Å; V996-W1103 HydrophobicContact CB-CE3 4.27Å; V996-W1103 HydrophobicContact CG1-CE3 3.94Å; V996-W1103 HydrophobicContact CG1-CZ3 4.23Å; V996-W1103 HydrophobicContact CG2-CD2 4.31Å; V996-W1103 HydrophobicContact CG2-CE3 3.73Å; V996-W1103 HydrophobicContact CG2-CZ3 4.22Å; V1019-W1103 HydrophobicContact CB-CD2 4.44Å; V1019-W1103 HydrophobicContact CB-CZ2 4.17Å; V1019-W1103 HydrophobicContact CG1-CD2 4.45Å; V1019-W1103 HydrophobicContact CG1-CH2 4.01Å; V1019-W1103 HydrophobicContact CG1-CZ2 3.45Å; V1019-W1103 VanDerWaalsContact CG1-CZ2 3.45Å; V1019-W1103 PolarHBondContact N-O 2.89Å; V1019-W1103 PolarHBondContact O-N 3.07Å; V1019-W1103 VanDerWaalsContact O-N 3.1Å; I1021-W1103 HydrophobicContact CD1-CH2 4.04Å; I1101-W1103 HydrophobicContact CB-CZ3 4.37Å; I1101-W1103 HydrophobicContact CD1-CZ3 4.04Å; I1101-W1103 HydrophobicContact CG1-CZ3 4.04Å
1104	N	98.9	Very high	97.9	Very high	7 Å²	7	18.9 Å²	18.9	4%	0.037	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	156.8	174.1	-63.2	111.7	0	0	0	112.3	L983 M993 E1012 F1016 C1017	L983-N1104 HydrophobicContact CD1-CB 3.51Å; M993-N1104 WeakPolarHBondContact CA-OD1 3.27Å; M993-N1104 HydrophobicContact CB-CB 4.22Å; M993-N1104 HydrophobicContact CE-CB 4.06Å; M993-N1104 VanDerWaalsContact CG-OD1 3.31Å; M993-N1104 WeakPolarHBondContact CG-OD1 3.42Å; M993-N1104 CarbonylContact O-C 3.49Å; M993-N1104 PolarHBondContact O-N 2.85Å; E1012-N1104 PolarHBondContact OE2-ND2 3.16Å; F1016-N1104 HydrophobicContact CB-CB 4.17Å; C1017-N1104 CarbonylContact O-C 3.57Å; C1017-N1104 WeakPolarHBondContact O-CA 3.32Å; C1017-N1104 WeakPolarHBondContact O-CB 3.16Å; C1017-N1104 PolarHBondContact O-ND2 3.07Å; C1017-N1104 VanDerWaalsContact O-ND2 3.12Å
1105	V	98.8	Very high	97.9	Very high	1 Å²	1	19.4 Å²	19.4	1%	0.006	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	145.9	166.8	-61.8	0	0	0	0	109.2	R975 C1017 V1019 W1083 P1107	R975-V1105 WeakPolarHBondContact O-CG1 3.18Å; C1017-V1105 WeakPolarHBondContact CA-O 3.3Å; C1017-V1105 HydrophobicContact CB-CG2 3.94Å; C1017-V1105 VanDerWaalsContact CB-O 3.31Å; C1017-V1105 WeakPolarHBondContact CB-O 3.07Å; C1017-V1105 PolarHBondContact N-O 3.46Å; C1017-V1105 PolarHBondContact O-N 3.47Å; V1019-V1105 HydrophobicContact CG2-CG1 4.22Å; V1019-V1105 HydrophobicContact CG2-CG2 4.08Å; W1083-V1105 HydrophobicContact CH2-CG2 3.37Å; W1083-V1105 HydrophobicContact CZ2-CG2 4.29Å; W1083-V1105 HydrophobicContact CZ3-CG2 3.51Å; V1105-P1107 WeakPolarHBondContact O-CD 3.46Å
1106	G	98.5	Very high	98	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	9%	0.086	C	C	.	.			trans	-112.3	99.2	171.3	0	0	0	0	0	110.3	N981 L982 L1108	N981-G1106 CarbonylContact C-O 3.6Å; N981-G1106 WeakPolarHBondContact CA-O 3.29Å; N981-G1106 PolarHBondContact OD1-N 3.16Å; L982-G1106 WeakPolarHBondContact CG-O 3.42Å; L982-G1106 PolarHBondContact N-O 3.11Å; G1106-L1108 PolarHBondContact O-N 3.5Å
1107	P	97.6	Very high	98.1	Very high	6 Å²	6	17.2 Å²	17.2	4%	0.039	9%	0.092	C	C	.	.	B	Isolated β-bridge	trans	-60.6	134.2	173.5	-23.4	34.4	0	0	0	111.2	T825 W1083 V1105 T1109 Q1112	T825-P1107 HydrophobicContact CG2-CB 3.77Å; T825-P1107 HydrophobicContact CG2-CG 3.66Å; W1083-P1107 HydrophobicContact CH2-CG 3.92Å; W1083-P1107 HydrophobicContact CZ2-CG 3.81Å; V1105-P1107 WeakPolarHBondContact O-CD 3.46Å; P1107-T1109 HydrophobicContact CB-CG2 4.07Å; P1107-T1109 PolarHBondContact O-N 2.97Å; P1107-T1109 PolarHBondContact O-OG1 3.37Å; P1107-Q1112 WeakPolarHBondContact O-CB 3.44Å
1108	L	96.1	Very high	98.1	Very high	57 Å²	57	18.8 Å²	18.8	30%	0.298	10%	0.101	S	C	.	.	S	Bend	trans	-65.7	77.1	175.7	-174.4	67.6	0	0	0	111.5	G980 L982 G1106 I1145 L1152	G980-L1108 PolarHBondContact O-N 2.87Å; L982-L1108 HydrophobicContact CD2-CB 4.5Å; L982-L1108 HydrophobicContact CD2-CD1 3.62Å; G1106-L1108 PolarHBondContact O-N 3.5Å; L1108-I1145 HydrophobicContact CD1-CD1 4.11Å; L1108-I1145 HydrophobicContact CD1-CG2 4.12Å; L1108-I1145 HydrophobicContact CD2-CG2 3.74Å; L1108-L1152 HydrophobicContact CD1-CD2 3.6Å; L1108-L1152 HydrophobicContact CG-CD2 3.8Å
1109	T	96.4	Very high	98.1	Very high	36 Å²	36	19.1 Å²	19.1	22%	0.221	10%	0.102	C	C	.	.	S	Bend	trans	-142.9	148.2	-175.4	66	0	0	0	0	111.2	P1107 C1111 Q1112 Y1113	P1107-T1109 HydrophobicContact CB-CG2 4.07Å; P1107-T1109 PolarHBondContact O-N 2.97Å; P1107-T1109 PolarHBondContact O-OG1 3.37Å; T1109-C1111 PolarHBondContact O-N 3.33Å; T1109-Q1112 PolarHBondContact O-N 2.97Å; T1109-Q1112 WeakPolarHBondContact OG1-CB 3.5Å; T1109-Q1112 PolarHBondContact OG1-N 2.82Å; T1109-Y1113 PolarHBondContact O-N 2.66Å; T1109-Y1113 VanDerWaalsContact O-N 3.16Å
1110	A	96.2	Very high	98.1	Very high	10 Å²	10	19.6 Å²	19.6	8%	0.083	10%	0.104	C	C	.	.	H	α-helix	trans	-57.2	-31.6	173.9	0	0	0	0	0	113.6	K1114 D1149 K1151 L1152 M1155	A1110-K1114 WeakPolarHBondContact O-CB 3.36Å; A1110-K1114 PolarHBondContact O-N 2.86Å; A1110-D1149 PolarHBondContact N-OD2 2.98Å; A1110-K1151 HydrophobicContact CB-CB 3.98Å; A1110-K1151 HydrophobicContact CB-CD 3.99Å; A1110-K1151 HydrophobicContact CB-CG 3.82Å; A1110-L1152 HydrophobicContact CB-CB 4.14Å; A1110-M1155 HydrophobicContact CB-SD 4.13Å
1111	C	97.1	Very high	98	Very high	43 Å²	43	22.1 Å²	22.1	29%	0.291	12%	0.116	S	C	.	.	H	α-helix	trans	-67.9	-51.6	179.3	-175.7	0	0	0	0	111.7	P827 T1109 Y1113 K1114 L1115	P827-C1111 HydrophobicContact CG-CB 4.31Å; T1109-C1111 PolarHBondContact O-N 3.33Å; C1111-Y1113 PolarHBondContact O-N 3.31Å; C1111-K1114 PolarHBondContact O-N 3.48Å; C1111-L1115 WeakPolarHBondContact O-CG 3.12Å; C1111-L1115 PolarHBondContact O-N 2.79Å; C1111-L1115 VanDerWaalsContact O-N 3.08Å
1112	Q	98.6	Very high	97.9	Very high	2 Å²	2	22.9 Å²	22.9	1%	0.009	12%	0.119	C	C	.	.	H	α-helix	trans	-59.7	-46.2	178.1	175.7	63.1	98.6	0	0	111.6	L982 N1015 C1017 P1107 T1109 A1116	L982-Q1112 HydrophobicContact CD1-CG 4.39Å; N1015-Q1112 PolarHBondContact O-NE2 2.99Å; C1017-Q1112 PolarHBondContact SG-OE1 3.23Å; C1017-Q1112 VanDerWaalsContact SG-OE1 3.38Å; P1107-Q1112 WeakPolarHBondContact O-CB 3.44Å; T1109-Q1112 PolarHBondContact O-N 2.97Å; T1109-Q1112 WeakPolarHBondContact OG1-CB 3.5Å; T1109-Q1112 PolarHBondContact OG1-N 2.82Å; Q1112-A1116 WeakPolarHBondContact O-CB 3.32Å; Q1112-A1116 PolarHBondContact O-N 3.43Å
1113	Y	98.6	Very high	97.8	Very high	3 Å²	3	22.9 Å²	22.9	1%	0.012	12%	0.118	C	C	.	.	H	α-helix	trans	-66.2	-43.5	-177.9	-174.7	-97.5	0	0	0	111.9	L982 T1109 C1111 A1116 V1117 M1134 S1138 M1141 L1152 M1155 I1156 C1159	L982-Y1113 HydrophobicContact CD1-CD2 4.49Å; T1109-Y1113 PolarHBondContact O-N 2.66Å; T1109-Y1113 VanDerWaalsContact O-N 3.16Å; C1111-Y1113 PolarHBondContact O-N 3.31Å; Y1113-A1116 PolarHBondContact O-N 2.9Å; Y1113-V1117 HydrophobicContact CD1-CG2 4.24Å; Y1113-V1117 HydrophobicContact CE1-CG2 3.83Å; Y1113-V1117 HydrophobicContact CE2-CG2 4.28Å; Y1113-V1117 WeakPolarHBondContact O-CG2 3.24Å; Y1113-V1117 PolarHBondContact O-N 3.34Å; Y1113-M1134 HydrophobicContact CD2-CE 4.14Å; Y1113-M1134 HydrophobicContact CE2-CE 4.03Å; Y1113-S1138 WeakPolarHBondContact CE2-OG 3.48Å; Y1113-S1138 PolarHBondContact OH-OG 3.13Å; Y1113-M1141 HydrophobicContact CD2-CE 3.86Å; Y1113-M1141 HydrophobicContact CD2-SD 4.28Å; Y1113-M1141 HydrophobicContact CE2-CE 4.02Å; Y1113-M1141 HydrophobicContact CE2-SD 4.16Å; Y1113-L1152 VanDerWaalsContact CB-CD1 3.48Å; Y1113-L1152 HydrophobicContact CD1-CD1 4.19Å; Y1113-L1152 HydrophobicContact CD2-CD1 4.49Å; Y1113-L1152 HydrophobicContact CG-CD1 3.81Å; Y1113-M1155 HydrophobicContact CD1-CB 3.72Å; Y1113-M1155 HydrophobicContact CE1-CB 3.82Å; Y1113-I1156 HydrophobicContact CD1-CG1 4.29Å; Y1113-I1156 HydrophobicContact CD2-CG1 4.32Å; Y1113-I1156 HydrophobicContact CE1-CG1 3.95Å; Y1113-I1156 HydrophobicContact CE2-CG1 3.99Å; Y1113-I1156 HydrophobicContact CG-CG1 4.46Å; Y1113-C1159 VanDerWaalsContact OH-CB 3.26Å; Y1113-C1159 WeakPolarHBondContact OH-CB 3.39Å
1114	K	97.8	Very high	97.6	Very high	83 Å²	83	26.4 Å²	26.4	36%	0.361	13%	0.133	S	C	.	.	H	α-helix	trans	-53.7	-56.8	173.7	175.2	-175.3	177.2	-71.9	0	111.4	A1110 C1111 A1116 V1117 E1118 M1155	A1110-K1114 WeakPolarHBondContact O-CB 3.36Å; A1110-K1114 PolarHBondContact O-N 2.86Å; C1111-K1114 PolarHBondContact O-N 3.48Å; K1114-A1116 VanDerWaalsContact C-N 3.25Å; K1114-A1116 PolarHBondContact O-N 3.13Å; K1114-V1117 PolarHBondContact O-N 2.85Å; K1114-E1118 WeakPolarHBondContact CE-OE1 3.46Å; K1114-E1118 HydrophobicContact CG-CG 4.45Å; K1114-E1118 WeakPolarHBondContact CG-OE2 3.28Å; K1114-E1118 IonicContact NZ-OE1 2.68Å; K1114-E1118 PolarHBondContact NZ-OE1 2.9Å; K1114-E1118 IonicContact NZ-OE2 2.65Å; K1114-E1118 PolarHBondContact NZ-OE2 3.35Å; K1114-E1118 WeakPolarHBondContact O-CB 3.45Å; K1114-E1118 WeakPolarHBondContact O-CG 3.42Å; K1114-E1118 PolarHBondContact O-N 2.92Å; K1114-M1155 HydrophobicContact CB-CE 4.1Å; K1114-M1155 HydrophobicContact CB-SD 4.04Å; K1114-M1155 HydrophobicContact CD-CE 4.36Å; K1114-M1155 HydrophobicContact CG-CE 4.44Å
1115	L	98.4	Very high	97.4	Very high	11 Å²	11	30.9 Å²	30.9	6%	0.058	16%	0.157	C	C	.	.	H	α-helix	trans	-64	-32	-175.5	-70.9	172.6	0	0	0	112.3	N1015 E1035 A1086 C1111 R1119	N1015-L1115 HydrophobicContact CB-CB 3.99Å; N1015-L1115 PolarHBondContact ND2-O 3.29Å; E1035-L1115 VanDerWaalsContact CD-CD2 3.47Å; E1035-L1115 HydrophobicContact CG-CD1 4.24Å; E1035-L1115 HydrophobicContact CG-CD2 3.98Å; E1035-L1115 WeakPolarHBondContact OE1-CD2 3.38Å; A1086-L1115 HydrophobicContact CB-CD1 3.78Å; A1086-L1115 WeakPolarHBondContact O-CD1 3.43Å; C1111-L1115 WeakPolarHBondContact O-CG 3.12Å; C1111-L1115 PolarHBondContact O-N 2.79Å; C1111-L1115 VanDerWaalsContact O-N 3.08Å; L1115-R1119 WeakPolarHBondContact O-CB 3.33Å; L1115-R1119 PolarHBondContact O-N 3.32Å
1116	A	98.7	Very high	97.2	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-71.6	-40.9	176.2	0	0	0	0	0	113.1	N1014 F1016 Q1112 Y1113 K1114 Y1120 M1134	N1014-A1116 WeakPolarHBondContact O-CA 3.42Å; N1014-A1116 VanDerWaalsContact O-CB 3.24Å; N1014-A1116 WeakPolarHBondContact O-CB 3.47Å; F1016-A1116 HydrophobicContact CD2-CB 4.38Å; F1016-A1116 HydrophobicContact CE2-CB 3.74Å; F1016-A1116 HydrophobicContact CZ-CB 4.21Å; Q1112-A1116 WeakPolarHBondContact O-CB 3.32Å; Q1112-A1116 PolarHBondContact O-N 3.43Å; Y1113-A1116 PolarHBondContact O-N 2.9Å; K1114-A1116 VanDerWaalsContact C-N 3.25Å; K1114-A1116 PolarHBondContact O-N 3.13Å; A1116-Y1120 WeakPolarHBondContact O-CB 3.35Å; A1116-Y1120 PolarHBondContact O-N 3.1Å; A1116-M1134 HydrophobicContact CB-CE 3.6Å; A1116-M1134 HydrophobicContact CB-SD 3.85Å
1117	V	98.1	Very high	97	Very high	39 Å²	39	39.1 Å²	39.1	24%	0.236	20%	0.204	C	C	.	.	H	α-helix	trans	-67.2	-41.2	173.2	174.1	0	0	0	0	111.3	Y1113 K1114 Y1120 E1121 M1134	Y1113-V1117 HydrophobicContact CD1-CG2 4.24Å; Y1113-V1117 HydrophobicContact CE1-CG2 3.83Å; Y1113-V1117 HydrophobicContact CE2-CG2 4.28Å; Y1113-V1117 WeakPolarHBondContact O-CG2 3.24Å; Y1113-V1117 PolarHBondContact O-N 3.34Å; K1114-V1117 PolarHBondContact O-N 2.85Å; V1117-Y1120 WeakPolarHBondContact O-CB 3.35Å; V1117-Y1120 PolarHBondContact O-N 2.79Å; V1117-E1121 PolarHBondContact O-N 3.45Å; V1117-M1134 HydrophobicContact CG2-CE 3.85Å
1118	E	97.7	Very high	96.9	Very high	84 Å²	84	40 Å²	40	39%	0.393	21%	0.209	S	C	.	.	H	α-helix	trans	-64.2	-42.8	177.2	-74.6	171.7	152.4	0	0	112.1	K1114 W1122	K1114-E1118 WeakPolarHBondContact CE-OE1 3.46Å; K1114-E1118 HydrophobicContact CG-CG 4.45Å; K1114-E1118 WeakPolarHBondContact CG-OE2 3.28Å; K1114-E1118 IonicContact NZ-OE1 2.68Å; K1114-E1118 PolarHBondContact NZ-OE1 2.9Å; K1114-E1118 IonicContact NZ-OE2 2.65Å; K1114-E1118 PolarHBondContact NZ-OE2 3.35Å; K1114-E1118 WeakPolarHBondContact O-CB 3.45Å; K1114-E1118 WeakPolarHBondContact O-CG 3.42Å; K1114-E1118 PolarHBondContact O-N 2.92Å; E1118-W1122 WeakPolarHBondContact O-CB 3.49Å; E1118-W1122 PolarHBondContact O-N 2.92Å
1119	R	98.5	Very high	97	Very high	7 Å²	7	41 Å²	41	3%	0.026	21%	0.211	C	C	.	.	H	α-helix	trans	-65.9	-38.3	172.4	-177.8	49.6	48.3	81.7	2	112.2	Q1011 N1015 L1115 W1122 N1123	Q1011-R1119 VanDerWaalsContact OE1-CZ 3.27Å; N1015-R1119 HydrophobicContact CB-CB 4.27Å; N1015-R1119 VanDerWaalsContact OD1-CZ 3.31Å; N1015-R1119 PolarHBondContact OD1-NH1 3.43Å; L1115-R1119 WeakPolarHBondContact O-CB 3.33Å; L1115-R1119 PolarHBondContact O-N 3.32Å; R1119-W1122 PolarHBondContact O-N 2.85Å; R1119-N1123 WeakPolarHBondContact CD-OD1 3.37Å; R1119-N1123 VanDerWaalsContact O-CB 3.25Å; R1119-N1123 WeakPolarHBondContact O-CB 3.31Å; R1119-N1123 PolarHBondContact O-N 3.36Å; R1119-N1123 PolarHBondContact O-OD1 2.93Å
1120	Y	98.3	Very high	97.1	Very high	12 Å²	12	39.6 Å²	39.6	5%	0.047	20%	0.203	C	C	.	.	H	α-helix	trans	-62.7	-45.9	178.1	168.6	-97.4	0	0	0	112.7	A1116 V1117 N1123 K1124 M1134 V1135 E1201	A1116-Y1120 WeakPolarHBondContact O-CB 3.35Å; A1116-Y1120 PolarHBondContact O-N 3.1Å; V1117-Y1120 WeakPolarHBondContact O-CB 3.35Å; V1117-Y1120 PolarHBondContact O-N 2.79Å; Y1120-N1123 PolarHBondContact O-N 2.94Å; Y1120-K1124 HydrophobicContact CE1-CD 4.5Å; Y1120-K1124 VanDerWaalsContact CZ-NZ 3.3Å; Y1120-K1124 WeakPolarHBondContact O-CG 3.26Å; Y1120-K1124 PolarHBondContact O-N 3.2Å; Y1120-K1124 WeakPolarHBondContact OH-CE 3.46Å; Y1120-K1124 PolarHBondContact OH-NZ 2.71Å; Y1120-K1124 VanDerWaalsContact OH-NZ 3.15Å; Y1120-M1134 HydrophobicContact CD1-CB 3.99Å; Y1120-M1134 HydrophobicContact CD1-CG 4.41Å; Y1120-M1134 HydrophobicContact CD2-CB 3.67Å; Y1120-M1134 HydrophobicContact CD2-CG 3.7Å; Y1120-M1134 HydrophobicContact CE1-CB 4.19Å; Y1120-M1134 HydrophobicContact CE2-CB 3.91Å; Y1120-M1134 HydrophobicContact CE2-CG 4.41Å; Y1120-M1134 HydrophobicContact CG-CB 3.72Å; Y1120-M1134 HydrophobicContact CG-CG 3.72Å; Y1120-V1135 HydrophobicContact CE1-CG2 4.24Å; Y1120-V1135 WeakPolarHBondContact OH-CG2 3.4Å; Y1120-E1201 HydrophobicContact CE2-CB 4.25Å; Y1120-E1201 WeakPolarHBondContact CE2-OE2 3.45Å; Y1120-E1201 PolarHBondContact OH-OE2 2.96Å
1121	E	96.8	Very high	97.1	Very high	54 Å²	54	40.8 Å²	40.8	25%	0.252	21%	0.21	S	C	.	.	H	α-helix	trans	-71.3	-33.1	175.3	-60.4	-76.7	88.5	0	0	111.7	P785 V1117 K1124 L1125 K1162	P785-E1121 HydrophobicContact CG-CB 4.14Å; V1117-E1121 PolarHBondContact O-N 3.45Å; E1121-K1124 WeakPolarHBondContact O-CB 3.49Å; E1121-K1124 PolarHBondContact O-N 3.44Å; E1121-K1124 WeakPolarHBondContact OE1-CD 3.26Å; E1121-K1124 WeakPolarHBondContact OE1-CE 3.14Å; E1121-K1124 IonicContact OE1-NZ 3.34Å; E1121-K1124 PolarHBondContact OE1-NZ 3.39Å; E1121-L1125 PolarHBondContact O-N 3.06Å; E1121-L1125 VanDerWaalsContact O-N 3.13Å; E1121-K1162 IonicContact OE2-NZ 2.83Å; E1121-K1162 PolarHBondContact OE2-NZ 2.89Å; E1121-K1162 VanDerWaalsContact OE2-NZ 3.07Å
