A0A087X6H0_POEFO Loading...

Peroxisome proliferator-activated receptor gamma coactivator 1-alpha

AlphaFold DB , UniProt , Accession A0A087X6H0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 931 aa.

						>A0A087X6H0_POEFO|A0A087X6H0
MAWDRCNQDSVWTELECAALVGEDQPLCPDLPELDLSELDVSDLDADSFLGGLKWYSDQSEIISSQYGNEASNLFEKIDEENEANLLAVLTETLDSIPVDEDGLPSFEALADGDVTNASDRSCPSSPDASPHTPEPEEPSLLKKLLLAPANSQLSYNQYTGGKAQNHAASSNHRIRPPPAVVKTESPWNGKARGGSGQQNRPVRRPCTELLKYLTATDDILLHTKASDAKSAWGGPSSRDKSSLGLSASSSSSSPSSSSTSSFSSLSSTSSSSSSTTSKKKSAVPLRGLRTQQRLCSKHKRTKPTTLPLPLTPESPNDHKGSPFENKTIERTLSVEIAGTPGLTPPTTPPHKASQENPFKASLKTKLSSCCSSALTCKRARLSELGAGALAPAPGASAGGPARKGPEQTELYAQLSKASTALPYAIAQRALGGGLEGHCGTGNNKRAAGQDGHSDHDYCQALAASLEMTFTPGATSTGKVENRQVVECMDSVMSTSFLSSSCSTSSSSLSHLTKEQKFVPVDGDACRVRGLGERTLPQTTQIPTQGGTAVRDQLQLSATSRKPLCDQEIRAELNKHFGPPLQALYTQGEQERDNSSKPNKPTTPQSPEGGEIDFYSQRLSGSSYLHPGFLSFQDELELDDGRESRFIFPWEGTPLDLLFDCSPRSPSCSPPSTCSPSRGSVSPPSSLLLSPSRPFCWTSSGSRSRSRSHSGSRSSSSRYRRRSLSSSPDRRPSSWSHHGSDLNAVRSRLHKSPHPQSRSPLSRRPRYDSYEEYQHERLKREEYRLDYEKREFERAEQREKQRQKAIEERRVVYVGRLRSDCSRSELKHRFEVFGEIEECAVNLRDDGDNFGFIMFRYTCDAFAALENGHTLRRSNEPQFELCFDGQKQLCKSRYTDLDSHSDDFDPTSTKSKYDSMDFDSLLKEAQCSLRR
					

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	35.1	Very low	33.4	Very low	236 Å²	236	145 Å²	145	100%	1.163	75%	0.75	S	S	*	*				0	125.2	0	-63.7	166.6	170.4	0	0	107.8
2	A	43.7	Very low	33.1	Very low	91 Å²	91	151.7 Å²	151.7	75%	0.752	76%	0.759	S	S	*	*			cis	-159.9	93.1	-37.2	0	0	0	0	0	104.2
3	W	31.3	Very low	33.3	Very low	241 Å²	241	148.5 Å²	148.5	91%	0.913	75%	0.752	S	S	*	*				61.5	124.8	81.7	-74.3	65.4	0	0	0	113.6
4	D	38.2	Very low	33.5	Very low	133 Å²	133	150.9 Å²	150.9	71%	0.711	76%	0.76	S	S	*	*			cis	172.5	157.3	-46.1	175.1	39.7	0	0	0	109.3
5	R	33.1	Very low	33.4	Very low	205 Å²	205	151.3 Å²	151.3	77%	0.774	76%	0.764	S	S	*	*			trans	77.2	150.7	155.4	-94.6	172.4	70.5	170.4	6.7	125.3
6	C	33.6	Very low	33.2	Very low	85 Å²	85	153.6 Å²	153.6	57%	0.574	77%	0.771	S	S	*	*			trans	80.1	132.4	159.3	-65.2	0	0	0	0	118.7
7	N	30.4	Very low	33	Very low	130 Å²	130	152.2 Å²	152.2	70%	0.695	78%	0.777	S	S	*	*			cis	77.1	142.7	33.3	-61.7	31.1	0	0	0	112.7
8	Q	29.7	Very low	32.8	Very low	152 Å²	152	149.3 Å²	149.3	71%	0.71	78%	0.78	S	S	*	*			cis	-167.7	165.5	-1.9	-115.4	175.9	-70.3	0	0	108
9	D	28.6	Very low	32.6	Very low	117 Å²	117	146.1 Å²	146.1	63%	0.626	78%	0.777	S	S	*	*			cis	-154.6	-159.6	-6.5	-150.8	-39.7	0	0	0	109.4
10	S	31.6	Very low	32.8	Very low	98 Å²	98	147.1 Å²	147.1	69%	0.685	78%	0.781	S	S	*	*			trans	-85.4	-176.3	176	-39.7	0	0	0	0	112
11	V	31.9	Very low	32.8	Very low	107 Å²	107	146.4 Å²	146.4	65%	0.648	78%	0.783	S	S	*	*				167.2	147.4	87.2	159.7	0	0	0	0	109.9
12	W	29.8	Very low	32.5	Very low	225 Å²	225	138.3 Å²	138.3	85%	0.852	76%	0.76	S	S	*	*			trans	43.2	130.6	164.1	-54	141.6	0	0	0	120.3
13	T	35.5	Very low	31.9	Very low	110 Å²	110	143.4 Å²	143.4	68%	0.675	77%	0.768	S	S	*	*			cis	79.9	102	43.7	70.3	0	0	0	0	118.1