1122	W	97.2	Very high	97.2	Very high	17 Å²	17	38.7 Å²	38.7	6%	0.064	20%	0.196	C	C	.	.	H	α-helix	trans	-64	-42.8	172.9	177.2	-113.7	0	0	0	112.4	P785 P787 W1038 E1118 R1119 K1124 L1125 K1126	P785-W1122 HydrophobicContact CB-CB 4.14Å; P785-W1122 HydrophobicContact CB-CE3 4.23Å; P785-W1122 HydrophobicContact CG-CB 4.35Å; P785-W1122 HydrophobicContact CG-CE3 4.36Å; P785-W1122 WeakPolarHBondContact O-CZ3 3.46Å; P787-W1122 HydrophobicContact CG-CH2 3.6Å; P787-W1122 HydrophobicContact CG-CZ2 3.81Å; P787-W1122 HydrophobicContact CG-CZ3 4.38Å; W1038-W1122 HydrophobicContact CH2-CD2 4.08Å; W1038-W1122 AromaticContact CH2-CE2 3.68Å; W1038-W1122 HydrophobicContact CH2-CG 4.24Å; W1038-W1122 HydrophobicContact CH2-CZ2 4.07Å; W1038-W1122 AromaticContact CH2-NE1 3.62Å; W1038-W1122 HydrophobicContact CZ3-CZ2 4.2Å; W1038-W1122 AromaticContact CZ3-NE1 3.78Å; E1118-W1122 WeakPolarHBondContact O-CB 3.49Å; E1118-W1122 PolarHBondContact O-N 2.92Å; R1119-W1122 PolarHBondContact O-N 2.85Å; W1122-K1124 VanDerWaalsContact C-N 3.33Å; W1122-K1124 PolarHBondContact O-N 3.3Å; W1122-L1125 HydrophobicContact CE3-CD2 4.12Å; W1122-L1125 HydrophobicContact CZ3-CD2 4.07Å; W1122-L1125 PolarHBondContact O-N 3.31Å; W1122-L1125 VanDerWaalsContact O-N 3.12Å; W1122-K1126 HydrophobicContact CD2-CG 4.2Å; W1122-K1126 HydrophobicContact CH2-CD 4.44Å; W1122-K1126 HydrophobicContact CH2-CG 4.37Å; W1122-K1126 HydrophobicContact CZ2-CD 4.25Å; W1122-K1126 HydrophobicContact CZ2-CG 3.98Å; W1122-K1126 PolarHBondContact O-N 3.29Å
1123	N	97.5	Very high	97.2	Very high	7 Å²	7	38.6 Å²	38.6	4%	0.037	20%	0.196	C	C	.	.	H	α-helix	trans	-59	-43.3	175.6	-82.2	6.9	0	0	0	111	R1119 Y1120 L1125 K1126 S1127 V1128 K1129 S1130	R1119-N1123 WeakPolarHBondContact CD-OD1 3.37Å; R1119-N1123 VanDerWaalsContact O-CB 3.25Å; R1119-N1123 WeakPolarHBondContact O-CB 3.31Å; R1119-N1123 PolarHBondContact O-N 3.36Å; R1119-N1123 PolarHBondContact O-OD1 2.93Å; Y1120-N1123 PolarHBondContact O-N 2.94Å; N1123-L1125 PolarHBondContact O-N 2.81Å; N1123-K1126 CarbonylContact O-C 3.54Å; N1123-K1126 PolarHBondContact O-N 3.44Å; N1123-S1127 PolarHBondContact O-N 2.96Å; N1123-V1128 CarbonylContact C-O 3.57Å; N1123-V1128 HydrophobicContact CB-CB 4.34Å; N1123-V1128 WeakPolarHBondContact CB-O 3.37Å; N1123-V1128 PolarHBondContact O-N 3.21Å; N1123-K1129 PolarHBondContact ND2-O 3.33Å; N1123-S1130 WeakPolarHBondContact CB-OG 3.48Å; N1123-S1130 PolarHBondContact ND2-OG 2.97Å
1124	K	93.8	Very high	97.2	Very high	76 Å²	76	38.6 Å²	38.6	33%	0.33	20%	0.196	S	C	.	.	H	α-helix	trans	-57.2	-46.6	171.6	-68.5	178.1	-175.2	172	0	112.4	Y1120 E1121 W1122 K1126 S1127 V1200	Y1120-K1124 HydrophobicContact CE1-CD 4.5Å; Y1120-K1124 VanDerWaalsContact CZ-NZ 3.3Å; Y1120-K1124 WeakPolarHBondContact O-CG 3.26Å; Y1120-K1124 PolarHBondContact O-N 3.2Å; Y1120-K1124 WeakPolarHBondContact OH-CE 3.46Å; Y1120-K1124 PolarHBondContact OH-NZ 2.71Å; Y1120-K1124 VanDerWaalsContact OH-NZ 3.15Å; E1121-K1124 WeakPolarHBondContact O-CB 3.49Å; E1121-K1124 PolarHBondContact O-N 3.44Å; E1121-K1124 WeakPolarHBondContact OE1-CD 3.26Å; E1121-K1124 WeakPolarHBondContact OE1-CE 3.14Å; E1121-K1124 IonicContact OE1-NZ 3.34Å; E1121-K1124 PolarHBondContact OE1-NZ 3.39Å; W1122-K1124 VanDerWaalsContact C-N 3.33Å; W1122-K1124 PolarHBondContact O-N 3.3Å; K1124-K1126 PolarHBondContact O-N 2.96Å; K1124-S1127 PolarHBondContact O-N 3.44Å; K1124-V1200 HydrophobicContact CD-CG2 4.01Å; K1124-V1200 HydrophobicContact CG-CG2 3.97Å
1125	L	95	Very high	97.2	Very high	100 Å²	100	35 Å²	35	52%	0.524	18%	0.181	S	C	.	.	H	α-helix	trans	-65.8	-25.7	179.9	-176.1	60.5	0	0	0	112.9	P785 E1121 W1122 N1123	P785-L1125 HydrophobicContact CG-CB 4.36Å; P785-L1125 HydrophobicContact CG-CD2 4.05Å; P785-L1125 WeakPolarHBondContact O-CD2 3.44Å; E1121-L1125 PolarHBondContact O-N 3.06Å; E1121-L1125 VanDerWaalsContact O-N 3.13Å; W1122-L1125 HydrophobicContact CE3-CD2 4.12Å; W1122-L1125 HydrophobicContact CZ3-CD2 4.07Å; W1122-L1125 PolarHBondContact O-N 3.31Å; W1122-L1125 VanDerWaalsContact O-N 3.12Å; N1123-L1125 PolarHBondContact O-N 2.81Å
1126	K	94.8	Very high	97.1	Very high	80 Å²	80	34.8 Å²	34.8	35%	0.348	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.3	5.2	177.5	-71.5	-69.9	-170.8	164.9	0	114.3	E1046 L1053 W1122 N1123 K1124 V1128	E1046-K1126 IonicContact OE1-NZ 3.21Å; L1053-K1126 HydrophobicContact CD1-CB 4.22Å; L1053-K1126 HydrophobicContact CD1-CG 4.41Å; W1122-K1126 HydrophobicContact CD2-CG 4.2Å; W1122-K1126 HydrophobicContact CH2-CD 4.44Å; W1122-K1126 HydrophobicContact CH2-CG 4.37Å; W1122-K1126 HydrophobicContact CZ2-CD 4.25Å; W1122-K1126 HydrophobicContact CZ2-CG 3.98Å; W1122-K1126 PolarHBondContact O-N 3.29Å; N1123-K1126 CarbonylContact O-C 3.54Å; N1123-K1126 PolarHBondContact O-N 3.44Å; K1124-K1126 PolarHBondContact O-N 2.96Å; K1126-V1128 VanDerWaalsContact C-N 3.25Å; K1126-V1128 HydrophobicContact CB-CG2 4.22Å; K1126-V1128 PolarHBondContact O-N 3Å
1127	S	94.7	Very high	97.1	Very high	94 Å²	94	34.8 Å²	34.8	66%	0.657	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.5	39.4	-174.5	-56.2	0	0	0	0	113.7	N1123 K1124	N1123-S1127 PolarHBondContact O-N 2.96Å; K1124-S1127 PolarHBondContact O-N 3.44Å
1128	V	95.2	Very high	97.1	Very high	25 Å²	25	32.9 Å²	32.9	15%	0.152	17%	0.168	C	C	.	.			trans	-107.4	135	175.4	175.4	0	0	0	0	108.6	L1053 M1054 N1123 K1126	L1053-V1128 HydrophobicContact CD1-CB 4.41Å; L1053-V1128 HydrophobicContact CD1-CG2 3.97Å; M1054-V1128 HydrophobicContact CG-CG2 4.03Å; M1054-V1128 HydrophobicContact SD-CG1 3.71Å; M1054-V1128 HydrophobicContact SD-CG2 4.08Å; N1123-V1128 CarbonylContact C-O 3.57Å; N1123-V1128 HydrophobicContact CB-CB 4.34Å; N1123-V1128 WeakPolarHBondContact CB-O 3.37Å; N1123-V1128 PolarHBondContact O-N 3.21Å; K1126-V1128 VanDerWaalsContact C-N 3.25Å; K1126-V1128 HydrophobicContact CB-CG2 4.22Å; K1126-V1128 PolarHBondContact O-N 3Å
1129	K	97.5	Very high	97.1	Very high	78 Å²	78	29 Å²	29	34%	0.339	15%	0.149	S	C	.	.			trans	-58.5	141.8	173.4	-167.2	178	-152.1	143.9	0	111.2	N1123 P1131 Y1194 E1199	N1123-K1129 PolarHBondContact ND2-O 3.33Å; K1129-P1131 WeakPolarHBondContact O-CD 3.48Å; K1129-Y1194 HydrophobicContact CG-CD1 4.23Å; K1129-Y1194 HydrophobicContact CG-CE1 4.15Å; K1129-E1199 HydrophobicContact CB-CB 3.8Å; K1129-E1199 HydrophobicContact CB-CG 4.49Å; K1129-E1199 VanDerWaalsContact CD-OE1 3.31Å; K1129-E1199 WeakPolarHBondContact CD-OE1 3.4Å; K1129-E1199 HydrophobicContact CG-CB 4.04Å; K1129-E1199 IonicContact NZ-OE1 3.81Å; K1129-E1199 PolarHBondContact NZ-OE1 3.3Å
1130	S	98.3	Very high	97.1	Very high	7 Å²	7	29.4 Å²	29.4	5%	0.049	15%	0.152	C	C	.	.			trans	-99.1	108.2	162.6	-72.7	0	0	0	0	109.6	N1014 N1123 V1132 Y1194	N1014-S1130 WeakPolarHBondContact ND2-CB 3.49Å; N1014-S1130 PolarHBondContact ND2-OG 2.84Å; N1014-S1130 WeakPolarHBondContact OD1-CA 3.5Å; N1014-S1130 WeakPolarHBondContact OD1-CB 3.32Å; N1123-S1130 WeakPolarHBondContact CB-OG 3.48Å; N1123-S1130 PolarHBondContact ND2-OG 2.97Å; S1130-V1132 PolarHBondContact O-N 3.49Å; S1130-Y1194 WeakPolarHBondContact O-CE1 3.47Å; S1130-Y1194 PolarHBondContact O-OH 2.88Å
1131	P	97.4	Very high	97	Very high	34 Å²	34	28.9 Å²	28.9	22%	0.221	15%	0.15	C	C	.	.	S	Bend	trans	-61	-25.6	178.1	-25.2	36.7	0	0	0	113.2	I990 M993 N1013 N1014 K1129 P1133 Y1194	I990-P1131 VanDerWaalsContact CD1-O 3.24Å; I990-P1131 WeakPolarHBondContact CD1-O 3.37Å; I990-P1131 HydrophobicContact CG2-CB 4.12Å; M993-P1131 HydrophobicContact SD-CB 4.15Å; N1013-P1131 HydrophobicContact CB-CG 4.31Å; N1014-P1131 WeakPolarHBondContact OD1-CD 3.46Å; K1129-P1131 WeakPolarHBondContact O-CD 3.48Å; P1131-P1133 WeakPolarHBondContact O-CD 3.14Å; P1131-Y1194 PolarHBondContact O-OH 3.49Å
1132	V	98.5	Very high	97	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.142	C	C	.	.	S	Bend	trans	-91.6	116.3	169.8	-170.8	0	0	0	0	109.6	L983 V986 I990 M993 N1014 F1016 S1130 M1134 L1137	L983-V1132 HydrophobicContact CD2-CG1 4.2Å; L983-V1132 HydrophobicContact CD2-CG2 3.85Å; V986-V1132 HydrophobicContact CG2-CG1 4.46Å; I990-V1132 HydrophobicContact CD1-CG2 4.2Å; M993-V1132 HydrophobicContact CE-CG2 3.51Å; M993-V1132 HydrophobicContact SD-CG2 3.64Å; N1014-V1132 HydrophobicContact CB-CB 4.02Å; N1014-V1132 HydrophobicContact CB-CG2 4.04Å; N1014-V1132 PolarHBondContact OD1-N 3.42Å; F1016-V1132 HydrophobicContact CD2-CG2 3.95Å; F1016-V1132 HydrophobicContact CE2-CB 3.98Å; F1016-V1132 HydrophobicContact CE2-CG1 3.84Å; F1016-V1132 HydrophobicContact CE2-CG2 3.69Å; F1016-V1132 HydrophobicContact CZ-CG1 3.9Å; F1016-V1132 HydrophobicContact CZ-CG2 4.33Å; S1130-V1132 PolarHBondContact O-N 3.49Å; V1132-M1134 HydrophobicContact CB-SD 4.28Å; V1132-M1134 HydrophobicContact CG1-SD 3.7Å; V1132-M1134 PolarHBondContact O-N 2.73Å; V1132-L1137 HydrophobicContact CG1-CD2 3.7Å
1133	P	98	Very high	96.9	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.154	C	C	.	.			trans	-78.2	86.4	177.4	32.1	-34.3	0	0	0	109.4	V986 P1131 V1135 H1136 L1137 A1192 E1201	V986-P1133 HydrophobicContact CG1-CG 4.46Å; P1131-P1133 WeakPolarHBondContact O-CD 3.14Å; P1133-V1135 PolarHBondContact O-N 3.07Å; P1133-H1136 HydrophobicContact CB-CB 4.03Å; P1133-H1136 HydrophobicContact CG-CB 4.22Å; P1133-H1136 PolarHBondContact O-N 2.82Å; P1133-L1137 VanDerWaalsContact O-CB 3.3Å; P1133-L1137 WeakPolarHBondContact O-CB 3.3Å; P1133-L1137 PolarHBondContact O-N 3.32Å; P1133-A1192 HydrophobicContact CB-CB 3.31Å; P1133-A1192 HydrophobicContact CG-CB 3.48Å; P1133-A1192 VanDerWaalsContact CG-CB 3.48Å; P1133-E1201 HydrophobicContact CB-CG 4.09Å; P1133-E1201 WeakPolarHBondContact CB-OE1 3.38Å
1134	M	98.4	Very high	96.7	Very high	3 Å²	3	34 Å²	34	2%	0.015	18%	0.176	C	C	.	.	H	α-helix	trans	-63	-27.2	-169.2	-71.4	-58.3	-61.3	0	0	113.6	F1016 Y1113 A1116 V1117 Y1120 V1132 L1137 S1138 E1201	F1016-M1134 HydrophobicContact CE2-SD 4.04Å; F1016-M1134 HydrophobicContact CZ-SD 4.15Å; Y1113-M1134 HydrophobicContact CD2-CE 4.14Å; Y1113-M1134 HydrophobicContact CE2-CE 4.03Å; A1116-M1134 HydrophobicContact CB-CE 3.6Å; A1116-M1134 HydrophobicContact CB-SD 3.85Å; V1117-M1134 HydrophobicContact CG2-CE 3.85Å; Y1120-M1134 HydrophobicContact CD1-CB 3.99Å; Y1120-M1134 HydrophobicContact CD1-CG 4.41Å; Y1120-M1134 HydrophobicContact CD2-CB 3.67Å; Y1120-M1134 HydrophobicContact CD2-CG 3.7Å; Y1120-M1134 HydrophobicContact CE1-CB 4.19Å; Y1120-M1134 HydrophobicContact CE2-CB 3.91Å; Y1120-M1134 HydrophobicContact CE2-CG 4.41Å; Y1120-M1134 HydrophobicContact CG-CB 3.72Å; Y1120-M1134 HydrophobicContact CG-CG 3.72Å; V1132-M1134 HydrophobicContact CB-SD 4.28Å; V1132-M1134 HydrophobicContact CG1-SD 3.7Å; V1132-M1134 PolarHBondContact O-N 2.73Å; M1134-L1137 HydrophobicContact CE-CD2 4.49Å; M1134-L1137 HydrophobicContact SD-CD2 4.06Å; M1134-S1138 VanDerWaalsContact O-CB 3.32Å; M1134-S1138 WeakPolarHBondContact O-CB 3.4Å; M1134-S1138 PolarHBondContact O-N 2.97Å; M1134-S1138 PolarHBondContact O-OG 3.17Å; M1134-E1201 PolarHBondContact N-OE2 3.46Å
1135	V	97.9	Very high	96.7	Very high	7 Å²	7	31.3 Å²	31.3	4%	0.042	17%	0.165	C	C	.	.	H	α-helix	trans	-74.5	-50.9	176	173.3	0	0	0	0	110.2	Y1120 P1133 L1137 S1138 W1139 I1163 E1201 F1203	Y1120-V1135 HydrophobicContact CE1-CG2 4.24Å; Y1120-V1135 WeakPolarHBondContact OH-CG2 3.4Å; P1133-V1135 PolarHBondContact O-N 3.07Å; V1135-L1137 VanDerWaalsContact C-N 3.32Å; V1135-L1137 PolarHBondContact O-N 3.34Å; V1135-S1138 PolarHBondContact O-N 3.27Å; V1135-S1138 VanDerWaalsContact O-N 3.15Å; V1135-W1139 VanDerWaalsContact O-CD1 3.28Å; V1135-W1139 PolarHBondContact O-N 2.98Å; V1135-W1139 VanDerWaalsContact O-N 3.1Å; V1135-I1163 HydrophobicContact CB-CD1 4.44Å; V1135-I1163 HydrophobicContact CG1-CB 4.37Å; V1135-I1163 HydrophobicContact CG1-CD1 3.94Å; V1135-I1163 HydrophobicContact CG1-CG1 3.83Å; V1135-I1163 HydrophobicContact CG1-CG2 3.77Å; V1135-I1163 HydrophobicContact CG2-CD1 3.56Å; V1135-I1163 HydrophobicContact CG2-CG1 3.97Å; V1135-E1201 WeakPolarHBondContact CB-OE1 3.48Å; V1135-E1201 PolarHBondContact N-OE1 3.28Å; V1135-E1201 PolarHBondContact N-OE2 2.88Å; V1135-E1201 VanDerWaalsContact N-OE2 3.1Å; V1135-F1203 HydrophobicContact CB-CB 4.4Å; V1135-F1203 HydrophobicContact CB-CG 4.45Å; V1135-F1203 HydrophobicContact CG1-CB 3.8Å; V1135-F1203 HydrophobicContact CG1-CD1 3.79Å; V1135-F1203 HydrophobicContact CG1-CD2 3.76Å; V1135-F1203 HydrophobicContact CG1-CE1 4.31Å; V1135-F1203 HydrophobicContact CG1-CE2 4.28Å; V1135-F1203 HydrophobicContact CG1-CG 3.48Å; V1135-F1203 VanDerWaalsContact CG1-CG 3.48Å
1136	H	97.8	Very high	96.7	Very high	6 Å²	6	35.5 Å²	35.5	3%	0.028	18%	0.179	C	C	.	.	H	α-helix	trans	-55.2	-47.3	175.1	-178.2	60.5	0	0	0	112	V986 P1133 S1138 W1139 N1140 R1186 A1192 E1201 F1203 Y1242	V986-H1136 PolarHBondContact O-CD2 2.91Å; V986-H1136 PolarHBondContact O-NE2 3.02Å; P1133-H1136 HydrophobicContact CB-CB 4.03Å; P1133-H1136 HydrophobicContact CG-CB 4.22Å; P1133-H1136 PolarHBondContact O-N 2.82Å; H1136-S1138 PolarHBondContact O-N 2.84Å; H1136-W1139 PolarHBondContact O-N 3.43Å; H1136-N1140 PolarHBondContact CE1-ND2 3.16Å; H1136-N1140 PolarHBondContact NE2-ND2 2.66Å; H1136-N1140 PolarHBondContact O-N 2.97Å; H1136-R1186 PolarHBondContact CE1-NH1 2.96Å; H1136-A1192 HydrophobicContact CB-CB 4.13Å; H1136-E1201 WeakPolarHBondContact CB-OE1 3.41Å; H1136-E1201 PolarHBondContact N-OE1 3.24Å; H1136-F1203 HydrophobicContact CB-CD2 4.36Å; H1136-Y1242 PolarHBondContact CE1-OH 3.32Å; H1136-Y1242 VanDerWaalsContact CE1-OH 3.26Å; H1136-Y1242 PolarHBondContact ND1-OH 3.4Å
1137	L	98.2	Very high	96.6	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-58.7	-44.9	176.1	172.8	56.8	0	0	0	111.7	L982 H985 V986 F1016 V1132 P1133 M1134 V1135 W1139 N1140 M1141	L982-L1137 HydrophobicContact CB-CD2 4.44Å; L982-L1137 WeakPolarHBondContact O-CD1 3.17Å; H985-L1137 HydrophobicContact CB-CD1 3.92Å; V986-L1137 HydrophobicContact CG2-CD1 4.07Å; V986-L1137 HydrophobicContact CG2-CD2 4.31Å; F1016-L1137 HydrophobicContact CZ-CD2 4.15Å; V1132-L1137 HydrophobicContact CG1-CD2 3.7Å; P1133-L1137 VanDerWaalsContact O-CB 3.3Å; P1133-L1137 WeakPolarHBondContact O-CB 3.3Å; P1133-L1137 PolarHBondContact O-N 3.32Å; M1134-L1137 HydrophobicContact CE-CD2 4.49Å; M1134-L1137 HydrophobicContact SD-CD2 4.06Å; V1135-L1137 VanDerWaalsContact C-N 3.32Å; V1135-L1137 PolarHBondContact O-N 3.34Å; L1137-W1139 VanDerWaalsContact C-N 3.34Å; L1137-W1139 PolarHBondContact O-N 3.03Å; L1137-N1140 PolarHBondContact O-N 2.78Å; L1137-N1140 VanDerWaalsContact O-N 3.16Å; L1137-M1141 HydrophobicContact CD1-CG 3.88Å; L1137-M1141 HydrophobicContact CD1-SD 3.95Å; L1137-M1141 HydrophobicContact CD2-SD 4.47Å; L1137-M1141 HydrophobicContact CG-CG 4.3Å; L1137-M1141 HydrophobicContact CG-SD 3.79Å; L1137-M1141 WeakPolarHBondContact O-CB 3.35Å; L1137-M1141 VanDerWaalsContact O-CG 3.25Å; L1137-M1141 WeakPolarHBondContact O-CG 3.35Å; L1137-M1141 PolarHBondContact O-N 2.76Å
1138	S	98.4	Very high	96.5	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-62.1	-39.7	179.4	-60.9	0	0	0	0	112.5	Y1113 M1134 V1135 H1136 M1141 A1142	Y1113-S1138 WeakPolarHBondContact CE2-OG 3.48Å; Y1113-S1138 PolarHBondContact OH-OG 3.13Å; M1134-S1138 VanDerWaalsContact O-CB 3.32Å; M1134-S1138 WeakPolarHBondContact O-CB 3.4Å; M1134-S1138 PolarHBondContact O-N 2.97Å; M1134-S1138 PolarHBondContact O-OG 3.17Å; V1135-S1138 PolarHBondContact O-N 3.27Å; V1135-S1138 VanDerWaalsContact O-N 3.15Å; H1136-S1138 PolarHBondContact O-N 2.84Å; S1138-M1141 PolarHBondContact O-N 2.93Å; S1138-A1142 WeakPolarHBondContact O-CB 3.4Å; S1138-A1142 PolarHBondContact O-N 3.18Å
1139	W	97.9	Very high	96.3	Very high	1 Å²	1	32.2 Å²	32.2	0%	0.004	16%	0.163	C	C	.	.	H	α-helix	trans	-67.2	-35.6	174.3	-78.8	102.8	0	0	0	112.9	V1135 H1136 L1137 A1142 R1143 L1160 L1164 F1203 L1247 V1250	V1135-W1139 VanDerWaalsContact O-CD1 3.28Å; V1135-W1139 PolarHBondContact O-N 2.98Å; V1135-W1139 VanDerWaalsContact O-N 3.1Å; H1136-W1139 PolarHBondContact O-N 3.43Å; L1137-W1139 VanDerWaalsContact C-N 3.34Å; L1137-W1139 PolarHBondContact O-N 3.03Å; W1139-A1142 PolarHBondContact O-N 3.04Å; W1139-R1143 WeakPolarHBondContact O-CG 3.39Å; W1139-R1143 PolarHBondContact O-N 2.82Å; W1139-L1160 HydrophobicContact CB-CD2 4.49Å; W1139-L1160 HydrophobicContact CD2-CD2 3.5Å; W1139-L1160 HydrophobicContact CE3-CD2 3.72Å; W1139-L1160 HydrophobicContact CG-CD2 3.87Å; W1139-L1160 HydrophobicContact CH2-CB 4.38Å; W1139-L1160 HydrophobicContact CH2-CD2 4.34Å; W1139-L1160 HydrophobicContact CZ2-CB 4.33Å; W1139-L1160 HydrophobicContact CZ2-CD2 4.17Å; W1139-L1160 HydrophobicContact CZ3-CD2 4.12Å; W1139-L1164 HydrophobicContact CH2-CB 4.43Å; W1139-L1164 HydrophobicContact CZ2-CB 4.32Å; W1139-F1203 HydrophobicContact CB-CE2 4.45Å; W1139-F1203 HydrophobicContact CB-CZ 4.31Å; W1139-F1203 AromaticContact CD1-CE1 3.65Å; W1139-F1203 AromaticContact CD1-CE2 3.64Å; W1139-F1203 AromaticContact CD1-CZ 3.17Å; W1139-F1203 HydrophobicContact CD2-CZ 4.25Å; W1139-F1203 HydrophobicContact CG-CE1 4.41Å; W1139-F1203 HydrophobicContact CG-CE2 4.19Å; W1139-F1203 AromaticContact CG-CZ 3.67Å; W1139-F1203 HydrophobicContact CG-CZ 3.67Å; W1139-F1203 AromaticContact NE1-CE1 3.48Å; W1139-F1203 AromaticContact NE1-CZ 3.51Å; W1139-L1247 HydrophobicContact CD2-CD2 4.01Å; W1139-L1247 HydrophobicContact CE3-CD2 3.76Å; W1139-L1247 HydrophobicContact CH2-CB 3.75Å; W1139-L1247 HydrophobicContact CH2-CD2 4.17Å; W1139-L1247 HydrophobicContact CH2-CG 4.37Å; W1139-L1247 HydrophobicContact CZ2-CB 4.39Å; W1139-L1247 HydrophobicContact CZ2-CD1 4.39Å; W1139-L1247 HydrophobicContact CZ2-CD2 4.39Å; W1139-L1247 HydrophobicContact CZ3-CB 3.93Å; W1139-L1247 HydrophobicContact CZ3-CD2 3.85Å; W1139-L1247 HydrophobicContact CZ3-CG 4.42Å; W1139-L1247 VanDerWaalsContact CZ3-O 3.3Å; W1139-L1247 WeakPolarHBondContact CZ3-O 3.42Å; W1139-V1250 HydrophobicContact CE3-CB 4.33Å; W1139-V1250 HydrophobicContact CE3-CG1 3.8Å; W1139-V1250 HydrophobicContact CZ3-CB 4.14Å; W1139-V1250 HydrophobicContact CZ3-CG1 3.97Å
1140	N	96.8	Very high	96.1	Very high	17 Å²	17	31.6 Å²	31.6	9%	0.091	17%	0.167	C	C	.	.	H	α-helix	trans	-73.2	-37.8	174.9	-66.4	-8.9	0	0	0	112.3	H985 H1136 L1137 A1142 R1143 N1144	H985-N1140 WeakPolarHBondContact O-CB 3.5Å; H985-N1140 PolarHBondContact O-ND2 3.12Å; H1136-N1140 PolarHBondContact CE1-ND2 3.16Å; H1136-N1140 PolarHBondContact NE2-ND2 2.66Å; H1136-N1140 PolarHBondContact O-N 2.97Å; L1137-N1140 PolarHBondContact O-N 2.78Å; L1137-N1140 VanDerWaalsContact O-N 3.16Å; N1140-A1142 VanDerWaalsContact C-N 3.29Å; N1140-A1142 PolarHBondContact O-N 3.39Å; N1140-R1143 PolarHBondContact O-N 2.87Å; N1140-R1143 PolarHBondContact OD1-NH1 2.86Å; N1140-R1143 VanDerWaalsContact OD1-NH1 3.09Å; N1140-N1144 VanDerWaalsContact O-CB 3.23Å; N1140-N1144 WeakPolarHBondContact O-CB 3.3Å; N1140-N1144 PolarHBondContact O-N 3.2Å; N1140-N1144 PolarHBondContact O-OD1 2.88Å
1141	M	96.8	Very high	95.9	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-58.1	-43.3	171.2	-71.2	167.5	57.1	0	0	110.9	L982 H985 Y1113 L1137 S1138 R1143 N1144 I1145 I1156	L982-M1141 HydrophobicContact CD1-CE 4.19Å; L982-M1141 HydrophobicContact CD1-SD 4.22Å; L982-M1141 HydrophobicContact CD2-CE 3.55Å; L982-M1141 HydrophobicContact CD2-CG 4.21Å; L982-M1141 HydrophobicContact CD2-SD 3.76Å; L982-M1141 HydrophobicContact CG-CE 4.49Å; L982-M1141 HydrophobicContact CG-SD 4.43Å; H985-M1141 HydrophobicContact CB-CG 4.44Å; Y1113-M1141 HydrophobicContact CD2-CE 3.86Å; Y1113-M1141 HydrophobicContact CD2-SD 4.28Å; Y1113-M1141 HydrophobicContact CE2-CE 4.02Å; Y1113-M1141 HydrophobicContact CE2-SD 4.16Å; L1137-M1141 HydrophobicContact CD1-CG 3.88Å; L1137-M1141 HydrophobicContact CD1-SD 3.95Å; L1137-M1141 HydrophobicContact CD2-SD 4.47Å; L1137-M1141 HydrophobicContact CG-CG 4.3Å; L1137-M1141 HydrophobicContact CG-SD 3.79Å; L1137-M1141 WeakPolarHBondContact O-CB 3.35Å; L1137-M1141 VanDerWaalsContact O-CG 3.25Å; L1137-M1141 WeakPolarHBondContact O-CG 3.35Å; L1137-M1141 PolarHBondContact O-N 2.76Å; S1138-M1141 PolarHBondContact O-N 2.93Å; M1141-R1143 VanDerWaalsContact C-N 3.31Å; M1141-R1143 PolarHBondContact O-N 2.92Å; M1141-N1144 PolarHBondContact O-N 3.1Å; M1141-I1145 HydrophobicContact CB-CD1 4.05Å; M1141-I1145 HydrophobicContact CG-CD1 3.87Å; M1141-I1145 WeakPolarHBondContact O-CB 3.33Å; M1141-I1145 PolarHBondContact O-N 3.37Å; M1141-I1156 HydrophobicContact CE-CD1 3.47Å; M1141-I1156 VanDerWaalsContact CE-CD1 3.47Å; M1141-I1156 HydrophobicContact CE-CG1 3.88Å
1142	A	96.9	Very high	95.8	Very high	11 Å²	11	35.6 Å²	35.6	9%	0.091	18%	0.18	C	C	.	.	H	α-helix	trans	-64	-32.6	178.6	0	0	0	0	0	113.8	S1138 W1139 N1140 L1160 V1250 F1254	S1138-A1142 WeakPolarHBondContact O-CB 3.4Å; S1138-A1142 PolarHBondContact O-N 3.18Å; W1139-A1142 PolarHBondContact O-N 3.04Å; N1140-A1142 VanDerWaalsContact C-N 3.29Å; N1140-A1142 PolarHBondContact O-N 3.39Å; A1142-L1160 HydrophobicContact CB-CD1 3.61Å; A1142-L1160 HydrophobicContact CB-CD2 4.07Å; A1142-L1160 HydrophobicContact CB-CG 4.45Å; A1142-V1250 HydrophobicContact CB-CG1 3.9Å; A1142-F1254 HydrophobicContact CB-CB 4.19Å; A1142-F1254 HydrophobicContact CB-CD1 4.45Å; A1142-F1254 HydrophobicContact CB-CD2 3.96Å; A1142-F1254 HydrophobicContact CB-CE2 4.48Å; A1142-F1254 HydrophobicContact CB-CG 3.94Å
1143	R	95.3	Very high	95.7	Very high	80 Å²	80	36.9 Å²	36.9	30%	0.302	19%	0.186	S	C	.	.	H	α-helix	trans	-75.5	-42	174	-69	164.5	-179	138.5	0.6	112.6	W1139 N1140 M1141 Y1242 V1250	W1139-R1143 WeakPolarHBondContact O-CG 3.39Å; W1139-R1143 PolarHBondContact O-N 2.82Å; N1140-R1143 PolarHBondContact O-N 2.87Å; N1140-R1143 PolarHBondContact OD1-NH1 2.86Å; N1140-R1143 VanDerWaalsContact OD1-NH1 3.09Å; M1141-R1143 VanDerWaalsContact C-N 3.31Å; M1141-R1143 PolarHBondContact O-N 2.92Å; R1143-Y1242 VanDerWaalsContact NH2-CD1 3.28Å; R1143-V1250 HydrophobicContact CG-CB 4.41Å; R1143-V1250 HydrophobicContact CG-CG1 3.73Å; R1143-V1250 HydrophobicContact CG-CG2 3.69Å
1144	N	94.4	Very high	95.4	Very high	96 Å²	96	41 Å²	41	51%	0.513	21%	0.205	S	C	.	.	H	α-helix	trans	-101.8	-19	-161.6	-61.2	-1.1	0	0	0	113.8	H985 N1140 M1141	H985-N1144 WeakPolarHBondContact CE1-CB 3.19Å; H985-N1144 PolarHBondContact CE1-ND2 2.8Å; H985-N1144 WeakPolarHBondContact ND1-CB 3.43Å; N1140-N1144 VanDerWaalsContact O-CB 3.23Å; N1140-N1144 WeakPolarHBondContact O-CB 3.3Å; N1140-N1144 PolarHBondContact O-N 3.2Å; N1140-N1144 PolarHBondContact O-OD1 2.88Å; M1141-N1144 PolarHBondContact O-N 3.1Å
1145	I	93.9	Very high	95.3	Very high	18 Å²	18	43.2 Å²	43.2	9%	0.092	22%	0.216	C	C	.	.			trans	-125.3	123.8	-167.2	-47.5	179.1	0	0	0	111.3	L982 L1108 M1141 V1147	L982-I1145 HydrophobicContact CD2-CD1 4.35Å; L1108-I1145 HydrophobicContact CD1-CD1 4.11Å; L1108-I1145 HydrophobicContact CD1-CG2 4.12Å; L1108-I1145 HydrophobicContact CD2-CG2 3.74Å; M1141-I1145 HydrophobicContact CB-CD1 4.05Å; M1141-I1145 HydrophobicContact CG-CD1 3.87Å; M1141-I1145 WeakPolarHBondContact O-CB 3.33Å; M1141-I1145 PolarHBondContact O-N 3.37Å; I1145-V1147 HydrophobicContact CB-CG2 4.45Å; I1145-V1147 HydrophobicContact CG2-CG2 4Å; I1145-V1147 PolarHBondContact O-N 3.36Å
1146	K	93.4	Very high	95.2	Very high	188 Å²	188	42.9 Å²	42.9	82%	0.817	21%	0.214	S	C	*	.			trans	-80.8	106.2	165.2	-69.2	-174	179.4	-177.1	0	109.1	A1257	K1146-A1257 HydrophobicContact CB-CB 3.98Å
1147	V	93.4	Very high	95	Very high	2 Å²	2	43.3 Å²	43.3	1%	0.012	22%	0.216	C	C	.	.			trans	-92	125.8	-178.4	-179.9	0	0	0	0	110.3	I1145 L1152 F1153 I1156 F1254 A1257	I1145-V1147 HydrophobicContact CB-CG2 4.45Å; I1145-V1147 HydrophobicContact CG2-CG2 4Å; I1145-V1147 PolarHBondContact O-N 3.36Å; V1147-L1152 HydrophobicContact CG1-CB 4.04Å; V1147-L1152 HydrophobicContact CG1-CD2 3.98Å; V1147-L1152 HydrophobicContact CG1-CG 3.9Å; V1147-F1153 HydrophobicContact CB-CB 4.45Å; V1147-F1153 HydrophobicContact CG1-CB 3.97Å; V1147-I1156 HydrophobicContact CG2-CD1 4Å; V1147-F1254 HydrophobicContact CB-CE2 4.4Å; V1147-F1254 HydrophobicContact CB-CZ 4.25Å; V1147-F1254 HydrophobicContact CG2-CE2 3.99Å; V1147-F1254 HydrophobicContact CG2-CZ 3.97Å; V1147-A1257 WeakPolarHBondContact O-CB 3.32Å; V1147-A1257 PolarHBondContact O-N 2.91Å
1148	S	92.6	Very high	94.7	Very high	72 Å²	72	47.7 Å²	47.7	50%	0.503	23%	0.233	S	C	.	.			trans	-109.5	-13.3	179.4	53.7	0	0	0	0	114.6	P1150 A1257	S1148-P1150 VanDerWaalsContact O-CD 3.3Å; S1148-P1150 WeakPolarHBondContact O-CD 3Å; S1148-A1257 WeakPolarHBondContact CA-O 3.13Å; S1148-A1257 WeakPolarHBondContact CB-O 3.24Å
1149	D	91.8	Very high	94.4	Very high	56 Å²	56	48.8 Å²	48.8	30%	0.299	24%	0.24	S	C	.	.			trans	-73.4	114.3	166.6	169.1	10.3	0	0	0	108.7	A1110 K1151 L1152 F1153	A1110-D1149 PolarHBondContact N-OD2 2.98Å; D1149-K1151 VanDerWaalsContact C-N 3.25Å; D1149-K1151 PolarHBondContact O-N 2.7Å; D1149-K1151 WeakPolarHBondContact OD1-CB 3.44Å; D1149-K1151 PolarHBondContact OD1-N 3.11Å; D1149-L1152 HydrophobicContact CB-CB 3.96Å; D1149-L1152 PolarHBondContact O-N 2.84Å; D1149-L1152 PolarHBondContact OD1-N 3.19Å; D1149-L1152 VanDerWaalsContact OD2-CB 3.26Å; D1149-L1152 WeakPolarHBondContact OD2-CB 3.44Å; D1149-L1152 PolarHBondContact OD2-N 3.43Å; D1149-F1153 WeakPolarHBondContact O-CB 3.21Å; D1149-F1153 PolarHBondContact O-N 3.37Å
1150	P	92.6	Very high	94.3	Very high	66 Å²	66	48.8 Å²	48.8	43%	0.429	24%	0.24	S	C	.	.	H	α-helix	trans	-58.6	-37.4	-179.1	-23.2	34.6	0	0	0	112.6	S1148 F1153 E1154 L1256	S1148-P1150 VanDerWaalsContact O-CD 3.3Å; S1148-P1150 WeakPolarHBondContact O-CD 3Å; P1150-F1153 PolarHBondContact O-N 3.44Å; P1150-E1154 WeakPolarHBondContact O-CB 3.49Å; P1150-E1154 VanDerWaalsContact O-CG 3.24Å; P1150-E1154 WeakPolarHBondContact O-CG 3.43Å; P1150-E1154 PolarHBondContact O-N 2.74Å; P1150-L1256 HydrophobicContact CB-CD1 4.44Å; P1150-L1256 HydrophobicContact CB-CD2 4.35Å; P1150-L1256 HydrophobicContact CG-CD1 4.38Å; P1150-L1256 HydrophobicContact CG-CD2 4.28Å
1151	K	93.8	Very high	94.1	Very high	123 Å²	123	48.1 Å²	48.1	54%	0.535	24%	0.237	S	C	.	.	H	α-helix	trans	-71.6	-39.9	-175.5	-170.7	176.1	-178.1	172.6	0	111.6	A1110 D1149 M1155	A1110-K1151 HydrophobicContact CB-CB 3.98Å; A1110-K1151 HydrophobicContact CB-CD 3.99Å; A1110-K1151 HydrophobicContact CB-CG 3.82Å; D1149-K1151 VanDerWaalsContact C-N 3.25Å; D1149-K1151 PolarHBondContact O-N 2.7Å; D1149-K1151 WeakPolarHBondContact OD1-CB 3.44Å; D1149-K1151 PolarHBondContact OD1-N 3.11Å; K1151-M1155 HydrophobicContact CD-CE 4.47Å; K1151-M1155 HydrophobicContact CG-CE 4.05Å; K1151-M1155 VanDerWaalsContact O-CG 3.23Å; K1151-M1155 WeakPolarHBondContact O-CG 3.24Å; K1151-M1155 PolarHBondContact O-N 3.07Å; K1151-M1155 VanDerWaalsContact O-N 3.14Å
1152	L	95.3	Very high	93.7	Very high	1 Å²	1	50.6 Å²	50.6	1%	0.005	25%	0.247	C	C	.	.	H	α-helix	trans	-67.4	-42.1	172.5	178.7	57.5	0	0	0	111.2	L1108 A1110 Y1113 V1147 D1149 M1155 I1156	L1108-L1152 HydrophobicContact CD1-CD2 3.6Å; L1108-L1152 HydrophobicContact CG-CD2 3.8Å; A1110-L1152 HydrophobicContact CB-CB 4.14Å; Y1113-L1152 VanDerWaalsContact CB-CD1 3.48Å; Y1113-L1152 HydrophobicContact CD1-CD1 4.19Å; Y1113-L1152 HydrophobicContact CD2-CD1 4.49Å; Y1113-L1152 HydrophobicContact CG-CD1 3.81Å; V1147-L1152 HydrophobicContact CG1-CB 4.04Å; V1147-L1152 HydrophobicContact CG1-CD2 3.98Å; V1147-L1152 HydrophobicContact CG1-CG 3.9Å; D1149-L1152 HydrophobicContact CB-CB 3.96Å; D1149-L1152 PolarHBondContact O-N 2.84Å; D1149-L1152 PolarHBondContact OD1-N 3.19Å; D1149-L1152 VanDerWaalsContact OD2-CB 3.26Å; D1149-L1152 WeakPolarHBondContact OD2-CB 3.44Å; D1149-L1152 PolarHBondContact OD2-N 3.43Å; L1152-M1155 PolarHBondContact O-N 3.36Å; L1152-I1156 HydrophobicContact CD1-CD1 3.75Å; L1152-I1156 HydrophobicContact CD1-CG1 4.09Å; L1152-I1156 HydrophobicContact CG-CD1 3.75Å; L1152-I1156 WeakPolarHBondContact O-CD1 3.24Å; L1152-I1156 VanDerWaalsContact O-CG1 3.28Å; L1152-I1156 WeakPolarHBondContact O-CG1 3.39Å; L1152-I1156 PolarHBondContact O-N 3.41Å
1153	F	95.6	Very high	93.4	Very high	28 Å²	28	51.1 Å²	51.1	12%	0.123	25%	0.249	C	C	.	.	H	α-helix	trans	-57.6	-50.5	175.8	171.1	-100.3	0	0	0	111.6	V1147 D1149 P1150 M1155 I1156 K1157 F1254 L1256	V1147-F1153 HydrophobicContact CB-CB 4.45Å; V1147-F1153 HydrophobicContact CG1-CB 3.97Å; D1149-F1153 WeakPolarHBondContact O-CB 3.21Å; D1149-F1153 PolarHBondContact O-N 3.37Å; P1150-F1153 PolarHBondContact O-N 3.44Å; F1153-M1155 PolarHBondContact O-N 2.85Å; F1153-I1156 PolarHBondContact O-N 3.03Å; F1153-K1157 HydrophobicContact CE1-CB 4.46Å; F1153-K1157 HydrophobicContact CE2-CD 4.32Å; F1153-K1157 HydrophobicContact CZ-CB 4.28Å; F1153-K1157 HydrophobicContact CZ-CD 3.97Å; F1153-K1157 HydrophobicContact CZ-CG 4.17Å; F1153-K1157 WeakPolarHBondContact O-CB 3.33Å; F1153-K1157 PolarHBondContact O-N 2.92Å; F1153-F1254 HydrophobicContact CD2-CD1 4.03Å; F1153-F1254 AromaticContact CD2-CE1 3.45Å; F1153-F1254 HydrophobicContact CD2-CE1 3.45Å; F1153-F1254 VanDerWaalsContact CD2-CE1 3.45Å; F1153-F1254 HydrophobicContact CD2-CE2 4.39Å; F1153-F1254 AromaticContact CD2-CZ 3.67Å; F1153-F1254 HydrophobicContact CD2-CZ 3.67Å; F1153-F1254 AromaticContact CE2-CD1 3.61Å; F1153-F1254 HydrophobicContact CE2-CD1 3.61Å; F1153-F1254 AromaticContact CE2-CE1 3.53Å; F1153-F1254 HydrophobicContact CE2-CE1 3.53Å; F1153-F1254 HydrophobicContact CE2-CG 4.2Å; F1153-F1254 HydrophobicContact CE2-CZ 4.09Å; F1153-F1254 WeakPolarHBondContact CE2-O 3.31Å; F1153-F1254 HydrophobicContact CG-CE1 4.48Å; F1153-L1256 HydrophobicContact CB-CD1 3.84Å; F1153-L1256 HydrophobicContact CD1-CB 3.95Å; F1153-L1256 HydrophobicContact CD1-CD1 4.3Å; F1153-L1256 HydrophobicContact CD2-CB 4.4Å; F1153-L1256 HydrophobicContact CE1-CB 4.1Å; F1153-L1256 VanDerWaalsContact CE2-N 3.3Å; F1153-L1256 HydrophobicContact CG-CB 4.11Å; F1153-L1256 HydrophobicContact CG-CD1 4.03Å; F1153-L1256 HydrophobicContact CZ-CB 4.42Å