14	E	36.7	Very low	32	Very low	183 Å²	183	139 Å²	139	86%	0.855	76%	0.762	S	S	*	*			trans	69.8	155.6	136	-140.7	171.9	-159	0	0	121.5
15	L	32.6	Very low	31.7	Very low	157 Å²	157	141.4 Å²	141.4	82%	0.822	77%	0.769	S	S	*	*			trans	95	147.9	161.8	-72.3	155.6	0	0	0	122.3
16	E	29.4	Very low	32.4	Very low	188 Å²	188	136.6 Å²	136.6	88%	0.879	77%	0.765	S	S	*	*			trans	71.2	143.5	160.9	-74.6	-172.6	139	0	0	123.7
17	C	29.7	Very low	32.2	Very low	130 Å²	130	140 Å²	140	88%	0.878	78%	0.776	S	S	*	*			trans	-128.1	119.8	170.8	-48.4	0	0	0	0	108.6
18	A	30.3	Very low	32.3	Very low	100 Å²	100	139.3 Å²	139.3	83%	0.826	78%	0.781	S	S	*	*			trans	-172.2	113	154.5	0	0	0	0	0	113.9
19	A	29.2	Very low	32.9	Very low	87 Å²	87	137.9 Å²	137.9	72%	0.719	78%	0.784	S	S	*	*			trans	32.9	147.7	130.7	0	0	0	0	0	124.2
20	L	35.8	Very low	33.2	Very low	166 Å²	166	139.6 Å²	139.6	87%	0.869	79%	0.794	S	S	*	*			trans	72.3	143.4	156.6	-67.5	162.6	0	0	0	116.2
21	V	32.3	Very low	33.6	Very low	134 Å²	134	142.4 Å²	142.4	81%	0.812	80%	0.8	S	S	*	*			cis	-138.6	152.8	-3.8	-159.1	0	0	0	0	104.4
22	G	30	Very low	34.3	Very low	66 Å²	66	142.9 Å²	142.9	68%	0.68	81%	0.805	S	S	*	*			cis	107.9	110	19.8	0	0	0	0	0	110.7
23	E	31.2	Very low	34.7	Very low	198 Å²	198	141.2 Å²	141.2	93%	0.925	81%	0.807	S	S	*	*			trans	-164.1	175.7	159.3	-126	173.9	-156.7	0	0	111.5
24	D	32	Very low	35.1	Very low	148 Å²	148	143.4 Å²	143.4	79%	0.791	81%	0.813	S	S	*	*			trans	-101.1	176.8	-155.3	-83.1	-60	0	0	0	117
25	Q	32.3	Very low	35.4	Very low	183 Å²	183	141 Å²	141	86%	0.855	81%	0.806	S	S	*	*			trans	88.4	157.8	150.1	-91.6	-176.5	57	0	0	119
26	P	46.9	Very low	36.4	Very low	104 Å²	104	139.9 Å²	139.9	68%	0.675	80%	0.801	S	S	*	*				-132.3	-150.8	-121.1	44	-25.2	0	0	0	113.9
27	L	30.4	Very low	37.3	Very low	157 Å²	157	135.4 Å²	135.4	82%	0.822	79%	0.79	S	S	*	*			trans	96.2	108.1	175.7	-55.9	169.8	0	0	0	115.4
28	C	31.6	Very low	38.3	Very low	116 Å²	116	138.2 Å²	138.2	78%	0.784	79%	0.79	S	S	*	*				177.8	109.4	120.4	-102.1	0	0	0	0	110.1
29	P	42.5	Very low	39	Very low	121 Å²	121	140.3 Å²	140.3	79%	0.786	79%	0.787	S	S	*	*			trans	-92.6	117.8	167.4	33.4	-26.4	0	0	0	110.5
30	D	34.6	Very low	39.8	Very low	154 Å²	154	141.5 Å²	141.5	82%	0.824	78%	0.781	S	S	*	*			trans	-131.1	87.6	169.7	-86.2	-57.6	0	0	0	109.5
31	L	40.3	Very low	40.9	Very low	157 Å²	157	140 Å²	140	82%	0.822	78%	0.778	S	S	*	*			trans	-128.5	131.6	163.4	-87.9	167	0	0	0	106.7	E33	L31-E33 PolarHBondContact O-N 3.37Å
32	P	47.6	Very low	41.8	Very low	116 Å²	116	137.6 Å²	137.6	75%	0.753	77%	0.768	S	S	*	*			trans	-68.7	121.5	-178.6	27.7	-33.3	0	0	0	110.2	L34	P32-L34 PolarHBondContact O-N 3.37Å
33	E	37	Very low	42.9	Very low	190 Å²	190	142 Å²	142	89%	0.888	78%	0.776	S	S	*	*			trans	-66.9	121.8	170.6	-63.3	-177.2	145.2	0	0	108.8	L31 D35	L31-E33 PolarHBondContact O-N 3.37Å; E33-D35 PolarHBondContact O-N 3.37Å
34	L	43.8	Very low	43.8	Very low	156 Å²	156	140.1 Å²	140.1	82%	0.817	77%	0.771	S	S	*	*			trans	-80.6	101	171.2	-74	171.5	0	0	0	108	P32 L36	P32-L34 PolarHBondContact O-N 3.37Å; L34-L36 PolarHBondContact O-N 2.89Å; L34-L36 VanDerWaalsContact O-N 3.14Å
35	D	44.8	Very low	44.5	Very low	132 Å²	132	139.7 Å²	139.7	71%	0.706	77%	0.769	S	S	*	*			trans	-70.9	105.5	178.6	-159.1	-22.5	0	0	0	110	E33 S37	E33-D35 PolarHBondContact O-N 3.37Å; D35-S37 VanDerWaalsContact C-N 3.26Å; D35-S37 VanDerWaalsContact CG-OG 3.27Å; D35-S37 PolarHBondContact O-N 3.32Å; D35-S37 VanDerWaalsContact OD1-CB 3.24Å; D35-S37 WeakPolarHBondContact OD1-CB 3.19Å; D35-S37 PolarHBondContact OD1-N 3.36Å; D35-S37 PolarHBondContact OD1-OG 3.42Å
36	L	52	Low	45.5	Very low	135 Å²	135	134.7 Å²	134.7	71%	0.707	76%	0.759	S	S	*	*			trans	-90.1	18.2	-178.6	-67.7	175.9	0	0	0	112.8	L34 E38	L34-L36 PolarHBondContact O-N 2.89Å; L34-L36 VanDerWaalsContact O-N 3.14Å; L36-E38 PolarHBondContact O-N 3.39Å
37	S	48.7	Very low	45.7	Very low	93 Å²	93	137.3 Å²	137.3	65%	0.65	77%	0.767	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	-5.2	-179	55.8	0	0	0	0	115.3	D35	D35-S37 VanDerWaalsContact C-N 3.26Å; D35-S37 VanDerWaalsContact CG-OG 3.27Å; D35-S37 PolarHBondContact O-N 3.32Å; D35-S37 VanDerWaalsContact OD1-CB 3.24Å; D35-S37 WeakPolarHBondContact OD1-CB 3.19Å; D35-S37 PolarHBondContact OD1-N 3.36Å; D35-S37 PolarHBondContact OD1-OG 3.42Å
38	E	50.6	Low	46.7	Very low	190 Å²	190	134.3 Å²	134.3	89%	0.888	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.4	8.6	178.7	-62	-165.1	155.9	0	0	114.8	L36 D40	L36-E38 PolarHBondContact O-N 3.39Å; E38-D40 PolarHBondContact O-N 3.17Å; E38-D40 VanDerWaalsContact O-N 3.08Å
39	L	44.8	Very low	47.6	Very low	143 Å²	143	137.8 Å²	137.8	75%	0.749	76%	0.762	S	S	*	*			trans	-78.9	84.8	166.3	-88.5	166.3	0	0	0	110.4	V41	L39-V41 PolarHBondContact O-N 2.95Å
40	D	46.2	Very low	47.8	Very low	113 Å²	113	139.2 Å²	139.2	60%	0.604	76%	0.762	S	S	*	*			trans	-61.2	129.6	171.4	-165.3	-26.4	0	0	0	110.2	E38 S42	E38-D40 PolarHBondContact O-N 3.17Å; E38-D40 VanDerWaalsContact O-N 3.08Å; D40-S42 PolarHBondContact O-N 3.08Å; D40-S42 VanDerWaalsContact OD1-CB 3.24Å; D40-S42 WeakPolarHBondContact OD1-CB 3.11Å; D40-S42 PolarHBondContact OD1-N 2.9Å; D40-S42 PolarHBondContact OD1-OG 3.17Å
41	V	58.3	Low	48.1	Very low	133 Å²	133	134.9 Å²	134.9	81%	0.806	75%	0.754	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.8	9	-176.9	-158.2	0	0	0	0	111.5	L39	L39-V41 PolarHBondContact O-N 2.95Å
42	S	52.2	Low	48.2	Very low	85 Å²	85	130.8 Å²	130.8	59%	0.594	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.8	-21.1	-178.2	-55.1	0	0	0	0	114.7	D40 L44	D40-S42 PolarHBondContact O-N 3.08Å; D40-S42 VanDerWaalsContact OD1-CB 3.24Å; D40-S42 WeakPolarHBondContact OD1-CB 3.11Å; D40-S42 PolarHBondContact OD1-N 2.9Å; D40-S42 PolarHBondContact OD1-OG 3.17Å; S42-L44 VanDerWaalsContact C-N 3.32Å; S42-L44 PolarHBondContact O-N 3.33Å
43	D	53.6	Low	48.2	Very low	158 Å²	158	132 Å²	132	85%	0.845	75%	0.749	S	S	*	*	S	Bend	trans	-86.1	9.9	-173.6	-89.3	4.8	0	0	0	114.5