1154	E	93.3	Very high	93.2	Very high	87 Å²	87	47.3 Å²	47.3	41%	0.407	23%	0.234	S	C	.	.	H	α-helix	trans	-57.3	-46.5	176.9	-74.8	171.9	-177.4	0	0	112.1	I753 P1150 I1156 K1157 Y1158	I753-E1154 HydrophobicContact CD1-CG 3.94Å; P1150-E1154 WeakPolarHBondContact O-CB 3.49Å; P1150-E1154 VanDerWaalsContact O-CG 3.24Å; P1150-E1154 WeakPolarHBondContact O-CG 3.43Å; P1150-E1154 PolarHBondContact O-N 2.74Å; E1154-I1156 PolarHBondContact O-N 3.44Å; E1154-K1157 PolarHBondContact O-N 3.2Å; E1154-Y1158 WeakPolarHBondContact O-CB 3.5Å; E1154-Y1158 PolarHBondContact O-N 3.28Å
1155	M	94.8	Very high	92.9	Very high	49 Å²	49	44.4 Å²	44.4	24%	0.241	22%	0.217	C	C	.	.	H	α-helix	trans	-61.7	-44.4	179	-73	174.8	175.1	0	0	112.5	A1110 Y1113 K1114 K1151 L1152 F1153 C1159	A1110-M1155 HydrophobicContact CB-SD 4.13Å; Y1113-M1155 HydrophobicContact CD1-CB 3.72Å; Y1113-M1155 HydrophobicContact CE1-CB 3.82Å; K1114-M1155 HydrophobicContact CB-CE 4.1Å; K1114-M1155 HydrophobicContact CB-SD 4.04Å; K1114-M1155 HydrophobicContact CD-CE 4.36Å; K1114-M1155 HydrophobicContact CG-CE 4.44Å; K1151-M1155 HydrophobicContact CD-CE 4.47Å; K1151-M1155 HydrophobicContact CG-CE 4.05Å; K1151-M1155 VanDerWaalsContact O-CG 3.23Å; K1151-M1155 WeakPolarHBondContact O-CG 3.24Å; K1151-M1155 PolarHBondContact O-N 3.07Å; K1151-M1155 VanDerWaalsContact O-N 3.14Å; L1152-M1155 PolarHBondContact O-N 3.36Å; F1153-M1155 PolarHBondContact O-N 2.85Å; M1155-C1159 PolarHBondContact O-N 3.1Å; M1155-C1159 VanDerWaalsContact O-N 3.09Å
1156	I	95.7	Very high	92.6	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-66.6	-50.8	176.7	-61.9	158.1	0	0	0	109.8	Y1113 M1141 V1147 L1152 F1153 E1154 Y1158 C1159 L1160 F1254	Y1113-I1156 HydrophobicContact CD1-CG1 4.29Å; Y1113-I1156 HydrophobicContact CD2-CG1 4.32Å; Y1113-I1156 HydrophobicContact CE1-CG1 3.95Å; Y1113-I1156 HydrophobicContact CE2-CG1 3.99Å; Y1113-I1156 HydrophobicContact CG-CG1 4.46Å; M1141-I1156 HydrophobicContact CE-CD1 3.47Å; M1141-I1156 VanDerWaalsContact CE-CD1 3.47Å; M1141-I1156 HydrophobicContact CE-CG1 3.88Å; V1147-I1156 HydrophobicContact CG2-CD1 4Å; L1152-I1156 HydrophobicContact CD1-CD1 3.75Å; L1152-I1156 HydrophobicContact CD1-CG1 4.09Å; L1152-I1156 HydrophobicContact CG-CD1 3.75Å; L1152-I1156 WeakPolarHBondContact O-CD1 3.24Å; L1152-I1156 VanDerWaalsContact O-CG1 3.28Å; L1152-I1156 WeakPolarHBondContact O-CG1 3.39Å; L1152-I1156 PolarHBondContact O-N 3.41Å; F1153-I1156 PolarHBondContact O-N 3.03Å; E1154-I1156 PolarHBondContact O-N 3.44Å; I1156-Y1158 VanDerWaalsContact C-N 3.27Å; I1156-Y1158 PolarHBondContact O-N 3.41Å; I1156-C1159 WeakPolarHBondContact O-CA 3.34Å; I1156-C1159 WeakPolarHBondContact O-CB 3.38Å; I1156-C1159 PolarHBondContact O-N 2.7Å; I1156-L1160 HydrophobicContact CG2-CD1 4.2Å; I1156-L1160 HydrophobicContact CG2-CG 4.26Å; I1156-L1160 WeakPolarHBondContact O-CG 3.4Å; I1156-L1160 PolarHBondContact O-N 3.38Å; I1156-F1254 HydrophobicContact CB-CE1 3.81Å; I1156-F1254 HydrophobicContact CB-CZ 3.98Å; I1156-F1254 HydrophobicContact CD1-CZ 4.02Å; I1156-F1254 HydrophobicContact CG2-CD1 4.35Å; I1156-F1254 HydrophobicContact CG2-CE1 3.55Å; I1156-F1254 HydrophobicContact CG2-CZ 3.73Å
1157	K	94.3	Very high	92.4	Very high	14 Å²	14	40.3 Å²	40.3	6%	0.061	20%	0.2	C	C	.	.	H	α-helix	trans	-57.5	-40.4	-178.8	-170.2	76.9	168	-170.3	0	111.4	C754 F1153 E1154 L1160 L1161 Y1251 F1254	C754-K1157 HydrophobicContact CB-CG 4.04Å; C754-K1157 VanDerWaalsContact SG-CG 3.6Å; F1153-K1157 HydrophobicContact CE1-CB 4.46Å; F1153-K1157 HydrophobicContact CE2-CD 4.32Å; F1153-K1157 HydrophobicContact CZ-CB 4.28Å; F1153-K1157 HydrophobicContact CZ-CD 3.97Å; F1153-K1157 HydrophobicContact CZ-CG 4.17Å; F1153-K1157 WeakPolarHBondContact O-CB 3.33Å; F1153-K1157 PolarHBondContact O-N 2.92Å; E1154-K1157 PolarHBondContact O-N 3.2Å; K1157-L1160 PolarHBondContact O-N 3.2Å; K1157-L1161 WeakPolarHBondContact O-CB 3.24Å; K1157-L1161 PolarHBondContact O-N 3.01Å; K1157-Y1251 HydrophobicContact CD-CD2 4.3Å; K1157-Y1251 HydrophobicContact CD-CE2 3.79Å; K1157-Y1251 HydrophobicContact CG-CE2 4.21Å; K1157-Y1251 PolarHBondContact NZ-O 2.82Å; K1157-F1254 HydrophobicContact CB-CD1 4.38Å; K1157-F1254 HydrophobicContact CB-CE1 4.32Å; K1157-F1254 HydrophobicContact CD-CD1 3.94Å; K1157-F1254 PolarHBondContact NZ-O 3.49Å
1158	Y	91.1	Very high	92.1	Very high	93 Å²	93	40.7 Å²	40.7	37%	0.365	20%	0.202	S	C	.	.	H	α-helix	trans	-66	-39.5	173.9	-179.1	-103.9	0	0	0	112.8	L778 E1154 I1156 L1161 K1162	L778-Y1158 HydrophobicContact CD1-CE2 4.11Å; L778-Y1158 HydrophobicContact CD2-CE2 4.14Å; E1154-Y1158 WeakPolarHBondContact O-CB 3.5Å; E1154-Y1158 PolarHBondContact O-N 3.28Å; I1156-Y1158 VanDerWaalsContact C-N 3.27Å; I1156-Y1158 PolarHBondContact O-N 3.41Å; Y1158-L1161 PolarHBondContact O-N 3.5Å; Y1158-K1162 WeakPolarHBondContact O-CB 3.34Å; Y1158-K1162 PolarHBondContact O-N 3.16Å
1159	C	93.9	Very high	91.9	Very high	22 Å²	22	40.5 Å²	40.5	15%	0.149	20%	0.197	C	C	.	.	H	α-helix	trans	-61.1	-51	173	-173	0	0	0	0	111.4	Y1113 M1155 I1156 L1161 K1162 I1163	Y1113-C1159 VanDerWaalsContact OH-CB 3.26Å; Y1113-C1159 WeakPolarHBondContact OH-CB 3.39Å; M1155-C1159 PolarHBondContact O-N 3.1Å; M1155-C1159 VanDerWaalsContact O-N 3.09Å; I1156-C1159 WeakPolarHBondContact O-CA 3.34Å; I1156-C1159 WeakPolarHBondContact O-CB 3.38Å; I1156-C1159 PolarHBondContact O-N 2.7Å; C1159-L1161 VanDerWaalsContact C-N 3.31Å; C1159-L1161 PolarHBondContact O-N 2.93Å; C1159-K1162 PolarHBondContact O-N 3.05Å; C1159-I1163 VanDerWaalsContact O-CG1 3.32Å; C1159-I1163 WeakPolarHBondContact O-CG1 3.42Å; C1159-I1163 PolarHBondContact O-N 3.09Å
1160	L	95.3	Very high	91.9	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-56.3	-45.9	176.7	-58.7	172.8	0	0	0	111.3	W1139 A1142 I1156 K1157 I1163 L1164 Y1251 F1254	W1139-L1160 HydrophobicContact CB-CD2 4.49Å; W1139-L1160 HydrophobicContact CD2-CD2 3.5Å; W1139-L1160 HydrophobicContact CE3-CD2 3.72Å; W1139-L1160 HydrophobicContact CG-CD2 3.87Å; W1139-L1160 HydrophobicContact CH2-CB 4.38Å; W1139-L1160 HydrophobicContact CH2-CD2 4.34Å; W1139-L1160 HydrophobicContact CZ2-CB 4.33Å; W1139-L1160 HydrophobicContact CZ2-CD2 4.17Å; W1139-L1160 HydrophobicContact CZ3-CD2 4.12Å; A1142-L1160 HydrophobicContact CB-CD1 3.61Å; A1142-L1160 HydrophobicContact CB-CD2 4.07Å; A1142-L1160 HydrophobicContact CB-CG 4.45Å; I1156-L1160 HydrophobicContact CG2-CD1 4.2Å; I1156-L1160 HydrophobicContact CG2-CG 4.26Å; I1156-L1160 WeakPolarHBondContact O-CG 3.4Å; I1156-L1160 PolarHBondContact O-N 3.38Å; K1157-L1160 PolarHBondContact O-N 3.2Å; L1160-I1163 PolarHBondContact O-N 3.49Å; L1160-L1164 VanDerWaalsContact O-CB 3.25Å; L1160-L1164 WeakPolarHBondContact O-CB 3.42Å; L1160-L1164 PolarHBondContact O-N 3.47Å; L1160-Y1251 HydrophobicContact CB-CD2 3.81Å; L1160-Y1251 HydrophobicContact CB-CE2 4.34Å; L1160-Y1251 HydrophobicContact CD1-CD2 4.41Å; L1160-F1254 HydrophobicContact CD1-CB 4.39Å; L1160-F1254 HydrophobicContact CD1-CD1 3.76Å; L1160-F1254 HydrophobicContact CD1-CE1 4.41Å; L1160-F1254 HydrophobicContact CD1-CG 4.26Å
1161	L	91.3	Very high	91.8	Very high	4 Å²	4	40.3 Å²	40.3	2%	0.021	19%	0.187	C	C	.	.	H	α-helix	trans	-60.1	-47.3	178.8	174.4	57.2	0	0	0	112.4	P755 V760 L778 K1157 Y1158 C1159 I1163 K1165 Y1251	P755-L1161 HydrophobicContact CG-CD1 3.85Å; P755-L1161 HydrophobicContact CG-CD2 4.02Å; V760-L1161 HydrophobicContact CB-CD1 4.49Å; V760-L1161 HydrophobicContact CG1-CD1 4.34Å; V760-L1161 HydrophobicContact CG2-CD1 3.31Å; L778-L1161 HydrophobicContact CD1-CD2 3.72Å; L778-L1161 HydrophobicContact CD1-CG 3.75Å; L778-L1161 HydrophobicContact CD2-CD2 4.37Å; L778-L1161 HydrophobicContact CG-CD2 4.33Å; K1157-L1161 WeakPolarHBondContact O-CB 3.24Å; K1157-L1161 PolarHBondContact O-N 3.01Å; Y1158-L1161 PolarHBondContact O-N 3.5Å; C1159-L1161 VanDerWaalsContact C-N 3.31Å; C1159-L1161 PolarHBondContact O-N 2.93Å; L1161-I1163 PolarHBondContact O-N 2.92Å; L1161-K1165 WeakPolarHBondContact O-CB 3.1Å; L1161-K1165 PolarHBondContact O-N 3.04Å; L1161-Y1251 HydrophobicContact CB-CE2 3.87Å
1162	K	88.8	Confident	91.6	Very high	51 Å²	51	37 Å²	37	22%	0.222	17%	0.173	C	C	.	.	H	α-helix	trans	-59.3	-46.1	176	-179.2	-179.1	172	-171	0	110.9	E1121 Y1158 C1159 Q1166	E1121-K1162 IonicContact OE2-NZ 2.83Å; E1121-K1162 PolarHBondContact OE2-NZ 2.89Å; E1121-K1162 VanDerWaalsContact OE2-NZ 3.07Å; Y1158-K1162 WeakPolarHBondContact O-CB 3.34Å; Y1158-K1162 PolarHBondContact O-N 3.16Å; C1159-K1162 PolarHBondContact O-N 3.05Å; K1162-Q1166 WeakPolarHBondContact O-CB 3.45Å; K1162-Q1166 VanDerWaalsContact O-CG 3.27Å; K1162-Q1166 WeakPolarHBondContact O-CG 3.36Å; K1162-Q1166 PolarHBondContact O-N 3.32Å
1163	I	91.4	Very high	91.3	Very high	23 Å²	23	39.6 Å²	39.6	12%	0.118	20%	0.195	C	C	.	.	H	α-helix	trans	-70.5	-42.2	-178.5	-63.3	-65.4	0	0	0	112	V1135 C1159 L1160 L1161 K1165 Q1166 Y1167 F1203	V1135-I1163 HydrophobicContact CB-CD1 4.44Å; V1135-I1163 HydrophobicContact CG1-CB 4.37Å; V1135-I1163 HydrophobicContact CG1-CD1 3.94Å; V1135-I1163 HydrophobicContact CG1-CG1 3.83Å; V1135-I1163 HydrophobicContact CG1-CG2 3.77Å; V1135-I1163 HydrophobicContact CG2-CD1 3.56Å; V1135-I1163 HydrophobicContact CG2-CG1 3.97Å; C1159-I1163 VanDerWaalsContact O-CG1 3.32Å; C1159-I1163 WeakPolarHBondContact O-CG1 3.42Å; C1159-I1163 PolarHBondContact O-N 3.09Å; L1160-I1163 PolarHBondContact O-N 3.49Å; L1161-I1163 PolarHBondContact O-N 2.92Å; I1163-K1165 PolarHBondContact O-N 3.25Å; I1163-Q1166 PolarHBondContact O-N 2.84Å; I1163-Y1167 WeakPolarHBondContact O-CB 3.46Å; I1163-Y1167 PolarHBondContact O-N 3.33Å; I1163-F1203 HydrophobicContact CG2-CD1 3.88Å; I1163-F1203 HydrophobicContact CG2-CE1 4.06Å
1164	L	91.3	Very high	91.2	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-60.8	-44.4	177.4	-177.1	62.5	0	0	0	111.1	W1139 L1160 Y1167 Q1168 M1244 L1247 Y1251	W1139-L1164 HydrophobicContact CH2-CB 4.43Å; W1139-L1164 HydrophobicContact CZ2-CB 4.32Å; L1160-L1164 VanDerWaalsContact O-CB 3.25Å; L1160-L1164 WeakPolarHBondContact O-CB 3.42Å; L1160-L1164 PolarHBondContact O-N 3.47Å; L1164-Y1167 PolarHBondContact O-N 3.13Å; L1164-Q1168 WeakPolarHBondContact O-CB 3.47Å; L1164-Q1168 PolarHBondContact O-N 3.26Å; L1164-M1244 HydrophobicContact CD1-SD 3.97Å; L1164-L1247 HydrophobicContact CD1-CB 4.05Å; L1164-Y1251 HydrophobicContact CD2-CD1 4.27Å; L1164-Y1251 HydrophobicContact CD2-CG 4.07Å
1165	K	87.4	Confident	91	Very high	34 Å²	34	38.8 Å²	38.8	15%	0.148	20%	0.198	C	C	.	.	H	α-helix	trans	-61.9	-48.4	174	-175.9	179.3	174.1	-175.3	0	111.8	V760 D780 L1161 I1163 Y1167 Q1168 T1169	V760-K1165 HydrophobicContact CG1-CB 4Å; D780-K1165 WeakPolarHBondContact OD1-CE 3.35Å; D780-K1165 IonicContact OD1-NZ 3.44Å; D780-K1165 PolarHBondContact OD1-NZ 3.41Å; D780-K1165 IonicContact OD2-NZ 2.82Å; D780-K1165 PolarHBondContact OD2-NZ 3Å; L1161-K1165 WeakPolarHBondContact O-CB 3.1Å; L1161-K1165 PolarHBondContact O-N 3.04Å; I1163-K1165 PolarHBondContact O-N 3.25Å; K1165-Y1167 VanDerWaalsContact C-N 3.34Å; K1165-Y1167 PolarHBondContact O-N 3.08Å; K1165-Q1168 PolarHBondContact O-N 3.37Å; K1165-T1169 WeakPolarHBondContact O-CB 3.21Å; K1165-T1169 PolarHBondContact O-N 3.07Å; K1165-T1169 PolarHBondContact O-OG1 2.91Å
1166	Q	87	Confident	90.8	Very high	108 Å²	108	40.7 Å²	40.7	51%	0.505	22%	0.222	S	C	.	.	H	α-helix	trans	-59.4	-43.8	179	-77.1	177.9	-20.4	0	0	112.1	K1162 I1163 L1170	K1162-Q1166 WeakPolarHBondContact O-CB 3.45Å; K1162-Q1166 VanDerWaalsContact O-CG 3.27Å; K1162-Q1166 WeakPolarHBondContact O-CG 3.36Å; K1162-Q1166 PolarHBondContact O-N 3.32Å; I1163-Q1166 PolarHBondContact O-N 2.84Å; Q1166-L1170 WeakPolarHBondContact O-CB 3.18Å; Q1166-L1170 PolarHBondContact O-N 3.44Å
1167	Y	89.1	Confident	90.6	Very high	12 Å²	12	44.5 Å²	44.5	5%	0.047	25%	0.253	C	S	.	.	H	α-helix	trans	-66.3	-47.8	177.6	167.3	-133.6	0	0	0	112.3	I1163 L1164 K1165 T1169 L1170 R1171 N1204 L1205 E1240 Y1242 M1244 L1247	I1163-Y1167 WeakPolarHBondContact O-CB 3.46Å; I1163-Y1167 PolarHBondContact O-N 3.33Å; L1164-Y1167 PolarHBondContact O-N 3.13Å; K1165-Y1167 VanDerWaalsContact C-N 3.34Å; K1165-Y1167 PolarHBondContact O-N 3.08Å; Y1167-T1169 PolarHBondContact O-N 2.63Å; Y1167-L1170 PolarHBondContact O-N 2.94Å; Y1167-R1171 HydrophobicContact CD2-CB 4.5Å; Y1167-R1171 HydrophobicContact CE2-CB 4.25Å; Y1167-R1171 HydrophobicContact CE2-CG 4.47Å; Y1167-R1171 VanDerWaalsContact O-CB 3.31Å; Y1167-R1171 WeakPolarHBondContact O-CB 3.42Å; Y1167-R1171 PolarHBondContact O-N 2.92Å; Y1167-N1204 WeakPolarHBondContact CE1-ND2 3.45Å; Y1167-N1204 WeakPolarHBondContact CE2-ND2 3.4Å; Y1167-N1204 PolarHBondContact OH-ND2 3.39Å; Y1167-L1205 HydrophobicContact CD2-CD1 3.68Å; Y1167-L1205 HydrophobicContact CD2-CG 3.82Å; Y1167-L1205 HydrophobicContact CE2-CD1 3.77Å; Y1167-L1205 HydrophobicContact CE2-CD2 3.97Å; Y1167-L1205 HydrophobicContact CE2-CG 3.65Å; Y1167-E1240 VanDerWaalsContact OH-CD 3.22Å; Y1167-E1240 PolarHBondContact OH-OE1 3.16Å; Y1167-Y1242 PolarHBondContact OH-O 3.05Å; Y1167-M1244 HydrophobicContact CD1-CE 3.52Å; Y1167-M1244 HydrophobicContact CD1-SD 3.76Å; Y1167-M1244 HydrophobicContact CD2-CE 4.39Å; Y1167-M1244 HydrophobicContact CE1-CE 3.09Å; Y1167-M1244 HydrophobicContact CE1-SD 3.49Å; Y1167-M1244 WeakPolarHBondContact CE1-SD 3.42Å; Y1167-M1244 HydrophobicContact CE2-CE 4.01Å; Y1167-M1244 HydrophobicContact CG-CE 4.16Å; Y1167-L1247 HydrophobicContact CD1-CD1 3.65Å; Y1167-L1247 HydrophobicContact CE1-CD1 3.63Å
1168	Q	88.6	Confident	90.5	Very high	11 Å²	11	47.2 Å²	47.2	5%	0.051	28%	0.284	C	S	.	.	H	α-helix	trans	-56.8	-48.9	176.2	-179.1	69.2	23.6	0	0	111.2	L761 C764 L1164 K1165 L1170 R1171 E1172 M1244	L761-Q1168 HydrophobicContact CD2-CB 4.47Å; L761-Q1168 VanDerWaalsContact CD2-CD 3.44Å; L761-Q1168 HydrophobicContact CD2-CG 3.88Å; C764-Q1168 HydrophobicContact CB-CB 4.3Å; C764-Q1168 HydrophobicContact CB-CG 3.51Å; L1164-Q1168 WeakPolarHBondContact O-CB 3.47Å; L1164-Q1168 PolarHBondContact O-N 3.26Å; K1165-Q1168 PolarHBondContact O-N 3.37Å; Q1168-L1170 PolarHBondContact O-N 3.42Å; Q1168-R1171 PolarHBondContact O-N 3.36Å; Q1168-E1172 VanDerWaalsContact NE2-CD 3.32Å; Q1168-E1172 PolarHBondContact NE2-OE1 3.31Å; Q1168-E1172 WeakPolarHBondContact O-CB 3.34Å; Q1168-E1172 WeakPolarHBondContact O-CG 3.49Å; Q1168-E1172 PolarHBondContact O-N 3.43Å; Q1168-M1244 HydrophobicContact CB-CE 4.41Å; Q1168-M1244 PolarHBondContact OE1-SD 3.18Å
1169	T	88.3	Confident	90.5	Very high	67 Å²	67	45 Å²	45	41%	0.411	28%	0.277	S	S	.	.	H	α-helix	trans	-65.1	-38.9	179.9	-66.6	0	0	0	0	112.6	C764 K1165 Y1167 A1173	C764-T1169 PolarHBondContact SG-OG1 2.61Å; C764-T1169 VanDerWaalsContact SG-OG1 3.42Å; K1165-T1169 WeakPolarHBondContact O-CB 3.21Å; K1165-T1169 PolarHBondContact O-N 3.07Å; K1165-T1169 PolarHBondContact O-OG1 2.91Å; Y1167-T1169 PolarHBondContact O-N 2.63Å; T1169-A1173 WeakPolarHBondContact O-CB 3.21Å; T1169-A1173 PolarHBondContact O-N 3.11Å