44	L	48.8	Very low	48.1	Very low	159 Å²	159	129.6 Å²	129.6	83%	0.832	74%	0.735	S	S	*	*			trans	-104.2	59.1	-174.7	-149.4	79.4	0	0	0	113.6	S42 A46	S42-L44 VanDerWaalsContact C-N 3.32Å; S42-L44 PolarHBondContact O-N 3.33Å; L44-A46 PolarHBondContact O-N 2.63Å; L44-A46 VanDerWaalsContact O-N 3.17Å
45	D	48.6	Very low	48.2	Very low	138 Å²	138	133.2 Å²	133.2	74%	0.738	74%	0.738	S	S	*	*			trans	-63.4	111.7	176.8	-93.2	-27.5	0	0	0	112.2	D47 S48	D45-D47 VanDerWaalsContact C-N 3.28Å; D45-D47 PolarHBondContact O-N 3.31Å; D45-S48 PolarHBondContact O-N 3.44Å; D45-S48 PolarHBondContact O-OG 3.14Å
46	A	52	Low	47.6	Very low	78 Å²	78	134.7 Å²	134.7	65%	0.645	74%	0.735	S	S	*	*	G	3₁₀ helix	trans	-69.5	-16.4	-168.4	0	0	0	0	0	115.2	L44 S48 F49	L44-A46 PolarHBondContact O-N 2.63Å; L44-A46 VanDerWaalsContact O-N 3.17Å; A46-S48 PolarHBondContact O-N 2.88Å; A46-F49 PolarHBondContact O-N 3.44Å
47	D	50.6	Low	47.1	Very low	159 Å²	159	133.1 Å²	133.1	85%	0.85	74%	0.736	S	S	*	*	G	3₁₀ helix	trans	-70.9	-13.6	-178.1	-71.1	-17.8	0	0	0	113.3	D45	D45-D47 VanDerWaalsContact C-N 3.28Å; D45-D47 PolarHBondContact O-N 3.31Å
48	S	52.6	Low	46.5	Very low	94 Å²	94	135 Å²	135	66%	0.657	74%	0.738	S	S	*	*	G	3₁₀ helix	trans	-75.8	-27.7	177.8	59.9	0	0	0	0	114	D45 A46	D45-S48 PolarHBondContact O-N 3.44Å; D45-S48 PolarHBondContact O-OG 3.14Å; A46-S48 PolarHBondContact O-N 2.88Å
49	F	50.4	Low	45.9	Very low	190 Å²	190	135.1 Å²	135.1	83%	0.833	74%	0.739	S	S	*	*	S	Bend	trans	-92.4	-6.3	-165.4	-128.8	-91.5	0	0	0	115.4	A46	A46-F49 PolarHBondContact O-N 3.44Å
50	L	45.9	Very low	45.7	Very low	150 Å²	150	133.8 Å²	133.8	79%	0.785	74%	0.742	S	S	*	*	S	Bend	trans	-114.8	-4.1	178.7	-73.4	171.7	0	0	0	114.3	G52	L50-G52 VanDerWaalsContact C-N 3.3Å; L50-G52 PolarHBondContact O-N 2.95Å
51	G	41	Very low	45.3	Very low	64 Å²	64	136.6 Å²	136.6	66%	0.66	75%	0.751	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.3	-19.4	175.4	0	0	0	0	0	114.9
52	G	42.5	Very low	44.4	Very low	71 Å²	71	137.8 Å²	137.8	73%	0.732	75%	0.751	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.6	-17.9	-172.5	0	0	0	0	0	116.2	L50 K54	L50-G52 VanDerWaalsContact C-N 3.3Å; L50-G52 PolarHBondContact O-N 2.95Å; G52-K54 PolarHBondContact O-N 3.1Å
53	L	48.6	Very low	43.4	Very low	140 Å²	140	141.8 Å²	141.8	73%	0.733	76%	0.764	S	S	*	*			trans	-101.2	50.9	-172.8	-66.1	178.8	0	0	0	113.2	W55	L53-W55 PolarHBondContact O-N 3.47Å
54	K	33.7	Very low	42.4	Very low	140 Å²	140	139.9 Å²	139.9	61%	0.609	76%	0.763	S	S	*	*			trans	-74.8	92.7	170.8	-172.5	-176.1	177.8	-176.3	0	110.7	G52 Y56	G52-K54 PolarHBondContact O-N 3.1Å; K54-Y56 HydrophobicContact CD-CD2 4.08Å; K54-Y56 HydrophobicContact CD-CE2 3.68Å; K54-Y56 VanDerWaalsContact CE-CE2 3.43Å; K54-Y56 HydrophobicContact CG-CD2 4.35Å; K54-Y56 HydrophobicContact CG-CE2 4.44Å; K54-Y56 VanDerWaalsContact NZ-CE2 3.35Å; K54-Y56 VanDerWaalsContact NZ-CZ 3.27Å; K54-Y56 PolarHBondContact NZ-OH 2.95Å; K54-Y56 PolarHBondContact O-N 2.82Å; K54-Y56 VanDerWaalsContact O-N 3.11Å
55	W	45.9	Very low	41.8	Very low	232 Å²	232	137.1 Å²	137.1	88%	0.879	76%	0.757	S	S	*	*			trans	-58.4	111.8	167.1	-73.5	87.1	0	0	0	110.7	L53 S57	L53-W55 PolarHBondContact O-N 3.47Å; W55-S57 PolarHBondContact O-N 2.8Å
56	Y	32.7	Very low	41.5	Very low	164 Å²	164	138.5 Å²	138.5	64%	0.643	76%	0.759	S	S	*	*			trans	-85.8	95	173.9	-111.7	-78.9	0	0	0	110.5	K54 D58	K54-Y56 HydrophobicContact CD-CD2 4.08Å; K54-Y56 HydrophobicContact CD-CE2 3.68Å; K54-Y56 VanDerWaalsContact CE-CE2 3.43Å; K54-Y56 HydrophobicContact CG-CD2 4.35Å; K54-Y56 HydrophobicContact CG-CE2 4.44Å; K54-Y56 VanDerWaalsContact NZ-CE2 3.35Å; K54-Y56 VanDerWaalsContact NZ-CZ 3.27Å; K54-Y56 PolarHBondContact NZ-OH 2.95Å; K54-Y56 PolarHBondContact O-N 2.82Å; K54-Y56 VanDerWaalsContact O-N 3.11Å; Y56-D58 VanDerWaalsContact C-N 3.32Å; Y56-D58 HydrophobicContact CD1-CB 4.12Å; Y56-D58 HydrophobicContact CE1-CB 4.36Å
57	S	40.8	Very low	40.6	Very low	102 Å²	102	145.6 Å²	145.6	71%	0.713	77%	0.771	S	S	*	*			trans	-96.7	34.1	172.9	-173.7	0	0	0	0	112.4	W55	W55-S57 PolarHBondContact O-N 2.8Å
58	D	36.6	Very low	39.8	Very low	131 Å²	131	141.1 Å²	141.1	70%	0.701	76%	0.762	S	S	*	*			trans	-130	74.2	-173.8	-78.6	-46.5	0	0	0	112.4	Y56	Y56-D58 VanDerWaalsContact C-N 3.32Å; Y56-D58 HydrophobicContact CD1-CB 4.12Å; Y56-D58 HydrophobicContact CE1-CB 4.36Å
59	Q	37.8	Very low	39.2	Very low	193 Å²	193	144.4 Å²	144.4	90%	0.902	77%	0.772	S	S	*	*			trans	-144.4	28.6	154.1	-76.6	-151.5	20.7	0	0	112.3
60	S	41.2	Very low	38.7	Very low	116 Å²	116	143.1 Å²	143.1	81%	0.811	77%	0.769	S	S	*	*			trans	-98.8	12.8	-175	-61.2	0	0	0	0	114.8
61	E	36.7	Very low	38.4	Very low	172 Å²	172	140.9 Å²	140.9	80%	0.804	77%	0.772	S	S	*	*			trans	-146.9	128.5	170.1	-91.7	168.2	-145	0	0	105.8
62	I	39.3	Very low	38.6	Very low	157 Å²	157	142.6 Å²	142.6	81%	0.805	77%	0.774	S	S	*	*	S	Bend	cis	-135.6	106	24.7	-51.3	95.4	0	0	0	112.4
63	I	32.1	Very low	38.6	Very low	170 Å²	170	144 Å²	144	87%	0.872	77%	0.765	S	S	*	*			trans	-144.5	87.4	130.7	-52.5	-177.4	0	0	0	108
64	S	32.7	Very low	38.5	Very low	118 Å²	118	145 Å²	145	83%	0.825	77%	0.77	S	S	*	*			trans	-135.4	84.4	171.6	-167.6	0	0	0	0	110.6
65	S	35.7	Very low	39	Very low	101 Å²	101	147.3 Å²	147.3	71%	0.706	78%	0.78	S	S	*	*	S	Bend	trans	-152.1	14.6	174.6	57.5	0	0	0	0	114.8
66	Q	42.8	Very low	39.3	Very low	167 Å²	167	144 Å²	144	78%	0.78	77%	0.774	S	S	*	*	S	Bend	trans	-149.1	119.4	164.3	-142.2	93.4	99.6	0	0	111.6
67	Y	32.5	Very low	40.1	Very low	227 Å²	227	145.1 Å²	145.1	89%	0.89	78%	0.783	S	S	*	*			trans	61.7	116.7	177.9	-63.1	-81.6	0	0	0	117.5
68	G	35.1	Very low	41	Very low	64 Å²	64	144.9 Å²	144.9	66%	0.66	77%	0.773	S	S	*	*			trans	-110.3	-172.4	160.2	0	0	0	0	0	111.5
69	N	39.4	Very low	41.9	Very low	164 Å²	164	144.8 Å²	144.8	88%	0.877	77%	0.772	S	S	*	*			trans	90.6	52.1	178.7	-55.3	-18.3	0	0	0	118.4
70	E	40.1	Very low	43.2	Very low	162 Å²	162	144 Å²	144	76%	0.757	77%	0.768	S	S	*	*			trans	-153.2	46.7	152.1	37.9	-150.1	138.5	0	0	115.2	S72	E70-S72 PolarHBondContact O-N 3.27Å