1170	L	91.1	Very high	90.4	Very high	44 Å²	44	50.6 Å²	50.6	23%	0.23	30%	0.301	C	S	.	.	H	α-helix	trans	-66.6	-42.1	174.9	177.9	56.7	0	0	0	111.8	Q1166 Y1167 Q1168 A1173 L1174 L1205 F1207 H1223	Q1166-L1170 WeakPolarHBondContact O-CB 3.18Å; Q1166-L1170 PolarHBondContact O-N 3.44Å; Y1167-L1170 PolarHBondContact O-N 2.94Å; Q1168-L1170 PolarHBondContact O-N 3.42Å; L1170-A1173 PolarHBondContact O-N 2.93Å; L1170-L1174 HydrophobicContact CD1-CD1 4.3Å; L1170-L1174 HydrophobicContact CD1-CG 4.29Å; L1170-L1174 HydrophobicContact CG-CD1 4.23Å; L1170-L1174 WeakPolarHBondContact O-CG 3.44Å; L1170-L1174 PolarHBondContact O-N 2.91Å; L1170-L1205 HydrophobicContact CB-CD1 4.42Å; L1170-L1205 HydrophobicContact CD2-CD1 3.94Å; L1170-L1205 HydrophobicContact CG-CD1 3.9Å; L1170-F1207 HydrophobicContact CD1-CZ 4.42Å; L1170-F1207 HydrophobicContact CD2-CE2 4.31Å; L1170-F1207 HydrophobicContact CD2-CZ 4.2Å; L1170-H1223 HydrophobicContact CD2-CB 4.42Å
1171	R	90.6	Very high	90.2	Very high	74 Å²	74	51.8 Å²	51.8	28%	0.279	31%	0.308	S	S	.	.	H	α-helix	trans	-63.6	-44.7	177.7	-165.1	-175.5	-162	-81.2	-0.7	111.7	Y1167 Q1168 L1174 V1175 L1205 E1240	Y1167-R1171 HydrophobicContact CD2-CB 4.5Å; Y1167-R1171 HydrophobicContact CE2-CB 4.25Å; Y1167-R1171 HydrophobicContact CE2-CG 4.47Å; Y1167-R1171 VanDerWaalsContact O-CB 3.31Å; Y1167-R1171 WeakPolarHBondContact O-CB 3.42Å; Y1167-R1171 PolarHBondContact O-N 2.92Å; Q1168-R1171 PolarHBondContact O-N 3.36Å; R1171-L1174 PolarHBondContact O-N 3.19Å; R1171-V1175 WeakPolarHBondContact O-CG2 3.46Å; R1171-V1175 PolarHBondContact O-N 3.13Å; R1171-L1205 HydrophobicContact CB-CD1 4.44Å; R1171-E1240 IonicContact CZ-OE1 2.76Å; R1171-E1240 IonicContact CZ-OE2 3.21Å; R1171-E1240 IonicContact NE-OE1 3.62Å; R1171-E1240 PolarHBondContact NE-OE1 2.82Å; R1171-E1240 IonicContact NE-OE2 2.7Å; R1171-E1240 IonicContact NH2-OE1 3.24Å; R1171-E1240 PolarHBondContact NH2-OE1 3.49Å; R1171-E1240 IonicContact NH2-OE2 2.76Å; R1171-E1240 PolarHBondContact NH2-OE2 3.1Å
1172	E	89.4	Confident	90.3	Very high	54 Å²	54	54.8 Å²	54.8	25%	0.252	32%	0.323	S	S	.	.	H	α-helix	trans	-63.4	-39.7	174.9	-74.6	177.2	166.5	0	0	111.8	C764 R765 Q1168 V1175 A1176	C764-E1172 WeakPolarHBondContact CB-OE2 3.46Å; R765-E1172 WeakPolarHBondContact CG-OE1 3.3Å; R765-E1172 IonicContact NE-OE1 2.85Å; Q1168-E1172 VanDerWaalsContact NE2-CD 3.32Å; Q1168-E1172 PolarHBondContact NE2-OE1 3.31Å; Q1168-E1172 WeakPolarHBondContact O-CB 3.34Å; Q1168-E1172 WeakPolarHBondContact O-CG 3.49Å; Q1168-E1172 PolarHBondContact O-N 3.43Å; E1172-V1175 PolarHBondContact O-N 3.47Å; E1172-A1176 VanDerWaalsContact O-CB 3.22Å; E1172-A1176 WeakPolarHBondContact O-CB 3.07Å; E1172-A1176 PolarHBondContact O-N 3.49Å
1173	A	90.2	Very high	90.6	Very high	56 Å²	56	58.3 Å²	58.3	46%	0.463	34%	0.335	S	S	.	.	H	α-helix	trans	-65.5	-37.1	175.6	0	0	0	0	0	113.3	T1169 L1170 A1177	T1169-A1173 WeakPolarHBondContact O-CB 3.21Å; T1169-A1173 PolarHBondContact O-N 3.11Å; L1170-A1173 PolarHBondContact O-N 2.93Å; A1173-A1177 WeakPolarHBondContact O-CB 3.26Å; A1173-A1177 PolarHBondContact O-N 3.13Å
1174	L	92	Very high	90.7	Very high	8 Å²	8	61.7 Å²	61.7	4%	0.042	35%	0.351	C	S	.	.	H	α-helix	trans	-68	-46.2	175.4	-71.6	167.4	0	0	0	111.8	L1170 R1171 A1176 A1177 G1178 K1179 V1181 L1205 F1207 L1233 V1238	L1170-L1174 HydrophobicContact CD1-CD1 4.3Å; L1170-L1174 HydrophobicContact CD1-CG 4.29Å; L1170-L1174 HydrophobicContact CG-CD1 4.23Å; L1170-L1174 WeakPolarHBondContact O-CG 3.44Å; L1170-L1174 PolarHBondContact O-N 2.91Å; R1171-L1174 PolarHBondContact O-N 3.19Å; L1174-A1176 PolarHBondContact O-N 2.93Å; L1174-A1177 CarbonylContact O-C 3.58Å; L1174-A1177 PolarHBondContact O-N 3.48Å; L1174-A1177 VanDerWaalsContact O-N 3.14Å; L1174-G1178 PolarHBondContact O-N 3.1Å; L1174-K1179 HydrophobicContact CD2-CB 4.25Å; L1174-K1179 HydrophobicContact CD2-CG 4.35Å; L1174-K1179 PolarHBondContact O-N 3.1Å; L1174-V1181 HydrophobicContact CB-CG2 4.16Å; L1174-V1181 HydrophobicContact CD1-CG2 4.13Å; L1174-L1205 HydrophobicContact CD1-CD1 4.05Å; L1174-F1207 HydrophobicContact CD1-CE1 4.31Å; L1174-F1207 HydrophobicContact CD1-CZ 4.08Å; L1174-F1207 HydrophobicContact CD2-CE1 4.08Å; L1174-L1233 HydrophobicContact CD2-CD1 3.83Å; L1174-V1238 HydrophobicContact CD1-CG1 4.09Å; L1174-V1238 HydrophobicContact CD1-CG2 4.49Å; L1174-V1238 HydrophobicContact CD2-CG2 4.49Å
1175	V	89.8	Confident	90.8	Very high	89 Å²	89	62 Å²	62	54%	0.539	35%	0.353	S	S	.	.	H	α-helix	trans	-62.8	-41.8	176.4	171.6	0	0	0	0	111.1	R1171 E1172 A1177 G1178	R1171-V1175 WeakPolarHBondContact O-CG2 3.46Å; R1171-V1175 PolarHBondContact O-N 3.13Å; E1172-V1175 PolarHBondContact O-N 3.47Å; V1175-A1177 VanDerWaalsContact C-N 3.26Å; V1175-A1177 PolarHBondContact O-N 3.36Å; V1175-G1178 PolarHBondContact O-N 3.28Å
1176	A	91.3	Very high	91	Very high	90 Å²	90	63.4 Å²	63.4	74%	0.744	36%	0.358	S	S	*	.	H	α-helix	trans	-66.5	-26.1	175.2	0	0	0	0	0	113.4	E1172 L1174 G1178	E1172-A1176 VanDerWaalsContact O-CB 3.22Å; E1172-A1176 WeakPolarHBondContact O-CB 3.07Å; E1172-A1176 PolarHBondContact O-N 3.49Å; L1174-A1176 PolarHBondContact O-N 2.93Å; A1176-G1178 VanDerWaalsContact C-N 3.28Å
1177	A	90.6	Very high	91.1	Very high	80 Å²	80	63.1 Å²	63.1	66%	0.661	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	3.5	171.4	0	0	0	0	0	113.5	A1173 L1174 V1175 K1179	A1173-A1177 WeakPolarHBondContact O-CB 3.26Å; A1173-A1177 PolarHBondContact O-N 3.13Å; L1174-A1177 CarbonylContact O-C 3.58Å; L1174-A1177 PolarHBondContact O-N 3.48Å; L1174-A1177 VanDerWaalsContact O-N 3.14Å; V1175-A1177 VanDerWaalsContact C-N 3.26Å; V1175-A1177 PolarHBondContact O-N 3.36Å; A1177-K1179 PolarHBondContact O-N 3.04Å
1178	G	91.4	Very high	90.8	Very high	70 Å²	70	69.7 Å²	69.7	72%	0.722	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.7	14.2	-177.7	0	0	0	0	0	114.5	L1174 V1175 A1176	L1174-G1178 PolarHBondContact O-N 3.1Å; V1175-G1178 PolarHBondContact O-N 3.28Å; A1176-G1178 VanDerWaalsContact C-N 3.28Å
1179	K	92.4	Very high	90.4	Very high	46 Å²	46	75.7 Å²	75.7	20%	0.2	43%	0.432	C	S	.	.			trans	-84.8	120.8	-179.9	-169.5	70.6	-166	-179.5	0	110.2	L1174 A1177 L1233 E1234 F1236 V1238	L1174-K1179 HydrophobicContact CD2-CB 4.25Å; L1174-K1179 HydrophobicContact CD2-CG 4.35Å; L1174-K1179 PolarHBondContact O-N 3.1Å; A1177-K1179 PolarHBondContact O-N 3.04Å; K1179-L1233 HydrophobicContact CD-CB 4.35Å; K1179-L1233 WeakPolarHBondContact CE-O 3.44Å; K1179-L1233 PolarHBondContact NZ-O 2.75Å; K1179-E1234 PolarHBondContact NZ-O 2.72Å; K1179-F1236 WeakPolarHBondContact CE-O 3.49Å; K1179-F1236 PolarHBondContact NZ-O 3.38Å; K1179-V1238 HydrophobicContact CG-CG2 4.13Å
1180	E	90.6	Very high	90.6	Very high	140 Å²	140	73.4 Å²	73.4	65%	0.654	42%	0.416	S	S	*	.			trans	-61.2	136.9	175.8	-171.1	176.4	-160.7	0	0	111.6	I1182	E1180-I1182 HydrophobicContact CG-CG1 3.9Å
1181	V	92.4	Very high	90.8	Very high	27 Å²	27	74.5 Å²	74.5	16%	0.164	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	106.9	174.6	177.6	0	0	0	0	107.1	L1174 L1205 V1238 E1240	L1174-V1181 HydrophobicContact CB-CG2 4.16Å; L1174-V1181 HydrophobicContact CD1-CG2 4.13Å; V1181-L1205 HydrophobicContact CG1-CD2 3.76Å; V1181-V1238 HydrophobicContact CG1-CG1 4.4Å; V1181-V1238 HydrophobicContact CG2-CB 4.41Å; V1181-V1238 HydrophobicContact CG2-CG1 4.27Å; V1181-E1240 HydrophobicContact CG1-CB 3.77Å; V1181-E1240 HydrophobicContact CG1-CG 4.43Å; V1181-E1240 WeakPolarHBondContact CG1-OE1 3.42Å
1182	I	93.4	Very high	91	Very high	66 Å²	66	71.5 Å²	71.5	34%	0.338	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	130.2	-171.2	-57.1	-174.6	0	0	0	109.6	E1180 H1184 V1237 V1238 L1239 E1240	E1180-I1182 HydrophobicContact CG-CG1 3.9Å; I1182-H1184 PolarHBondContact O-N 3.2Å; I1182-V1237 HydrophobicContact CD1-CG1 3.72Å; I1182-V1237 HydrophobicContact CG1-CG1 4.31Å; I1182-V1238 PolarHBondContact N-O 2.89Å; I1182-L1239 HydrophobicContact CB-CD2 4.26Å; I1182-L1239 CarbonylContact O-C 3.6Å; I1182-L1239 WeakPolarHBondContact O-CA 3.2Å; I1182-E1240 PolarHBondContact O-N 3.46Å
1183	W	94.7	Very high	91.3	Very high	125 Å²	125	71 Å²	71	47%	0.473	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	119.5	172.7	175.1	-105.5	0	0	0	111	E1240 K1243	W1183-E1240 HydrophobicContact CE3-CG 4.33Å; W1183-E1240 HydrophobicContact CZ3-CG 4.49Å; W1183-K1243 HydrophobicContact CE3-CG 4Å; W1183-K1243 HydrophobicContact CH2-CD 4.44Å; W1183-K1243 HydrophobicContact CH2-CG 3.6Å; W1183-K1243 HydrophobicContact CZ2-CG 4.35Å; W1183-K1243 HydrophobicContact CZ3-CB 4.41Å; W1183-K1243 HydrophobicContact CZ3-CD 4.48Å; W1183-K1243 HydrophobicContact CZ3-CG 3.4Å
1184	H	93.2	Very high	91.7	Very high	95 Å²	95	70.3 Å²	70.3	44%	0.44	40%	0.4	S	S	.	.			trans	-109.6	-37.6	174.1	178.9	-84.9	0	0	0	111.3	I1182 L1239 E1240	I1182-H1184 PolarHBondContact O-N 3.2Å; H1184-L1239 HydrophobicContact CB-CB 3.95Å; H1184-L1239 HydrophobicContact CB-CD2 4.37Å; H1184-E1240 PolarHBondContact N-O 3.41Å
1185	G	92.3	Very high	91.9	Very high	5 Å²	5	70 Å²	70	5%	0.052	40%	0.399	C	S	.	.			trans	69.6	-159.5	-170.4	0	0	0	0	0	112.3	E1240 Q1241	G1185-E1240 PolarHBondContact N-O 3.24Å; G1185-Q1241 CarbonylContact C-O 3.37Å; G1185-Q1241 VanDerWaalsContact CA-O 3.3Å; G1185-Q1241 WeakPolarHBondContact CA-O 3.22Å; G1185-Q1241 WeakPolarHBondContact O-CA 3.17Å
1186	R	91.6	Very high	92.2	Very high	65 Å²	65	68.9 Å²	68.9	25%	0.245	40%	0.395	C	S	.	.			trans	-140.5	152.8	171.4	-56.9	-168.5	76.4	-123.9	10.3	111.8	H1136 E1190 P1191 Q1241 Y1242	H1136-R1186 PolarHBondContact CE1-NH1 2.96Å; R1186-E1190 WeakPolarHBondContact CA-OE2 3.15Å; R1186-E1190 WeakPolarHBondContact CB-OE2 3.44Å; R1186-E1190 IonicContact CZ-OE1 3.68Å; R1186-E1190 IonicContact NE-OE1 3.58Å; R1186-E1190 PolarHBondContact NE-OE1 2.66Å; R1186-E1190 VanDerWaalsContact NE-OE1 3.1Å; R1186-E1190 VanDerWaalsContact NH2-C 3.33Å; R1186-E1190 PolarHBondContact NH2-O 2.74Å; R1186-E1190 IonicContact NH2-OE1 3.38Å; R1186-E1190 PolarHBondContact NH2-OE1 3.44Å; R1186-P1191 PolarHBondContact NH2-O 2.78Å; R1186-Q1241 HydrophobicContact CG-CB 3.63Å; R1186-Q1241 HydrophobicContact CG-CG 4.03Å; R1186-Q1241 VanDerWaalsContact NE-NE2 3.14Å; R1186-Y1242 VanDerWaalsContact CD-OH 3.29Å; R1186-Y1242 WeakPolarHBondContact CD-OH 3.26Å
1187	T	90.3	Very high	92.3	Very high	101 Å²	101	69.4 Å²	69.4	62%	0.62	38%	0.384	S	S	*	.			trans	-87.5	164.4	166.6	55.2	0	0	0	0	111.8	E1190	T1187-E1190 PolarHBondContact N-OE2 3.31Å; T1187-E1190 WeakPolarHBondContact O-CB 3.49Å
1188	N	81.7	Confident	92.5	Very high	151 Å²	151	67.6 Å²	67.6	81%	0.807	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	145.2	168.1	-68.7	-9.7	0	0	0	109.8	E1190	N1188-E1190 PolarHBondContact O-N 2.69Å
1189	D	82.1	Confident	92.8	Very high	137 Å²	137	68.3 Å²	68.3	73%	0.733	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.7	14.7	-178.7	-48.2	-41.4	0	0	0	115.3	G987	G987-D1189 WeakPolarHBondContact O-CA 3.27Å
1190	E	92.3	Very high	93	Very high	18 Å²	18	67.9 Å²	67.9	8%	0.084	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-62.1	132.1	175.4	-169.2	-168.5	118.6	0	0	110.3	R1186 T1187 N1188 H1193 Q1241	R1186-E1190 WeakPolarHBondContact CA-OE2 3.15Å; R1186-E1190 WeakPolarHBondContact CB-OE2 3.44Å; R1186-E1190 IonicContact CZ-OE1 3.68Å; R1186-E1190 IonicContact NE-OE1 3.58Å; R1186-E1190 PolarHBondContact NE-OE1 2.66Å; R1186-E1190 VanDerWaalsContact NE-OE1 3.1Å; R1186-E1190 VanDerWaalsContact NH2-C 3.33Å; R1186-E1190 PolarHBondContact NH2-O 2.74Å; R1186-E1190 IonicContact NH2-OE1 3.38Å; R1186-E1190 PolarHBondContact NH2-OE1 3.44Å; T1187-E1190 PolarHBondContact N-OE2 3.31Å; T1187-E1190 WeakPolarHBondContact O-CB 3.49Å; N1188-E1190 PolarHBondContact O-N 2.69Å; E1190-H1193 IonicContact OE1-CD2 2.64Å; E1190-H1193 IonicContact OE1-CE1 3.1Å; E1190-H1193 IonicContact OE1-NE2 2.69Å; E1190-H1193 PolarHBondContact OE1-NE2 3.13Å; E1190-Q1241 PolarHBondContact OE1-NE2 3.25Å
1191	P	94.2	Very high	93.3	Very high	67 Å²	67	61.9 Å²	61.9	44%	0.435	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-69.1	162.3	177.7	29.6	-36.1	0	0	0	112.6	R1186	R1186-P1191 PolarHBondContact NH2-O 2.78Å
1192	A	95.9	Very high	93.6	Very high	11 Å²	11	61 Å²	61	9%	0.091	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-72.1	140.9	167.4	0	0	0	0	0	110.2	H988 P1133 H1136 Y1194	H988-A1192 PolarHBondContact CE1-N 3.27Å; H988-A1192 PolarHBondContact NE2-N 3.2Å; P1133-A1192 HydrophobicContact CB-CB 3.31Å; P1133-A1192 HydrophobicContact CG-CB 3.48Å; P1133-A1192 VanDerWaalsContact CG-CB 3.48Å; H1136-A1192 HydrophobicContact CB-CB 4.13Å; A1192-Y1194 HydrophobicContact CB-CE2 4.43Å; A1192-Y1194 WeakPolarHBondContact O-CD2 3.3Å; A1192-Y1194 WeakPolarHBondContact O-CE2 3.24Å
1193	H	96.1	Very high	93.7	Very high	43 Å²	43	59.6 Å²	59.6	20%	0.199	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	152.2	-178.5	-61.2	-69.8	0	0	0	112	E1190 V1202 L1206 V1220 Q1241	E1190-H1193 IonicContact OE1-CD2 2.64Å; E1190-H1193 IonicContact OE1-CE1 3.1Å; E1190-H1193 IonicContact OE1-NE2 2.69Å; E1190-H1193 PolarHBondContact OE1-NE2 3.13Å; H1193-V1202 PolarHBondContact O-N 3.04Å; H1193-L1206 HydrophobicContact CB-CD2 3.94Å; H1193-V1220 HydrophobicContact CB-CB 4.47Å; H1193-V1220 HydrophobicContact CB-CG1 4.05Å; H1193-V1220 HydrophobicContact CB-CG2 4.25Å; H1193-Q1241 PolarHBondContact CD2-NE2 3.02Å; H1193-Q1241 PolarHBondContact NE2-NE2 2.74Å
1194	Y	97.1	Very high	93.7	Very high	42 Å²	42	53.6 Å²	53.6	17%	0.165	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	147.8	-179.3	-67.6	-94.5	0	0	0	109.8	K1129 S1130 P1131 A1192 S1196 E1199 V1200 E1201	K1129-Y1194 HydrophobicContact CG-CD1 4.23Å; K1129-Y1194 HydrophobicContact CG-CE1 4.15Å; S1130-Y1194 WeakPolarHBondContact O-CE1 3.47Å; S1130-Y1194 PolarHBondContact O-OH 2.88Å; P1131-Y1194 PolarHBondContact O-OH 3.49Å; A1192-Y1194 HydrophobicContact CB-CE2 4.43Å; A1192-Y1194 WeakPolarHBondContact O-CD2 3.3Å; A1192-Y1194 WeakPolarHBondContact O-CE2 3.24Å; Y1194-S1196 PolarHBondContact O-N 2.91Å; Y1194-E1199 WeakPolarHBondContact CD1-O 3.44Å; Y1194-V1200 CarbonylContact C-O 3.37Å; Y1194-V1200 VanDerWaalsContact CA-O 3.3Å; Y1194-V1200 WeakPolarHBondContact CA-O 2.98Å; Y1194-E1201 HydrophobicContact CD1-CB 4.4Å; Y1194-E1201 HydrophobicContact CE1-CB 4.23Å
1195	C	97	Very high	93.9	Very high	1 Å²	1	49.3 Å²	49.3	1%	0.007	27%	0.268	C	S	.	.			trans	-71.1	120.7	177.3	178.8	0	0	0	0	110.7	I1197 C1198 E1199 V1200 V1202 V1220 C1222	C1195-I1197 PolarHBondContact O-N 2.72Å; C1195-C1198 PolarHBondContact O-N 2.94Å; C1195-E1199 WeakPolarHBondContact O-CA 3.42Å; C1195-E1199 PolarHBondContact O-N 2.86Å; C1195-V1200 HydrophobicContact CB-CG1 3.91Å; C1195-V1200 PolarHBondContact N-O 2.87Å; C1195-V1202 HydrophobicContact CB-CG2 3.87Å; C1195-V1220 WeakPolarHBondContact CA-O 3.47Å; C1195-C1222 HydrophobicContact CB-CB 3.98Å; C1195-C1222 PolarHBondContact SG-N 3.49Å