71	A	39.5	Very low	44.1	Very low	104 Å²	104	146.5 Å²	146.5	86%	0.86	77%	0.767	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	35.6	171.1	0	0	0	0	0	113.5
72	S	45	Very low	45.7	Very low	100 Å²	100	143 Å²	143	70%	0.699	75%	0.754	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.2	-11.2	-173.5	-53.8	0	0	0	0	114.8	E70	E70-S72 PolarHBondContact O-N 3.27Å
73	N	42.2	Very low	47.5	Very low	99 Å²	99	140.5 Å²	140.5	53%	0.529	74%	0.739	S	S	.	*	T	Hydrogen-bonded Turn	trans	-97.5	8.2	-171	-60.6	-26.8	0	0	0	114.1
74	L	45.7	Very low	49.5	Very low	161 Å²	161	135.1 Å²	135.1	84%	0.843	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.7	-16.5	-177.5	-170.8	56	0	0	0	113.6
75	F	45.1	Very low	51.6	Low	189 Å²	189	134.7 Å²	134.7	83%	0.829	71%	0.708	S	S	*	*	S	Bend	trans	-100.5	-14.5	177.2	-87.2	-97.2	0	0	0	114.1	K77	F75-K77 PolarHBondContact O-N 3.48Å
76	E	53.2	Low	53.6	Low	162 Å²	162	135.1 Å²	135.1	76%	0.757	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.1	47.3	-177.3	-159.3	-176.4	-157.8	0	0	112.3
77	K	48.1	Very low	55.4	Low	189 Å²	189	131.6 Å²	131.6	82%	0.822	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-157	29.1	-180	-129.1	160.9	-167.2	161.4	0	117.1	F75	F75-K77 PolarHBondContact O-N 3.48Å
78	I	59.2	Low	57.4	Low	97 Å²	97	123.1 Å²	123.1	50%	0.497	67%	0.665	S	S	.	*	S	Bend	trans	-78.7	127.6	150.1	-57.8	176.8	0	0	0	105.6	E80 N82 E83	I78-E80 PolarHBondContact O-N 3.1Å; I78-N82 HydrophobicContact CG2-CB 4.13Å; I78-N82 WeakPolarHBondContact CG2-ND2 3.25Å; I78-E83 HydrophobicContact CG2-CB 4.2Å
79	D	56.4	Low	59.5	Low	129 Å²	129	123.7 Å²	123.7	69%	0.69	66%	0.656	S	S	*	*			trans	-63	132.7	174.4	-67.8	-54.5	0	0	0	109.2	E81 N82 E83	D79-E81 PolarHBondContact O-N 2.85Å; D79-N82 WeakPolarHBondContact O-CB 3.43Å; D79-N82 PolarHBondContact O-N 2.66Å; D79-E83 PolarHBondContact O-N 3.04Å
80	E	65.1	Low	61	Low	175 Å²	175	120.3 Å²	120.3	82%	0.818	64%	0.637	S	S	*	*	H	α-helix	trans	-52.9	-31.9	-171.6	-60	174.5	138.5	0	0	113	I78 A84	I78-E80 PolarHBondContact O-N 3.1Å; E80-A84 VanDerWaalsContact O-CB 3.29Å; E80-A84 WeakPolarHBondContact O-CB 3.4Å; E80-A84 PolarHBondContact O-N 3.46Å
81	E	60.8	Low	62.8	Low	169 Å²	169	116.8 Å²	116.8	79%	0.79	63%	0.627	S	S	*	*	H	α-helix	trans	-69.4	-31.3	177.6	-167.8	167.6	-153	0	0	112.7	D79 N85	D79-E81 PolarHBondContact O-N 2.85Å; E81-N85 VanDerWaalsContact O-CB 3.28Å; E81-N85 WeakPolarHBondContact O-CB 3.42Å; E81-N85 PolarHBondContact O-N 3.23Å
82	N	69.6	Low	64.4	Low	98 Å²	98	118.4 Å²	118.4	52%	0.524	62%	0.616	S	S	.	*	H	α-helix	trans	-76	-39.2	175.1	180	80.8	0	0	0	112	I78 D79 N85 L86	I78-N82 HydrophobicContact CG2-CB 4.13Å; I78-N82 WeakPolarHBondContact CG2-ND2 3.25Å; D79-N82 WeakPolarHBondContact O-CB 3.43Å; D79-N82 PolarHBondContact O-N 2.66Å; N82-N85 PolarHBondContact O-N 2.78Å; N82-L86 WeakPolarHBondContact O-CB 3.46Å; N82-L86 PolarHBondContact O-N 2.96Å