1196	S	95.1	Very high	94.1	Very high	67 Å²	67	49.2 Å²	49.2	47%	0.469	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-27	179	58	0	0	0	0	114.8	Y1194 I1219 V1220 H1221	Y1194-S1196 PolarHBondContact O-N 2.91Å; S1196-I1219 WeakPolarHBondContact OG-CG2 3.41Å; S1196-V1220 PolarHBondContact N-O 3.44Å; S1196-V1220 PolarHBondContact OG-O 3.41Å; S1196-H1221 PolarHBondContact OG-CE1 3.32Å; S1196-H1221 PolarHBondContact OG-ND1 3.08Å
1197	I	94.4	Very high	94.3	Very high	100 Å²	100	46.3 Å²	46.3	51%	0.513	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-30.3	-175.5	-64.7	176.2	0	0	0	113.8	C1195 H1221 C1225	C1195-I1197 PolarHBondContact O-N 2.72Å; I1197-H1221 WeakPolarHBondContact CD1-ND1 3.39Å; I1197-C1225 HydrophobicContact CB-CB 4.33Å; I1197-C1225 HydrophobicContact CD1-CB 4.28Å
1198	C	94.8	Very high	94.4	Very high	43 Å²	43	41.6 Å²	41.6	29%	0.291	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-140.8	7.2	-170	66.7	0	0	0	0	114.9	C1195 V1200	C1195-C1198 PolarHBondContact O-N 2.94Å; C1198-V1200 PolarHBondContact O-N 3.29Å
1199	E	96.8	Very high	94.8	Very high	85 Å²	85	35.6 Å²	35.6	40%	0.397	20%	0.195	S	C	.	.			trans	53.4	17.9	174.4	-54.2	-151.3	94.1	0	0	116.8	K1129 Y1194 C1195	K1129-E1199 HydrophobicContact CB-CB 3.8Å; K1129-E1199 HydrophobicContact CB-CG 4.49Å; K1129-E1199 VanDerWaalsContact CD-OE1 3.31Å; K1129-E1199 WeakPolarHBondContact CD-OE1 3.4Å; K1129-E1199 HydrophobicContact CG-CB 4.04Å; K1129-E1199 IonicContact NZ-OE1 3.81Å; K1129-E1199 PolarHBondContact NZ-OE1 3.3Å; Y1194-E1199 WeakPolarHBondContact CD1-O 3.44Å; C1195-E1199 WeakPolarHBondContact O-CA 3.42Å; C1195-E1199 PolarHBondContact O-N 2.86Å
1200	V	96.6	Very high	94.2	Very high	36 Å²	36	34.9 Å²	34.9	22%	0.218	19%	0.191	C	C	.	.			trans	-70.9	141.4	167.8	72.5	0	0	0	0	110.3	K1124 Y1194 C1195 C1198 V1202 C1222	K1124-V1200 HydrophobicContact CD-CG2 4.01Å; K1124-V1200 HydrophobicContact CG-CG2 3.97Å; Y1194-V1200 CarbonylContact C-O 3.37Å; Y1194-V1200 VanDerWaalsContact CA-O 3.3Å; Y1194-V1200 WeakPolarHBondContact CA-O 2.98Å; C1195-V1200 HydrophobicContact CB-CG1 3.91Å; C1195-V1200 PolarHBondContact N-O 2.87Å; C1198-V1200 PolarHBondContact O-N 3.29Å; V1200-V1202 PolarHBondContact O-N 3.24Å; V1200-C1222 HydrophobicContact CG1-CB 3.76Å
1201	E	97.8	Very high	92.7	Very high	15 Å²	15	39.9 Å²	39.9	7%	0.07	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.4	131.3	169	-177.6	-173.3	-179	0	0	110.1	Y1120 P1133 M1134 V1135 H1136 Y1194	Y1120-E1201 HydrophobicContact CE2-CB 4.25Å; Y1120-E1201 WeakPolarHBondContact CE2-OE2 3.45Å; Y1120-E1201 PolarHBondContact OH-OE2 2.96Å; P1133-E1201 HydrophobicContact CB-CG 4.09Å; P1133-E1201 WeakPolarHBondContact CB-OE1 3.38Å; M1134-E1201 PolarHBondContact N-OE2 3.46Å; V1135-E1201 WeakPolarHBondContact CB-OE1 3.48Å; V1135-E1201 PolarHBondContact N-OE1 3.28Å; V1135-E1201 PolarHBondContact N-OE2 2.88Å; V1135-E1201 VanDerWaalsContact N-OE2 3.1Å; H1136-E1201 WeakPolarHBondContact CB-OE1 3.41Å; H1136-E1201 PolarHBondContact N-OE1 3.24Å; Y1194-E1201 HydrophobicContact CD1-CB 4.4Å; Y1194-E1201 HydrophobicContact CE1-CB 4.23Å
1202	V	97.4	Very high	90.4	Very high	9 Å²	9	39.7 Å²	39.7	6%	0.055	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	97	177.4	-174.3	0	0	0	0	107.8	H1193 C1195 V1200 L1205 L1206 V1220 C1222	H1193-V1202 PolarHBondContact O-N 3.04Å; C1195-V1202 HydrophobicContact CB-CG2 3.87Å; V1200-V1202 PolarHBondContact O-N 3.24Å; V1202-L1205 VanDerWaalsContact CG1-O 3.28Å; V1202-L1205 WeakPolarHBondContact CG1-O 3.3Å; V1202-L1206 HydrophobicContact CB-CD2 4.33Å; V1202-L1206 HydrophobicContact CG1-CD2 3.89Å; V1202-L1206 WeakPolarHBondContact O-CD2 3.18Å; V1202-V1220 HydrophobicContact CB-CG1 3.98Å; V1202-V1220 HydrophobicContact CG1-CG1 4.06Å; V1202-V1220 HydrophobicContact CG2-CG1 4.11Å; V1202-C1222 HydrophobicContact CG2-CB 3.88Å
1203	F	96.3	Very high	88.1	Confident	35 Å²	35	47.9 Å²	47.9	15%	0.154	26%	0.258	C	S	.	.			trans	-92	130	-177.3	-178.5	-97.1	0	0	0	111.9	V1135 H1136 W1139 I1163 L1205 Y1242 L1247	V1135-F1203 HydrophobicContact CB-CB 4.4Å; V1135-F1203 HydrophobicContact CB-CG 4.45Å; V1135-F1203 HydrophobicContact CG1-CB 3.8Å; V1135-F1203 HydrophobicContact CG1-CD1 3.79Å; V1135-F1203 HydrophobicContact CG1-CD2 3.76Å; V1135-F1203 HydrophobicContact CG1-CE1 4.31Å; V1135-F1203 HydrophobicContact CG1-CE2 4.28Å; V1135-F1203 HydrophobicContact CG1-CG 3.48Å; V1135-F1203 VanDerWaalsContact CG1-CG 3.48Å; H1136-F1203 HydrophobicContact CB-CD2 4.36Å; W1139-F1203 HydrophobicContact CB-CE2 4.45Å; W1139-F1203 HydrophobicContact CB-CZ 4.31Å; W1139-F1203 AromaticContact CD1-CE1 3.65Å; W1139-F1203 AromaticContact CD1-CE2 3.64Å; W1139-F1203 AromaticContact CD1-CZ 3.17Å; W1139-F1203 HydrophobicContact CD2-CZ 4.25Å; W1139-F1203 HydrophobicContact CG-CE1 4.41Å; W1139-F1203 HydrophobicContact CG-CE2 4.19Å; W1139-F1203 AromaticContact CG-CZ 3.67Å; W1139-F1203 HydrophobicContact CG-CZ 3.67Å; W1139-F1203 AromaticContact NE1-CE1 3.48Å; W1139-F1203 AromaticContact NE1-CZ 3.51Å; I1163-F1203 HydrophobicContact CG2-CD1 3.88Å; I1163-F1203 HydrophobicContact CG2-CE1 4.06Å; F1203-L1205 VanDerWaalsContact C-N 3.28Å; F1203-L1205 PolarHBondContact O-N 2.68Å; F1203-Y1242 HydrophobicContact CE2-CD2 4.23Å; F1203-Y1242 AromaticContact CE2-CE2 3.7Å; F1203-Y1242 HydrophobicContact CE2-CE2 3.7Å; F1203-Y1242 AromaticContact CZ-CD2 3.93Å; F1203-Y1242 HydrophobicContact CZ-CD2 3.93Å; F1203-Y1242 AromaticContact CZ-CE2 3.84Å; F1203-Y1242 HydrophobicContact CZ-CE2 3.84Å; F1203-L1247 HydrophobicContact CE1-CD1 4.26Å; F1203-L1247 HydrophobicContact CZ-CD2 4.5Å
1204	N	95.9	Very high	86	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	28%	0.284	C	S	.	.	S	Bend	trans	66.2	-58.8	174.7	-160.1	11	0	0	0	117.1	Y1167 L1239 Q1241 Y1242	Y1167-N1204 WeakPolarHBondContact CE1-ND2 3.45Å; Y1167-N1204 WeakPolarHBondContact CE2-ND2 3.4Å; Y1167-N1204 PolarHBondContact OH-ND2 3.39Å; N1204-L1239 VanDerWaalsContact O-O 3.08Å; N1204-Q1241 PolarHBondContact O-N 2.89Å; N1204-Q1241 VanDerWaalsContact O-N 3.16Å; N1204-Q1241 WeakPolarHBondContact OD1-CA 3.48Å; N1204-Q1241 PolarHBondContact OD1-N 3.24Å; N1204-Y1242 HydrophobicContact CB-CD2 4.25Å; N1204-Y1242 PolarHBondContact ND2-O 3.1Å; N1204-Y1242 PolarHBondContact OD1-N 3.01Å; N1204-Y1242 PolarHBondContact OD1-O 3.39Å
1205	L	96.1	Very high	83.7	Confident	5 Å²	5	56.6 Å²	56.6	3%	0.026	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	99.9	179.4	-70	178.6	0	0	0	110.6	Y1167 L1170 R1171 L1174 V1181 V1202 F1203 F1207 V1238 L1239 E1240	Y1167-L1205 HydrophobicContact CD2-CD1 3.68Å; Y1167-L1205 HydrophobicContact CD2-CG 3.82Å; Y1167-L1205 HydrophobicContact CE2-CD1 3.77Å; Y1167-L1205 HydrophobicContact CE2-CD2 3.97Å; Y1167-L1205 HydrophobicContact CE2-CG 3.65Å; L1170-L1205 HydrophobicContact CB-CD1 4.42Å; L1170-L1205 HydrophobicContact CD2-CD1 3.94Å; L1170-L1205 HydrophobicContact CG-CD1 3.9Å; R1171-L1205 HydrophobicContact CB-CD1 4.44Å; L1174-L1205 HydrophobicContact CD1-CD1 4.05Å; V1181-L1205 HydrophobicContact CG1-CD2 3.76Å; V1202-L1205 VanDerWaalsContact CG1-O 3.28Å; V1202-L1205 WeakPolarHBondContact CG1-O 3.3Å; F1203-L1205 VanDerWaalsContact C-N 3.28Å; F1203-L1205 PolarHBondContact O-N 2.68Å; L1205-F1207 HydrophobicContact CB-CE2 4.26Å; L1205-V1238 HydrophobicContact CB-CG1 4.38Å; L1205-V1238 HydrophobicContact CD2-CG1 3.99Å; L1205-L1239 WeakPolarHBondContact CA-O 3.09Å; L1205-E1240 HydrophobicContact CD2-CB 4.12Å; L1205-E1240 HydrophobicContact CD2-CG 4.32Å
1206	L	95.9	Very high	81.8	Confident	3 Å²	3	66 Å²	66	2%	0.016	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	124	179.3	-41.1	-178.3	0	0	0	109.4	H1193 V1202 V1208 V1220 V1238 L1239 Q1241	H1193-L1206 HydrophobicContact CB-CD2 3.94Å; V1202-L1206 HydrophobicContact CB-CD2 4.33Å; V1202-L1206 HydrophobicContact CG1-CD2 3.89Å; V1202-L1206 WeakPolarHBondContact O-CD2 3.18Å; L1206-V1208 HydrophobicContact CB-CG1 4.13Å; L1206-V1220 HydrophobicContact CB-CG1 4.15Å; L1206-V1220 HydrophobicContact CB-CG2 4.47Å; L1206-V1220 HydrophobicContact CD1-CG2 4.34Å; L1206-V1220 HydrophobicContact CD2-CG1 4.25Å; L1206-V1238 WeakPolarHBondContact O-CA 3.3Å; L1206-L1239 HydrophobicContact CB-CB 4.23Å; L1206-L1239 PolarHBondContact N-O 3Å; L1206-L1239 PolarHBondContact O-N 2.54Å; L1206-Q1241 HydrophobicContact CD1-CG 4.13Å; L1206-Q1241 HydrophobicContact CG-CG 4.22Å
1207	F	96.2	Very high	80.4	Confident	3 Å²	3	66.1 Å²	66.1	1%	0.013	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	107	174.1	-62.2	-101.3	0	0	0	107.6	L1170 L1174 L1205 H1221 H1223 A1226 L1233 F1236 V1238	L1170-F1207 HydrophobicContact CD1-CZ 4.42Å; L1170-F1207 HydrophobicContact CD2-CE2 4.31Å; L1170-F1207 HydrophobicContact CD2-CZ 4.2Å; L1174-F1207 HydrophobicContact CD1-CE1 4.31Å; L1174-F1207 HydrophobicContact CD1-CZ 4.08Å; L1174-F1207 HydrophobicContact CD2-CE1 4.08Å; L1205-F1207 HydrophobicContact CB-CE2 4.26Å; F1207-H1221 HydrophobicContact CB-CB 4.46Å; F1207-H1221 WeakPolarHBondContact CB-O 3.5Å; F1207-H1221 PolarHBondContact N-O 3.34Å; F1207-H1221 WeakPolarHBondContact O-CB 3.36Å; F1207-H1221 PolarHBondContact O-N 2.96Å; F1207-H1223 HydrophobicContact CD2-CB 4.24Å; F1207-H1223 HydrophobicContact CE1-CB 4.39Å; F1207-H1223 HydrophobicContact CE2-CB 3.63Å; F1207-H1223 HydrophobicContact CZ-CB 3.72Å; F1207-H1223 AromaticContact CZ-CD2 3.99Å; F1207-A1226 HydrophobicContact CB-CB 3.73Å; F1207-A1226 HydrophobicContact CD1-CB 4.15Å; F1207-A1226 HydrophobicContact CG-CB 4.08Å; F1207-L1233 HydrophobicContact CD1-CD1 4.01Å; F1207-L1233 HydrophobicContact CD1-CD2 4.16Å; F1207-L1233 HydrophobicContact CE1-CD1 3.7Å; F1207-F1236 HydrophobicContact CB-CD1 4.05Å; F1207-V1238 HydrophobicContact CD1-CG2 3.87Å; F1207-V1238 HydrophobicContact CE1-CG1 4.4Å; F1207-V1238 HydrophobicContact CE1-CG2 3.83Å; F1207-V1238 HydrophobicContact CZ-CG1 4.48Å
1208	V	94	Very high	79.8	Confident	2 Å²	2	67.2 Å²	67.2	1%	0.012	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	141.5	-172.7	-56.8	0	0	0	0	113.3	L1206 Y1218 I1219 V1220 F1236 V1237 L1239	L1206-V1208 HydrophobicContact CB-CG1 4.13Å; V1208-Y1218 HydrophobicContact CB-CD1 4.08Å; V1208-Y1218 HydrophobicContact CB-CG 4.44Å; V1208-Y1218 HydrophobicContact CG2-CD1 3.6Å; V1208-Y1218 HydrophobicContact CG2-CE1 4.24Å; V1208-Y1218 HydrophobicContact CG2-CG 4.23Å; V1208-I1219 VanDerWaalsContact CA-O 3.27Å; V1208-I1219 WeakPolarHBondContact CA-O 3.42Å; V1208-V1220 HydrophobicContact CG1-CG2 4Å; V1208-F1236 CarbonylContact O-C 3.52Å; V1208-F1236 WeakPolarHBondContact O-CA 3.29Å; V1208-V1237 HydrophobicContact CG2-CB 3.85Å; V1208-V1237 HydrophobicContact CG2-CG1 4.44Å; V1208-V1237 PolarHBondContact N-O 3.48Å; V1208-V1237 PolarHBondContact O-N 2.75Å; V1208-L1239 HydrophobicContact CG1-CD1 3.99Å; V1208-L1239 HydrophobicContact CG2-CD1 3.8Å; V1208-L1239 HydrophobicContact CG2-CG 3.98Å
1209	T	88.4	Confident	79.6	Confident	26 Å²	26	67.2 Å²	67.2	16%	0.16	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	156.4	164	54.7	0	0	0	0	109.9	I1219 F1236	T1209-I1219 PolarHBondContact N-O 3.11Å; T1209-I1219 PolarHBondContact O-N 3.24Å; T1209-F1236 HydrophobicContact CG2-CD1 3.8Å; T1209-F1236 HydrophobicContact CG2-CE1 3.49Å; T1209-F1236 VanDerWaalsContact CG2-CE1 3.49Å; T1209-F1236 HydrophobicContact CG2-CE2 4.34Å; T1209-F1236 HydrophobicContact CG2-CG 4.36Å; T1209-F1236 HydrophobicContact CG2-CZ 3.77Å
1210	N	70.9	Confident	79.5	Confident	121 Å²	121	64.1 Å²	64.1	65%	0.647	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.2	129.6	157.5	-68.3	-24.4	0	0	0	107.8	Y1218	N1210-Y1218 WeakPolarHBondContact OD1-CE1 3.41Å
1211	E	59	Low	79.5	Confident	123 Å²	123	63.2 Å²	63.2	58%	0.575	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.7	132.6	168.3	-161.5	165.4	-101.6	0	0	110	T1217 I1219	E1211-T1217 PolarHBondContact O-OG1 3.47Å; E1211-I1219 HydrophobicContact CB-CD1 3.74Å; E1211-I1219 HydrophobicContact CB-CG1 4.45Å; E1211-I1219 HydrophobicContact CG-CD1 4.32Å; E1211-I1219 WeakPolarHBondContact OE2-CD1 3.42Å
1212	S	47.5	Very low	79.4	Confident	63 Å²	63	63.3 Å²	63.3	44%	0.441	33%	0.325	S	S	.	.			trans	71	142.3	-167.6	86.5	0	0	0	0	116.9	T1214 Q1215	S1212-T1214 VanDerWaalsContact C-N 3.27Å; S1212-T1214 PolarHBondContact O-N 2.84Å; S1212-Q1215 PolarHBondContact OG-N 3.02Å
1213	N	47.8	Very low	79.3	Confident	184 Å²	184	65.1 Å²	65.1	98%	0.984	33%	0.333	S	S	*	.	S	Bend	trans	-84.1	4.6	173.2	-82.7	-15.9	0	0	0	113.2
1214	T	50.6	Low	79.3	Confident	124 Å²	124	68.4 Å²	68.4	76%	0.761	35%	0.352	S	S	*	.	S	Bend	trans	-116	-23.1	-166.6	44	0	0	0	0	114.3	S1212	S1212-T1214 VanDerWaalsContact C-N 3.27Å; S1212-T1214 PolarHBondContact O-N 2.84Å
1215	Q	48.9	Very low	79.3	Confident	143 Å²	143	68.8 Å²	68.8	67%	0.668	36%	0.355	S	S	*	.	S	Bend	trans	-139.7	145	170.5	-72.7	-174	-21.9	0	0	111.3	S1212 T1217	S1212-Q1215 PolarHBondContact OG-N 3.02Å; Q1215-T1217 HydrophobicContact CB-CG2 4.46Å; Q1215-T1217 PolarHBondContact O-N 3.4Å
1216	K	56.7	Low	79.2	Confident	198 Å²	198	68.6 Å²	68.6	86%	0.861	35%	0.353	S	S	*	.			trans	-78.9	62.8	178.7	-67.9	-173.5	178.3	-177.8	0	111.8
1217	T	67	Low	79.2	Confident	71 Å²	71	74.3 Å²	74.3	44%	0.436	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	106.4	176.8	42.8	0	0	0	0	110.9	E1211 Q1215	E1211-T1217 PolarHBondContact O-OG1 3.47Å; Q1215-T1217 HydrophobicContact CB-CG2 4.46Å; Q1215-T1217 PolarHBondContact O-N 3.4Å
1218	Y	81.1	Confident	79.1	Confident	123 Å²	123	82.4 Å²	82.4	48%	0.482	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	124	171.9	-68.1	-69.8	0	0	0	110.6	V1208 N1210	V1208-Y1218 HydrophobicContact CB-CD1 4.08Å; V1208-Y1218 HydrophobicContact CB-CG 4.44Å; V1208-Y1218 HydrophobicContact CG2-CD1 3.6Å; V1208-Y1218 HydrophobicContact CG2-CE1 4.24Å; V1208-Y1218 HydrophobicContact CG2-CG 4.23Å; N1210-Y1218 WeakPolarHBondContact OD1-CE1 3.41Å
1219	I	90.3	Very high	79	Confident	43 Å²	43	86.9 Å²	86.9	22%	0.221	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	122.3	175.8	-59.5	-178.3	0	0	0	108.9	S1196 V1208 T1209 E1211 H1221	S1196-I1219 WeakPolarHBondContact OG-CG2 3.41Å; V1208-I1219 VanDerWaalsContact CA-O 3.27Å; V1208-I1219 WeakPolarHBondContact CA-O 3.42Å; T1209-I1219 PolarHBondContact N-O 3.11Å; T1209-I1219 PolarHBondContact O-N 3.24Å; E1211-I1219 HydrophobicContact CB-CD1 3.74Å; E1211-I1219 HydrophobicContact CB-CG1 4.45Å; E1211-I1219 HydrophobicContact CG-CD1 4.32Å; E1211-I1219 WeakPolarHBondContact OE2-CD1 3.42Å; I1219-H1221 PolarHBondContact O-CD2 3.45Å; I1219-H1221 VanDerWaalsContact O-CD2 3.26Å