83	E	77.3	Confident	65.4	Low	105 Å²	105	117.5 Å²	117.5	49%	0.491	61%	0.607	S	S	.	*	H	α-helix	trans	-63.4	-47.6	172.7	-172.5	-179.9	162.6	0	0	110.7	I78 D79 N85 L86 L87	I78-E83 HydrophobicContact CG2-CB 4.2Å; D79-E83 PolarHBondContact O-N 3.04Å; E83-N85 VanDerWaalsContact C-N 3.3Å; E83-N85 PolarHBondContact O-N 2.87Å; E83-L86 PolarHBondContact O-N 2.96Å; E83-L87 HydrophobicContact CG-CD1 4Å; E83-L87 HydrophobicContact CG-CG 4.46Å; E83-L87 WeakPolarHBondContact O-CB 3.18Å; E83-L87 WeakPolarHBondContact O-CG 3.4Å; E83-L87 PolarHBondContact O-N 3.12Å
84	A	73.3	Confident	66.4	Low	57 Å²	57	118.4 Å²	118.4	47%	0.471	61%	0.611	S	S	.	*	H	α-helix	trans	-59	-38.9	176.5	0	0	0	0	0	112.7	E80 A88	E80-A84 VanDerWaalsContact O-CB 3.29Å; E80-A84 WeakPolarHBondContact O-CB 3.4Å; E80-A84 PolarHBondContact O-N 3.46Å; A84-A88 VanDerWaalsContact O-CB 3.27Å; A84-A88 WeakPolarHBondContact O-CB 3.45Å; A84-A88 PolarHBondContact O-N 2.8Å
85	N	76.6	Confident	66.9	Low	109 Å²	109	118 Å²	118	58%	0.583	61%	0.61	S	S	*	*	H	α-helix	trans	-71.7	-36.7	178.5	-150.7	18.9	0	0	0	112	E81 N82 E83 A88 V89	E81-N85 VanDerWaalsContact O-CB 3.28Å; E81-N85 WeakPolarHBondContact O-CB 3.42Å; E81-N85 PolarHBondContact O-N 3.23Å; N82-N85 PolarHBondContact O-N 2.78Å; E83-N85 VanDerWaalsContact C-N 3.3Å; E83-N85 PolarHBondContact O-N 2.87Å; N85-A88 PolarHBondContact O-N 3.45Å; N85-V89 WeakPolarHBondContact O-CG2 3.35Å; N85-V89 PolarHBondContact O-N 3.4Å
86	L	79.1	Confident	67.2	Low	111 Å²	111	113.3 Å²	113.3	58%	0.581	60%	0.6	S	S	*	*	H	α-helix	trans	-65.8	-43.3	173.8	-162.6	76.5	0	0	0	111.2	N82 E83 V89 L90	N82-L86 WeakPolarHBondContact O-CB 3.46Å; N82-L86 PolarHBondContact O-N 2.96Å; E83-L86 PolarHBondContact O-N 2.96Å; L86-V89 PolarHBondContact O-N 2.99Å; L86-L90 HydrophobicContact CG-CD1 4.31Å; L86-L90 WeakPolarHBondContact O-CB 3.46Å; L86-L90 VanDerWaalsContact O-CG 3.28Å; L86-L90 WeakPolarHBondContact O-CG 3.46Å; L86-L90 PolarHBondContact O-N 2.64Å
87	L	79.6	Confident	67.3	Low	93 Å²	93	110.7 Å²	110.7	49%	0.487	59%	0.591	S	S	.	*	H	α-helix	trans	-66.5	-35.1	175.5	-69.4	172	0	0	0	112.5	E83 T91	E83-L87 HydrophobicContact CG-CD1 4Å; E83-L87 HydrophobicContact CG-CG 4.46Å; E83-L87 WeakPolarHBondContact O-CB 3.18Å; E83-L87 WeakPolarHBondContact O-CG 3.4Å; E83-L87 PolarHBondContact O-N 3.12Å; L87-T91 WeakPolarHBondContact O-CB 3.48Å; L87-T91 WeakPolarHBondContact O-CG2 3.42Å; L87-T91 PolarHBondContact O-N 3.02Å; L87-T91 PolarHBondContact O-OG1 3.47Å
88	A	75.2	Confident	67.3	Low	48 Å²	48	107.2 Å²	107.2	40%	0.397	59%	0.587	S	S	.	*	H	α-helix	trans	-64.6	-47.7	174.2	0	0	0	0	0	111.6	A84 N85 L90 T91 E92	A84-A88 VanDerWaalsContact O-CB 3.27Å; A84-A88 WeakPolarHBondContact O-CB 3.45Å; A84-A88 PolarHBondContact O-N 2.8Å; N85-A88 PolarHBondContact O-N 3.45Å; A88-L90 PolarHBondContact O-N 3.02Å; A88-T91 WeakPolarHBondContact CA-OG1 3.45Å; A88-T91 PolarHBondContact O-N 2.87Å; A88-T91 PolarHBondContact O-OG1 3.41Å; A88-T91 VanDerWaalsContact O-OG1 3.09Å; A88-E92 WeakPolarHBondContact O-CB 3.5Å; A88-E92 PolarHBondContact O-N 2.98Å