1220	V	95.1	Very high	79.1	Confident	20 Å²	20	86.4 Å²	86.4	12%	0.121	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	131.1	-178.9	-179.1	0	0	0	0	111.8	H1193 C1195 S1196 V1202 L1206 V1208	H1193-V1220 HydrophobicContact CB-CB 4.47Å; H1193-V1220 HydrophobicContact CB-CG1 4.05Å; H1193-V1220 HydrophobicContact CB-CG2 4.25Å; C1195-V1220 WeakPolarHBondContact CA-O 3.47Å; S1196-V1220 PolarHBondContact N-O 3.44Å; S1196-V1220 PolarHBondContact OG-O 3.41Å; V1202-V1220 HydrophobicContact CB-CG1 3.98Å; V1202-V1220 HydrophobicContact CG1-CG1 4.06Å; V1202-V1220 HydrophobicContact CG2-CG1 4.11Å; L1206-V1220 HydrophobicContact CB-CG1 4.15Å; L1206-V1220 HydrophobicContact CB-CG2 4.47Å; L1206-V1220 HydrophobicContact CD1-CG2 4.34Å; L1206-V1220 HydrophobicContact CD2-CG1 4.25Å; V1208-V1220 HydrophobicContact CG1-CG2 4Å
1221	H	96.6	Very high	80	Confident	16 Å²	16	89.1 Å²	89.1	7%	0.074	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	156.7	170.9	-57.4	-97.9	0	0	0	110.7	S1196 I1197 F1207 I1219 A1226 F1236	S1196-H1221 PolarHBondContact OG-CE1 3.32Å; S1196-H1221 PolarHBondContact OG-ND1 3.08Å; I1197-H1221 WeakPolarHBondContact CD1-ND1 3.39Å; F1207-H1221 HydrophobicContact CB-CB 4.46Å; F1207-H1221 WeakPolarHBondContact CB-O 3.5Å; F1207-H1221 PolarHBondContact N-O 3.34Å; F1207-H1221 WeakPolarHBondContact O-CB 3.36Å; F1207-H1221 PolarHBondContact O-N 2.96Å; I1219-H1221 PolarHBondContact O-CD2 3.45Å; I1219-H1221 VanDerWaalsContact O-CD2 3.26Å; H1221-A1226 HydrophobicContact CB-CB 4.33Å; H1221-F1236 HydrophobicContact CB-CE1 4.14Å; H1221-F1236 AromaticContact CD2-CE1 3.68Å; H1221-F1236 AromaticContact CG-CE1 3.94Å
1222	C	96.3	Very high	81.4	Confident	18 Å²	18	86.3 Å²	86.3	12%	0.122	44%	0.436	C	S	.	.			trans	-81.2	158.3	164.4	71.1	0	0	0	0	110.6	C1195 V1200 V1202 D1224 C1225 A1226	C1195-C1222 HydrophobicContact CB-CB 3.98Å; C1195-C1222 PolarHBondContact SG-N 3.49Å; V1200-C1222 HydrophobicContact CG1-CB 3.76Å; V1202-C1222 HydrophobicContact CG2-CB 3.88Å; C1222-D1224 VanDerWaalsContact C-N 3.26Å; C1222-D1224 PolarHBondContact O-N 2.96Å; C1222-C1225 PolarHBondContact O-N 3.32Å; C1222-A1226 WeakPolarHBondContact O-CB 3.46Å; C1222-A1226 PolarHBondContact O-N 3.14Å
1223	H	95.4	Very high	83.5	Confident	47 Å²	47	83.7 Å²	83.7	22%	0.218	42%	0.416	C	S	.	.	H	α-helix	trans	-44.7	-47.8	176.6	166.7	-97.5	0	0	0	113.2	L1170 F1207 A1226 R1227	L1170-H1223 HydrophobicContact CD2-CB 4.42Å; F1207-H1223 HydrophobicContact CD2-CB 4.24Å; F1207-H1223 HydrophobicContact CE1-CB 4.39Å; F1207-H1223 HydrophobicContact CE2-CB 3.63Å; F1207-H1223 HydrophobicContact CZ-CB 3.72Å; F1207-H1223 AromaticContact CZ-CD2 3.99Å; H1223-A1226 PolarHBondContact O-N 3.38Å; H1223-R1227 WeakPolarHBondContact NE2-CD 3.2Å; H1223-R1227 WeakPolarHBondContact O-CB 3.47Å; H1223-R1227 WeakPolarHBondContact O-CG 3.38Å; H1223-R1227 PolarHBondContact O-N 2.93Å
1224	D	95	Very high	85.4	Confident	103 Å²	103	81.6 Å²	81.6	55%	0.551	40%	0.401	S	S	*	.	H	α-helix	trans	-71.8	-35.2	-173	-61.3	-13	0	0	0	112.6	C1222 K1228	C1222-D1224 VanDerWaalsContact C-N 3.26Å; C1222-D1224 PolarHBondContact O-N 2.96Å; D1224-K1228 WeakPolarHBondContact O-CD 3.48Å; D1224-K1228 WeakPolarHBondContact O-CG 3.49Å; D1224-K1228 PolarHBondContact O-N 2.94Å; D1224-K1228 VanDerWaalsContact O-N 3.11Å
1225	C	95.9	Very high	87.1	Confident	9 Å²	9	81.8 Å²	81.8	6%	0.061	40%	0.397	C	S	.	.	H	α-helix	trans	-72.6	-42.3	172.7	-78.8	0	0	0	0	111.1	I1197 C1222 R1227 K1228 T1229	I1197-C1225 HydrophobicContact CB-CB 4.33Å; I1197-C1225 HydrophobicContact CD1-CB 4.28Å; C1222-C1225 PolarHBondContact O-N 3.32Å; C1225-R1227 VanDerWaalsContact C-N 3.31Å; C1225-R1227 PolarHBondContact O-N 3.3Å; C1225-K1228 PolarHBondContact O-N 3Å; C1225-T1229 PolarHBondContact O-N 3.08Å; C1225-T1229 VanDerWaalsContact O-N 3.13Å; C1225-T1229 PolarHBondContact O-OG1 3.16Å
1226	A	95.1	Very high	89.2	Confident	0 Å²	0	75.1 Å²	75.1	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-58.7	-42.5	175.3	0	0	0	0	0	111.8	F1207 H1221 C1222 H1223 T1229 S1230 L1233 F1236	F1207-A1226 HydrophobicContact CB-CB 3.73Å; F1207-A1226 HydrophobicContact CD1-CB 4.15Å; F1207-A1226 HydrophobicContact CG-CB 4.08Å; H1221-A1226 HydrophobicContact CB-CB 4.33Å; C1222-A1226 WeakPolarHBondContact O-CB 3.46Å; C1222-A1226 PolarHBondContact O-N 3.14Å; H1223-A1226 PolarHBondContact O-N 3.38Å; A1226-T1229 PolarHBondContact O-N 3.09Å; A1226-S1230 PolarHBondContact O-N 2.86Å; A1226-L1233 HydrophobicContact CB-CD2 3.52Å; A1226-F1236 HydrophobicContact CB-CD1 3.75Å; A1226-F1236 HydrophobicContact CB-CD2 4.26Å; A1226-F1236 HydrophobicContact CB-CE1 3.51Å; A1226-F1236 HydrophobicContact CB-CE2 4.07Å; A1226-F1236 HydrophobicContact CB-CG 4.12Å; A1226-F1236 HydrophobicContact CB-CZ 3.71Å; A1226-F1236 WeakPolarHBondContact O-CE2 3.32Å
1227	R	94.8	Very high	90.9	Very high	124 Å²	124	68.1 Å²	68.1	47%	0.468	34%	0.339	S	S	.	.	H	α-helix	trans	-75.2	-21.2	177.2	-69.7	-168.4	73.7	-172.9	0.8	115.3	H1223 C1225 S1230 K1231 L1233	H1223-R1227 WeakPolarHBondContact NE2-CD 3.2Å; H1223-R1227 WeakPolarHBondContact O-CB 3.47Å; H1223-R1227 WeakPolarHBondContact O-CG 3.38Å; H1223-R1227 PolarHBondContact O-N 2.93Å; C1225-R1227 VanDerWaalsContact C-N 3.31Å; C1225-R1227 PolarHBondContact O-N 3.3Å; R1227-S1230 WeakPolarHBondContact CA-O 3.48Å; R1227-S1230 CarbonylContact O-C 3.6Å; R1227-K1231 PolarHBondContact NE-O 3.21Å; R1227-K1231 WeakPolarHBondContact O-CA 3.5Å; R1227-L1233 HydrophobicContact CG-CD1 4.12Å; R1227-L1233 HydrophobicContact CG-CD2 3.63Å; R1227-L1233 HydrophobicContact CG-CG 3.84Å
1228	K	94.5	Very high	92.3	Very high	172 Å²	172	64.7 Å²	64.7	75%	0.748	32%	0.319	S	S	*	.	H	α-helix	trans	-69.1	-37.9	166.9	-76.9	164.7	-174.3	174.4	0	111.1	D1224 C1225	D1224-K1228 WeakPolarHBondContact O-CD 3.48Å; D1224-K1228 WeakPolarHBondContact O-CG 3.49Å; D1224-K1228 PolarHBondContact O-N 2.94Å; D1224-K1228 VanDerWaalsContact O-N 3.11Å; C1225-K1228 PolarHBondContact O-N 3Å
1229	T	92	Very high	92.9	Very high	97 Å²	97	59.6 Å²	59.6	60%	0.595	30%	0.3	S	S	*	.	H	α-helix	trans	-76.8	-43.3	176.7	-53.4	0	0	0	0	112.7	C1225 A1226 F1236	C1225-T1229 PolarHBondContact O-N 3.08Å; C1225-T1229 VanDerWaalsContact O-N 3.13Å; C1225-T1229 PolarHBondContact O-OG1 3.16Å; A1226-T1229 PolarHBondContact O-N 3.09Å; T1229-F1236 HydrophobicContact CG2-CE2 4.27Å; T1229-F1236 HydrophobicContact CG2-CZ 4.31Å
1230	S	91.7	Very high	93.2	Very high	16 Å²	16	58 Å²	58	11%	0.112	29%	0.291	C	S	.	.			trans	-141.5	106.7	178.5	177.8	0	0	0	0	110.3	A1226 R1227 S1232 L1233 E1234	A1226-S1230 PolarHBondContact O-N 2.86Å; R1227-S1230 WeakPolarHBondContact CA-O 3.48Å; R1227-S1230 CarbonylContact O-C 3.6Å; S1230-S1232 PolarHBondContact O-N 3.48Å; S1230-S1232 VanDerWaalsContact O-N 3.15Å; S1230-L1233 PolarHBondContact O-N 3.15Å; S1230-L1233 PolarHBondContact OG-N 3.24Å; S1230-E1234 PolarHBondContact OG-N 3Å
1231	K	89.4	Confident	93.1	Very high	177 Å²	177	57.4 Å²	57.4	77%	0.77	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-33	-173.7	-69.1	-178.7	179.1	176.3	0	113.9	R1227	R1227-K1231 PolarHBondContact NE-O 3.21Å; R1227-K1231 WeakPolarHBondContact O-CA 3.5Å
1232	S	87.9	Confident	93.1	Very high	65 Å²	65	57.7 Å²	57.7	46%	0.455	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94	-5.8	178.9	44.5	0	0	0	0	113.9	S1230 E1234	S1230-S1232 PolarHBondContact O-N 3.48Å; S1230-S1232 VanDerWaalsContact O-N 3.15Å; S1232-E1234 WeakPolarHBondContact CB-OE1 3.28Å; S1232-E1234 PolarHBondContact O-N 2.83Å; S1232-E1234 VanDerWaalsContact OG-CD 3.25Å; S1232-E1234 PolarHBondContact OG-OE1 2.95Å
1233	L	91.8	Very high	92.9	Very high	7 Å²	7	61.2 Å²	61.2	4%	0.037	30%	0.301	C	S	.	.			trans	58.7	25.8	-175.9	-60.2	171.6	0	0	0	114.4	L1174 K1179 F1207 A1226 R1227 S1230 N1235 F1236	L1174-L1233 HydrophobicContact CD2-CD1 3.83Å; K1179-L1233 HydrophobicContact CD-CB 4.35Å; K1179-L1233 WeakPolarHBondContact CE-O 3.44Å; K1179-L1233 PolarHBondContact NZ-O 2.75Å; F1207-L1233 HydrophobicContact CD1-CD1 4.01Å; F1207-L1233 HydrophobicContact CD1-CD2 4.16Å; F1207-L1233 HydrophobicContact CE1-CD1 3.7Å; A1226-L1233 HydrophobicContact CB-CD2 3.52Å; R1227-L1233 HydrophobicContact CG-CD1 4.12Å; R1227-L1233 HydrophobicContact CG-CD2 3.63Å; R1227-L1233 HydrophobicContact CG-CG 3.84Å; S1230-L1233 PolarHBondContact O-N 3.15Å; S1230-L1233 PolarHBondContact OG-N 3.24Å; L1233-N1235 PolarHBondContact O-N 3.4Å; L1233-F1236 HydrophobicContact CB-CB 4.39Å; L1233-F1236 HydrophobicContact CD2-CB 4.43Å; L1233-F1236 HydrophobicContact CD2-CD2 4.06Å; L1233-F1236 HydrophobicContact CD2-CG 4.26Å; L1233-F1236 PolarHBondContact O-N 2.95Å
1234	E	86.8	Confident	92.7	Very high	140 Å²	140	59.5 Å²	59.5	65%	0.654	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-53.6	-179.2	-79	157	-129.7	0	0	111.9	K1179 S1230 S1232 F1236	K1179-E1234 PolarHBondContact NZ-O 2.72Å; S1230-E1234 PolarHBondContact OG-N 3Å; S1232-E1234 WeakPolarHBondContact CB-OE1 3.28Å; S1232-E1234 PolarHBondContact O-N 2.83Å; S1232-E1234 VanDerWaalsContact OG-CD 3.25Å; S1232-E1234 PolarHBondContact OG-OE1 2.95Å; E1234-F1236 PolarHBondContact O-N 3.19Å; E1234-F1236 VanDerWaalsContact O-N 3.1Å
1235	N	87.6	Confident	92.6	Very high	128 Å²	128	60.5 Å²	60.5	68%	0.684	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	7	-177.4	-62.5	-2.9	0	0	0	114.7	L1233	L1233-N1235 PolarHBondContact O-N 3.4Å
1236	F	92.6	Very high	92.5	Very high	3 Å²	3	63 Å²	63	1%	0.013	31%	0.308	C	S	.	.			trans	-113.2	140.1	-178.6	-72.3	-94.4	0	0	0	111.4	K1179 F1207 V1208 T1209 H1221 A1226 T1229 L1233 E1234	K1179-F1236 WeakPolarHBondContact CE-O 3.49Å; K1179-F1236 PolarHBondContact NZ-O 3.38Å; F1207-F1236 HydrophobicContact CB-CD1 4.05Å; V1208-F1236 CarbonylContact O-C 3.52Å; V1208-F1236 WeakPolarHBondContact O-CA 3.29Å; T1209-F1236 HydrophobicContact CG2-CD1 3.8Å; T1209-F1236 HydrophobicContact CG2-CE1 3.49Å; T1209-F1236 VanDerWaalsContact CG2-CE1 3.49Å; T1209-F1236 HydrophobicContact CG2-CE2 4.34Å; T1209-F1236 HydrophobicContact CG2-CG 4.36Å; T1209-F1236 HydrophobicContact CG2-CZ 3.77Å; H1221-F1236 HydrophobicContact CB-CE1 4.14Å; H1221-F1236 AromaticContact CD2-CE1 3.68Å; H1221-F1236 AromaticContact CG-CE1 3.94Å; A1226-F1236 HydrophobicContact CB-CD1 3.75Å; A1226-F1236 HydrophobicContact CB-CD2 4.26Å; A1226-F1236 HydrophobicContact CB-CE1 3.51Å; A1226-F1236 HydrophobicContact CB-CE2 4.07Å; A1226-F1236 HydrophobicContact CB-CG 4.12Å; A1226-F1236 HydrophobicContact CB-CZ 3.71Å; A1226-F1236 WeakPolarHBondContact O-CE2 3.32Å; T1229-F1236 HydrophobicContact CG2-CE2 4.27Å; T1229-F1236 HydrophobicContact CG2-CZ 4.31Å; L1233-F1236 HydrophobicContact CB-CB 4.39Å; L1233-F1236 HydrophobicContact CD2-CB 4.43Å; L1233-F1236 HydrophobicContact CD2-CD2 4.06Å; L1233-F1236 HydrophobicContact CD2-CG 4.26Å; L1233-F1236 PolarHBondContact O-N 2.95Å; E1234-F1236 PolarHBondContact O-N 3.19Å; E1234-F1236 VanDerWaalsContact O-N 3.1Å
1237	V	92.6	Very high	92.4	Very high	51 Å²	51	63.1 Å²	63.1	31%	0.309	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	142.6	160.4	178.3	0	0	0	0	107.9	I1182 V1208 L1239	I1182-V1237 HydrophobicContact CD1-CG1 3.72Å; I1182-V1237 HydrophobicContact CG1-CG1 4.31Å; V1208-V1237 HydrophobicContact CG2-CB 3.85Å; V1208-V1237 HydrophobicContact CG2-CG1 4.44Å; V1208-V1237 PolarHBondContact N-O 3.48Å; V1208-V1237 PolarHBondContact O-N 2.75Å; V1237-L1239 HydrophobicContact CG1-CD2 3.75Å; V1237-L1239 HydrophobicContact CG1-CG 4.35Å
1238	V	95.1	Very high	92.4	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	120.9	171.3	-171.1	0	0	0	0	108.5	L1174 K1179 V1181 I1182 L1205 L1206 F1207	L1174-V1238 HydrophobicContact CD1-CG1 4.09Å; L1174-V1238 HydrophobicContact CD1-CG2 4.49Å; L1174-V1238 HydrophobicContact CD2-CG2 4.49Å; K1179-V1238 HydrophobicContact CG-CG2 4.13Å; V1181-V1238 HydrophobicContact CG1-CG1 4.4Å; V1181-V1238 HydrophobicContact CG2-CB 4.41Å; V1181-V1238 HydrophobicContact CG2-CG1 4.27Å; I1182-V1238 PolarHBondContact N-O 2.89Å; L1205-V1238 HydrophobicContact CB-CG1 4.38Å; L1205-V1238 HydrophobicContact CD2-CG1 3.99Å; L1206-V1238 WeakPolarHBondContact O-CA 3.3Å; F1207-V1238 HydrophobicContact CD1-CG2 3.87Å; F1207-V1238 HydrophobicContact CE1-CG1 4.4Å; F1207-V1238 HydrophobicContact CE1-CG2 3.83Å; F1207-V1238 HydrophobicContact CZ-CG1 4.48Å
1239	L	94.6	Very high	92.4	Very high	15 Å²	15	55.8 Å²	55.8	8%	0.079	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	137.2	179	-57.7	178	0	0	0	110.5	I1182 H1184 N1204 L1205 L1206 V1208 V1237	I1182-L1239 HydrophobicContact CB-CD2 4.26Å; I1182-L1239 CarbonylContact O-C 3.6Å; I1182-L1239 WeakPolarHBondContact O-CA 3.2Å; H1184-L1239 HydrophobicContact CB-CB 3.95Å; H1184-L1239 HydrophobicContact CB-CD2 4.37Å; N1204-L1239 VanDerWaalsContact O-O 3.08Å; L1205-L1239 WeakPolarHBondContact CA-O 3.09Å; L1206-L1239 HydrophobicContact CB-CB 4.23Å; L1206-L1239 PolarHBondContact N-O 3Å; L1206-L1239 PolarHBondContact O-N 2.54Å; V1208-L1239 HydrophobicContact CG1-CD1 3.99Å; V1208-L1239 HydrophobicContact CG2-CD1 3.8Å; V1208-L1239 HydrophobicContact CG2-CG 3.98Å; V1237-L1239 HydrophobicContact CG1-CD2 3.75Å; V1237-L1239 HydrophobicContact CG1-CG 4.35Å
1240	E	95.5	Very high	92.6	Very high	10 Å²	10	52.1 Å²	52.1	5%	0.047	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	122.5	180	-176.7	164.3	-79.8	0	0	111	Y1167 R1171 V1181 I1182 W1183 H1184 G1185 L1205	Y1167-E1240 VanDerWaalsContact OH-CD 3.22Å; Y1167-E1240 PolarHBondContact OH-OE1 3.16Å; R1171-E1240 IonicContact CZ-OE1 2.76Å; R1171-E1240 IonicContact CZ-OE2 3.21Å; R1171-E1240 IonicContact NE-OE1 3.62Å; R1171-E1240 PolarHBondContact NE-OE1 2.82Å; R1171-E1240 IonicContact NE-OE2 2.7Å; R1171-E1240 IonicContact NH2-OE1 3.24Å; R1171-E1240 PolarHBondContact NH2-OE1 3.49Å; R1171-E1240 IonicContact NH2-OE2 2.76Å; R1171-E1240 PolarHBondContact NH2-OE2 3.1Å; V1181-E1240 HydrophobicContact CG1-CB 3.77Å; V1181-E1240 HydrophobicContact CG1-CG 4.43Å; V1181-E1240 WeakPolarHBondContact CG1-OE1 3.42Å; I1182-E1240 PolarHBondContact O-N 3.46Å; W1183-E1240 HydrophobicContact CE3-CG 4.33Å; W1183-E1240 HydrophobicContact CZ3-CG 4.49Å; H1184-E1240 PolarHBondContact N-O 3.41Å; G1185-E1240 PolarHBondContact N-O 3.24Å; L1205-E1240 HydrophobicContact CD2-CB 4.12Å; L1205-E1240 HydrophobicContact CD2-CG 4.32Å
1241	Q	94.9	Very high	92.8	Very high	8 Å²	8	51.4 Å²	51.4	4%	0.037	26%	0.255	C	S	.	.			trans	-95.3	-29.9	-172.5	-68.3	-172.7	-65	0	0	115	G1185 R1186 E1190 H1193 N1204 L1206	G1185-Q1241 CarbonylContact C-O 3.37Å; G1185-Q1241 VanDerWaalsContact CA-O 3.3Å; G1185-Q1241 WeakPolarHBondContact CA-O 3.22Å; G1185-Q1241 WeakPolarHBondContact O-CA 3.17Å; R1186-Q1241 HydrophobicContact CG-CB 3.63Å; R1186-Q1241 HydrophobicContact CG-CG 4.03Å; R1186-Q1241 VanDerWaalsContact NE-NE2 3.14Å; E1190-Q1241 PolarHBondContact OE1-NE2 3.25Å; H1193-Q1241 PolarHBondContact CD2-NE2 3.02Å; H1193-Q1241 PolarHBondContact NE2-NE2 2.74Å; N1204-Q1241 PolarHBondContact O-N 2.89Å; N1204-Q1241 VanDerWaalsContact O-N 3.16Å; N1204-Q1241 WeakPolarHBondContact OD1-CA 3.48Å; N1204-Q1241 PolarHBondContact OD1-N 3.24Å; L1206-Q1241 HydrophobicContact CD1-CG 4.13Å; L1206-Q1241 HydrophobicContact CG-CG 4.22Å
1242	Y	94.8	Very high	92.9	Very high	22 Å²	22	45.9 Å²	45.9	9%	0.086	23%	0.234	C	C	.	.	S	Bend	trans	-133.9	132.5	-178.1	-60.4	-82.6	0	0	0	109.1	H1136 R1143 Y1167 R1186 F1203 N1204 L1247	H1136-Y1242 PolarHBondContact CE1-OH 3.32Å; H1136-Y1242 VanDerWaalsContact CE1-OH 3.26Å; H1136-Y1242 PolarHBondContact ND1-OH 3.4Å; R1143-Y1242 VanDerWaalsContact NH2-CD1 3.28Å; Y1167-Y1242 PolarHBondContact OH-O 3.05Å; R1186-Y1242 VanDerWaalsContact CD-OH 3.29Å; R1186-Y1242 WeakPolarHBondContact CD-OH 3.26Å; F1203-Y1242 HydrophobicContact CE2-CD2 4.23Å; F1203-Y1242 AromaticContact CE2-CE2 3.7Å; F1203-Y1242 HydrophobicContact CE2-CE2 3.7Å; F1203-Y1242 AromaticContact CZ-CD2 3.93Å; F1203-Y1242 HydrophobicContact CZ-CD2 3.93Å; F1203-Y1242 AromaticContact CZ-CE2 3.84Å; F1203-Y1242 HydrophobicContact CZ-CE2 3.84Å; N1204-Y1242 HydrophobicContact CB-CD2 4.25Å; N1204-Y1242 PolarHBondContact ND2-O 3.1Å; N1204-Y1242 PolarHBondContact OD1-N 3.01Å; N1204-Y1242 PolarHBondContact OD1-O 3.39Å; Y1242-L1247 HydrophobicContact CD1-CD2 4.43Å; Y1242-L1247 HydrophobicContact CG-CD2 4.07Å
1243	K	93.6	Very high	93.3	Very high	92 Å²	92	48.9 Å²	48.9	40%	0.4	24%	0.241	S	C	.	.			trans	-68.8	154.6	177.8	-56.8	-172.8	176	-179.4	0	109.7	W1183 E1245 D1246 L1247	W1183-K1243 HydrophobicContact CE3-CG 4Å; W1183-K1243 HydrophobicContact CH2-CD 4.44Å; W1183-K1243 HydrophobicContact CH2-CG 3.6Å; W1183-K1243 HydrophobicContact CZ2-CG 4.35Å; W1183-K1243 HydrophobicContact CZ3-CB 4.41Å; W1183-K1243 HydrophobicContact CZ3-CD 4.48Å; W1183-K1243 HydrophobicContact CZ3-CG 3.4Å; K1243-E1245 WeakPolarHBondContact CB-OE2 3.49Å; K1243-E1245 PolarHBondContact O-N 3.48Å; K1243-D1246 WeakPolarHBondContact CB-OD2 3.47Å; K1243-D1246 PolarHBondContact N-OD2 3.26Å; K1243-D1246 PolarHBondContact O-N 2.96Å; K1243-L1247 PolarHBondContact O-N 3.08Å
1244	M	90.4	Very high	93.5	Very high	11 Å²	11	48.9 Å²	48.9	5%	0.054	24%	0.24	C	C	.	.	H	α-helix	trans	-60.8	-39.2	177.9	-166	62	64.8	0	0	110.4	L761 L1164 Y1167 Q1168 D1246 L1247 I1248	L761-M1244 HydrophobicContact CD2-CG 4.39Å; L1164-M1244 HydrophobicContact CD1-SD 3.97Å; Y1167-M1244 HydrophobicContact CD1-CE 3.52Å; Y1167-M1244 HydrophobicContact CD1-SD 3.76Å; Y1167-M1244 HydrophobicContact CD2-CE 4.39Å; Y1167-M1244 HydrophobicContact CE1-CE 3.09Å; Y1167-M1244 HydrophobicContact CE1-SD 3.49Å; Y1167-M1244 WeakPolarHBondContact CE1-SD 3.42Å; Y1167-M1244 HydrophobicContact CE2-CE 4.01Å; Y1167-M1244 HydrophobicContact CG-CE 4.16Å; Q1168-M1244 HydrophobicContact CB-CE 4.41Å; Q1168-M1244 PolarHBondContact OE1-SD 3.18Å; M1244-D1246 PolarHBondContact O-N 3.27Å; M1244-L1247 PolarHBondContact O-N 3.37Å; M1244-I1248 HydrophobicContact CG-CD1 3.79Å; M1244-I1248 HydrophobicContact CG-CG1 4.39Å; M1244-I1248 WeakPolarHBondContact O-CB 3.25Å; M1244-I1248 WeakPolarHBondContact O-CD1 3.39Å; M1244-I1248 WeakPolarHBondContact O-CG1 3.17Å; M1244-I1248 PolarHBondContact O-N 2.88Å
1245	E	92.4	Very high	93.8	Very high	123 Å²	123	46.5 Å²	46.5	58%	0.575	24%	0.236	S	C	*	.	H	α-helix	trans	-60.6	-42	178.9	-62.6	66.8	-145.8	0	0	111.8	K1243 I1248 Q1249	K1243-E1245 WeakPolarHBondContact CB-OE2 3.49Å; K1243-E1245 PolarHBondContact O-N 3.48Å; E1245-I1248 PolarHBondContact O-N 3.45Å; E1245-Q1249 WeakPolarHBondContact O-CB 3.48Å; E1245-Q1249 PolarHBondContact O-N 3.41Å
1246	D	93.6	Very high	94	Very high	63 Å²	63	44.1 Å²	44.1	34%	0.337	22%	0.222	S	C	.	.	H	α-helix	trans	-64.9	-42.8	177.7	-50.3	-29.6	0	0	0	111	K1243 M1244 Q1249 V1250	K1243-D1246 WeakPolarHBondContact CB-OD2 3.47Å; K1243-D1246 PolarHBondContact N-OD2 3.26Å; K1243-D1246 PolarHBondContact O-N 2.96Å; M1244-D1246 PolarHBondContact O-N 3.27Å; D1246-Q1249 PolarHBondContact O-N 2.96Å; D1246-V1250 WeakPolarHBondContact O-CB 3.32Å; D1246-V1250 VanDerWaalsContact O-CG2 3.28Å; D1246-V1250 WeakPolarHBondContact O-CG2 3.48Å; D1246-V1250 PolarHBondContact O-N 3.42Å
1247	L	94.4	Very high	94	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-72.2	-36.6	179.3	-62.1	-170.7	0	0	0	112	W1139 L1164 Y1167 F1203 Y1242 K1243 M1244 Y1251	W1139-L1247 HydrophobicContact CD2-CD2 4.01Å; W1139-L1247 HydrophobicContact CE3-CD2 3.76Å; W1139-L1247 HydrophobicContact CH2-CB 3.75Å; W1139-L1247 HydrophobicContact CH2-CD2 4.17Å; W1139-L1247 HydrophobicContact CH2-CG 4.37Å; W1139-L1247 HydrophobicContact CZ2-CB 4.39Å; W1139-L1247 HydrophobicContact CZ2-CD1 4.39Å; W1139-L1247 HydrophobicContact CZ2-CD2 4.39Å; W1139-L1247 HydrophobicContact CZ3-CB 3.93Å; W1139-L1247 HydrophobicContact CZ3-CD2 3.85Å; W1139-L1247 HydrophobicContact CZ3-CG 4.42Å; W1139-L1247 VanDerWaalsContact CZ3-O 3.3Å; W1139-L1247 WeakPolarHBondContact CZ3-O 3.42Å; L1164-L1247 HydrophobicContact CD1-CB 4.05Å; Y1167-L1247 HydrophobicContact CD1-CD1 3.65Å; Y1167-L1247 HydrophobicContact CE1-CD1 3.63Å; F1203-L1247 HydrophobicContact CE1-CD1 4.26Å; F1203-L1247 HydrophobicContact CZ-CD2 4.5Å; Y1242-L1247 HydrophobicContact CD1-CD2 4.43Å; Y1242-L1247 HydrophobicContact CG-CD2 4.07Å; K1243-L1247 PolarHBondContact O-N 3.08Å; M1244-L1247 PolarHBondContact O-N 3.37Å; L1247-Y1251 WeakPolarHBondContact O-CB 3.31Å; L1247-Y1251 PolarHBondContact O-N 3.43Å
1248	I	93.4	Very high	93.6	Very high	35 Å²	35	50.7 Å²	50.7	18%	0.179	26%	0.258	C	S	.	.	H	α-helix	trans	-57.4	-52.7	169.8	-76	162	0	0	0	110.1	S757 L761 M1244 E1245 V1250 Y1251 D1252	S757-I1248 WeakPolarHBondContact OG-CG2 3.46Å; L761-I1248 HydrophobicContact CD1-CD1 3.53Å; L761-I1248 HydrophobicContact CD1-CG1 4.04Å; L761-I1248 HydrophobicContact CD2-CD1 4.36Å; M1244-I1248 HydrophobicContact CG-CD1 3.79Å; M1244-I1248 HydrophobicContact CG-CG1 4.39Å; M1244-I1248 WeakPolarHBondContact O-CB 3.25Å; M1244-I1248 WeakPolarHBondContact O-CD1 3.39Å; M1244-I1248 WeakPolarHBondContact O-CG1 3.17Å; M1244-I1248 PolarHBondContact O-N 2.88Å; E1245-I1248 PolarHBondContact O-N 3.45Å; I1248-V1250 PolarHBondContact O-N 3Å; I1248-Y1251 PolarHBondContact O-N 3.37Å; I1248-D1252 PolarHBondContact O-N 3.15Å
1249	Q	94.9	Very high	92.2	Very high	107 Å²	107	55.7 Å²	55.7	50%	0.5	29%	0.293	S	S	.	.	H	α-helix	trans	-62.5	-46.2	-176.6	-176	175.5	18.5	0	0	111.6	E1245 D1246 D1252 Q1253	E1245-Q1249 WeakPolarHBondContact O-CB 3.48Å; E1245-Q1249 PolarHBondContact O-N 3.41Å; D1246-Q1249 PolarHBondContact O-N 2.96Å; Q1249-D1252 PolarHBondContact O-N 2.97Å; Q1249-Q1253 HydrophobicContact CG-CG 4.32Å; Q1249-Q1253 VanDerWaalsContact O-CB 3.24Å; Q1249-Q1253 WeakPolarHBondContact O-CB 3.47Å; Q1249-Q1253 VanDerWaalsContact O-CG 3.23Å; Q1249-Q1253 WeakPolarHBondContact O-CG 3.44Å; Q1249-Q1253 PolarHBondContact O-N 2.93Å
1250	V	96.4	Very high	89.9	Confident	21 Å²	21	63.2 Å²	63.2	13%	0.127	33%	0.333	C	S	.	.	H	α-helix	trans	-63.4	-40.7	176	170.2	0	0	0	0	111.5	W1139 A1142 R1143 D1246 I1248 F1254	W1139-V1250 HydrophobicContact CE3-CB 4.33Å; W1139-V1250 HydrophobicContact CE3-CG1 3.8Å; W1139-V1250 HydrophobicContact CZ3-CB 4.14Å; W1139-V1250 HydrophobicContact CZ3-CG1 3.97Å; A1142-V1250 HydrophobicContact CB-CG1 3.9Å; R1143-V1250 HydrophobicContact CG-CB 4.41Å; R1143-V1250 HydrophobicContact CG-CG1 3.73Å; R1143-V1250 HydrophobicContact CG-CG2 3.69Å; D1246-V1250 WeakPolarHBondContact O-CB 3.32Å; D1246-V1250 VanDerWaalsContact O-CG2 3.28Å; D1246-V1250 WeakPolarHBondContact O-CG2 3.48Å; D1246-V1250 PolarHBondContact O-N 3.42Å; I1248-V1250 PolarHBondContact O-N 3Å; V1250-F1254 WeakPolarHBondContact O-CB 3.27Å; V1250-F1254 PolarHBondContact O-N 3.28Å
1251	Y	95.8	Very high	86.9	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-62.7	-49.7	177.1	174.1	-96.8	0	0	0	111.7	P755 K1157 L1160 L1161 L1164 L1247 I1248 F1254	P755-Y1251 WeakPolarHBondContact O-CE1 3.45Å; P755-Y1251 PolarHBondContact O-OH 2.99Å; K1157-Y1251 HydrophobicContact CD-CD2 4.3Å; K1157-Y1251 HydrophobicContact CD-CE2 3.79Å; K1157-Y1251 HydrophobicContact CG-CE2 4.21Å; K1157-Y1251 PolarHBondContact NZ-O 2.82Å; L1160-Y1251 HydrophobicContact CB-CD2 3.81Å; L1160-Y1251 HydrophobicContact CB-CE2 4.34Å; L1160-Y1251 HydrophobicContact CD1-CD2 4.41Å; L1161-Y1251 HydrophobicContact CB-CE2 3.87Å; L1164-Y1251 HydrophobicContact CD2-CD1 4.27Å; L1164-Y1251 HydrophobicContact CD2-CG 4.07Å; L1247-Y1251 WeakPolarHBondContact O-CB 3.31Å; L1247-Y1251 PolarHBondContact O-N 3.43Å; I1248-Y1251 PolarHBondContact O-N 3.37Å; Y1251-F1254 PolarHBondContact O-N 3.15Å
1252	D	92.8	Very high	83.9	Confident	62 Å²	62	73.2 Å²	73.2	33%	0.332	41%	0.405	S	S	.	.	H	α-helix	trans	-70.5	-37.3	-177.3	-71.3	-30.8	0	0	0	112.3	S757 I1248 Q1249 F1254	S757-D1252 WeakPolarHBondContact CB-OD1 3.49Å; S757-D1252 WeakPolarHBondContact CB-OD2 3.46Å; S757-D1252 PolarHBondContact N-OD1 3.19Å; S757-D1252 PolarHBondContact OG-OD1 2.97Å; S757-D1252 PolarHBondContact OG-OD2 3.43Å; I1248-D1252 PolarHBondContact O-N 3.15Å; Q1249-D1252 PolarHBondContact O-N 2.97Å; D1252-F1254 VanDerWaalsContact C-N 3.32Å; D1252-F1254 PolarHBondContact O-N 2.95Å
1253	Q	95.4	Very high	80.6	Confident	128 Å²	128	77.1 Å²	77.1	60%	0.598	44%	0.435	S	S	*	.	H	α-helix	trans	-69.7	-25.1	176.1	-72.2	-179	-8	0	0	113.6	Q1249 T1255	Q1249-Q1253 HydrophobicContact CG-CG 4.32Å; Q1249-Q1253 VanDerWaalsContact O-CB 3.24Å; Q1249-Q1253 WeakPolarHBondContact O-CB 3.47Å; Q1249-Q1253 VanDerWaalsContact O-CG 3.23Å; Q1249-Q1253 WeakPolarHBondContact O-CG 3.44Å; Q1249-Q1253 PolarHBondContact O-N 2.93Å; Q1253-T1255 PolarHBondContact O-N 2.93Å; Q1253-T1255 PolarHBondContact O-OG1 3.29Å
1254	F	95.4	Very high	77.5	Confident	7 Å²	7	81.9 Å²	81.9	3%	0.031	48%	0.48	C	S	.	.			trans	-71.2	95.6	175.3	-173.7	-113.9	0	0	0	110.5	A1142 V1147 F1153 I1156 K1157 L1160 V1250 Y1251 D1252	A1142-F1254 HydrophobicContact CB-CB 4.19Å; A1142-F1254 HydrophobicContact CB-CD1 4.45Å; A1142-F1254 HydrophobicContact CB-CD2 3.96Å; A1142-F1254 HydrophobicContact CB-CE2 4.48Å; A1142-F1254 HydrophobicContact CB-CG 3.94Å; V1147-F1254 HydrophobicContact CB-CE2 4.4Å; V1147-F1254 HydrophobicContact CB-CZ 4.25Å; V1147-F1254 HydrophobicContact CG2-CE2 3.99Å; V1147-F1254 HydrophobicContact CG2-CZ 3.97Å; F1153-F1254 HydrophobicContact CD2-CD1 4.03Å; F1153-F1254 AromaticContact CD2-CE1 3.45Å; F1153-F1254 HydrophobicContact CD2-CE1 3.45Å; F1153-F1254 VanDerWaalsContact CD2-CE1 3.45Å; F1153-F1254 HydrophobicContact CD2-CE2 4.39Å; F1153-F1254 AromaticContact CD2-CZ 3.67Å; F1153-F1254 HydrophobicContact CD2-CZ 3.67Å; F1153-F1254 AromaticContact CE2-CD1 3.61Å; F1153-F1254 HydrophobicContact CE2-CD1 3.61Å; F1153-F1254 AromaticContact CE2-CE1 3.53Å; F1153-F1254 HydrophobicContact CE2-CE1 3.53Å; F1153-F1254 HydrophobicContact CE2-CG 4.2Å; F1153-F1254 HydrophobicContact CE2-CZ 4.09Å; F1153-F1254 WeakPolarHBondContact CE2-O 3.31Å; F1153-F1254 HydrophobicContact CG-CE1 4.48Å; I1156-F1254 HydrophobicContact CB-CE1 3.81Å; I1156-F1254 HydrophobicContact CB-CZ 3.98Å; I1156-F1254 HydrophobicContact CD1-CZ 4.02Å; I1156-F1254 HydrophobicContact CG2-CD1 4.35Å; I1156-F1254 HydrophobicContact CG2-CE1 3.55Å; I1156-F1254 HydrophobicContact CG2-CZ 3.73Å; K1157-F1254 HydrophobicContact CB-CD1 4.38Å; K1157-F1254 HydrophobicContact CB-CE1 4.32Å; K1157-F1254 HydrophobicContact CD-CD1 3.94Å; K1157-F1254 PolarHBondContact NZ-O 3.49Å; L1160-F1254 HydrophobicContact CD1-CB 4.39Å; L1160-F1254 HydrophobicContact CD1-CD1 3.76Å; L1160-F1254 HydrophobicContact CD1-CE1 4.41Å; L1160-F1254 HydrophobicContact CD1-CG 4.26Å; V1250-F1254 WeakPolarHBondContact O-CB 3.27Å; V1250-F1254 PolarHBondContact O-N 3.28Å; Y1251-F1254 PolarHBondContact O-N 3.15Å; D1252-F1254 VanDerWaalsContact C-N 3.32Å; D1252-F1254 PolarHBondContact O-N 2.95Å
1255	T	93.5	Very high	76.8	Confident	90 Å²	90	85.5 Å²	85.5	55%	0.552	50%	0.502	S	S	*	.			trans	-122.8	152.2	-177.6	53.9	0	0	0	0	111.5	Q1253 A1257	Q1253-T1255 PolarHBondContact O-N 2.93Å; Q1253-T1255 PolarHBondContact O-OG1 3.29Å; T1255-A1257 PolarHBondContact O-N 3.16Å
1256	L	92.8	Very high	76	Confident	78 Å²	78	83.5 Å²	83.5	41%	0.408	50%	0.498	S	S	.	.	P	Polyproline II helix	trans	-58.8	121	177.1	-178.5	63.4	0	0	0	110.4	P1150 F1153	P1150-L1256 HydrophobicContact CB-CD1 4.44Å; P1150-L1256 HydrophobicContact CB-CD2 4.35Å; P1150-L1256 HydrophobicContact CG-CD1 4.38Å; P1150-L1256 HydrophobicContact CG-CD2 4.28Å; F1153-L1256 HydrophobicContact CB-CD1 3.84Å; F1153-L1256 HydrophobicContact CD1-CB 3.95Å; F1153-L1256 HydrophobicContact CD1-CD1 4.3Å; F1153-L1256 HydrophobicContact CD2-CB 4.4Å; F1153-L1256 HydrophobicContact CE1-CB 4.1Å; F1153-L1256 VanDerWaalsContact CE2-N 3.3Å; F1153-L1256 HydrophobicContact CG-CB 4.11Å; F1153-L1256 HydrophobicContact CG-CD1 4.03Å; F1153-L1256 HydrophobicContact CZ-CB 4.42Å
1257	A	90.9	Very high	75	Confident	24 Å²	24	84.6 Å²	84.6	20%	0.198	51%	0.507	C	S	.	.	P	Polyproline II helix	trans	-76	131.3	178.1	0	0	0	0	0	110.3	K1146 V1147 S1148 T1255 S1259	K1146-A1257 HydrophobicContact CB-CB 3.98Å; V1147-A1257 WeakPolarHBondContact O-CB 3.32Å; V1147-A1257 PolarHBondContact O-N 2.91Å; S1148-A1257 WeakPolarHBondContact CA-O 3.13Å; S1148-A1257 WeakPolarHBondContact CB-O 3.24Å; T1255-A1257 PolarHBondContact O-N 3.16Å; A1257-S1259 PolarHBondContact O-N 3.31Å
1258	L	84.1	Confident	73.9	Confident	167 Å²	167	89.5 Å²	89.5	87%	0.874	54%	0.536	S	S	*	.	P	Polyproline II helix	trans	-55.6	132.3	172.4	-66	173.8	0	0	0	110	L1260	L1258-L1260 PolarHBondContact O-N 3.31Å
1259	S	65.8	Low	72.6	Confident	106 Å²	106	92.9 Å²	92.9	74%	0.741	56%	0.558	S	S	*	*			trans	-64.2	114.7	166	40.7	0	0	0	0	108.9	A1257 S1261	A1257-S1259 PolarHBondContact O-N 3.31Å; S1259-S1261 PolarHBondContact O-N 2.9Å; S1259-S1261 VanDerWaalsContact O-N 3.08Å
1260	L	46.2	Very low	71.2	Confident	172 Å²	172	92 Å²	92	90%	0.901	56%	0.562	S	S	*	*			trans	-62.4	112	167.4	-77.1	165.6	0	0	0	107.7	L1258 S1262	L1258-L1260 PolarHBondContact O-N 3.31Å; L1260-S1262 PolarHBondContact O-N 3.05Å
1261	S	33.7	Very low	69.4	Low	109 Å²	109	97.1 Å²	97.1	76%	0.762	59%	0.593	S	S	*	*			trans	-59.9	121.9	167.5	44.9	0	0	0	0	108.4	S1259 S1263	S1259-S1261 PolarHBondContact O-N 2.9Å; S1259-S1261 VanDerWaalsContact O-N 3.08Å; S1261-S1263 PolarHBondContact O-N 3.27Å
1262	S	30.7	Very low	67.3	Low	120 Å²	120	104.5 Å²	104.5	84%	0.839	64%	0.639	S	S	*	*			trans	-67.7	96.5	177.9	53.1	0	0	0	0	109.8	L1260	L1260-S1262 PolarHBondContact O-N 3.05Å
1263	S	26.4	Very low	65.2	Low	104 Å²	104	108.1 Å²	108.1	73%	0.727	67%	0.665	S	S	*	*			trans	-79.4	129.6	166	54.5	0	0	0	0	109.7	S1261	S1261-S1263 PolarHBondContact O-N 3.27Å
1264	S	27.6	Very low	62.5	Low	192 Å²	192	106.3 Å²	106.3	100%	1.343	67%	0.671	S	S	*	*			trans	56.1	0	-175.8	71	0	0	0	0	115.5

Retrieved 1,264 of 1,264 residues in 1015.8 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).