89	V	78.8	Confident	66.6	Low	77 Å²	77	108.1 Å²	108.1	47%	0.467	60%	0.597	S	S	.	*	H	α-helix	trans	-63.2	-43.2	176.8	171.2	0	0	0	0	111.1	N85 L86 T91 E92 T93	N85-V89 WeakPolarHBondContact O-CG2 3.35Å; N85-V89 PolarHBondContact O-N 3.4Å; L86-V89 PolarHBondContact O-N 2.99Å; V89-T91 PolarHBondContact O-N 2.75Å; V89-E92 PolarHBondContact O-N 3.42Å; V89-T93 WeakPolarHBondContact O-CG2 3.48Å; V89-T93 PolarHBondContact O-N 3.34Å; V89-T93 PolarHBondContact O-OG1 3.05Å
90	L	71.8	Confident	65.7	Low	93 Å²	93	109.7 Å²	109.7	49%	0.487	61%	0.605	S	S	.	*	H	α-helix	trans	-63.6	-40.8	177.6	-73.2	168.1	0	0	0	112.2	L86 A88 T93 L94	L86-L90 HydrophobicContact CG-CD1 4.31Å; L86-L90 WeakPolarHBondContact O-CB 3.46Å; L86-L90 VanDerWaalsContact O-CG 3.28Å; L86-L90 WeakPolarHBondContact O-CG 3.46Å; L86-L90 PolarHBondContact O-N 2.64Å; A88-L90 PolarHBondContact O-N 3.02Å; L90-T93 WeakPolarHBondContact CA-OG1 3.25Å; L90-T93 PolarHBondContact O-N 2.9Å; L90-T93 PolarHBondContact O-OG1 3.11Å; L90-L94 WeakPolarHBondContact O-CG 3.4Å; L90-L94 PolarHBondContact O-N 2.74Å
91	T	76.8	Confident	64.7	Low	88 Å²	88	109.3 Å²	109.3	54%	0.54	60%	0.604	S	S	.	*	H	α-helix	trans	-69.8	-40.3	176.1	45.5	0	0	0	0	112.4	L87 A88 V89 T93 L94 D95	L87-T91 WeakPolarHBondContact O-CB 3.48Å; L87-T91 WeakPolarHBondContact O-CG2 3.42Å; L87-T91 PolarHBondContact O-N 3.02Å; L87-T91 PolarHBondContact O-OG1 3.47Å; A88-T91 WeakPolarHBondContact CA-OG1 3.45Å; A88-T91 PolarHBondContact O-N 2.87Å; A88-T91 PolarHBondContact O-OG1 3.41Å; A88-T91 VanDerWaalsContact O-OG1 3.09Å; V89-T91 PolarHBondContact O-N 2.75Å; T91-T93 VanDerWaalsContact C-N 3.31Å; T91-T93 PolarHBondContact O-N 2.69Å; T91-L94 PolarHBondContact O-N 3.06Å; T91-L94 VanDerWaalsContact O-N 3.08Å; T91-D95 WeakPolarHBondContact O-CB 3.32Å; T91-D95 PolarHBondContact O-N 2.94Å
92	E	73.4	Confident	63.8	Low	137 Å²	137	109.2 Å²	109.2	64%	0.64	61%	0.608	S	S	*	*	H	α-helix	trans	-58.7	-39.3	172.9	-173.6	175.4	-169.7	0	0	112.2	A88 V89 L94 S96	A88-E92 WeakPolarHBondContact O-CB 3.5Å; A88-E92 PolarHBondContact O-N 2.98Å; V89-E92 PolarHBondContact O-N 3.42Å; E92-L94 VanDerWaalsContact C-N 3.32Å; E92-L94 PolarHBondContact O-N 2.73Å; E92-S96 PolarHBondContact O-N 2.92Å; E92-S96 PolarHBondContact O-OG 2.87Å
93	T	66.6	Low	62.4	Low	82 Å²	82	108.1 Å²	108.1	50%	0.503	62%	0.621	S	S	.	*	H	α-helix	trans	-70.9	-22.6	175.1	54.3	0	0	0	0	114.6	V89 L90 T91	V89-T93 WeakPolarHBondContact O-CG2 3.48Å; V89-T93 PolarHBondContact O-N 3.34Å; V89-T93 PolarHBondContact O-OG1 3.05Å; L90-T93 WeakPolarHBondContact CA-OG1 3.25Å; L90-T93 PolarHBondContact O-N 2.9Å; L90-T93 PolarHBondContact O-OG1 3.11Å; T91-T93 VanDerWaalsContact C-N 3.31Å; T91-T93 PolarHBondContact O-N 2.69Å
94	L	62.4	Low	60.6	Low	117 Å²	117	111.1 Å²	111.1	61%	0.613	64%	0.639	S	S	*	*	H	α-helix	trans	-89.8	-36.7	178.7	-70	169.9	0	0	0	112.3	L90 T91 E92 S96 I97	L90-L94 WeakPolarHBondContact O-CG 3.4Å; L90-L94 PolarHBondContact O-N 2.74Å; T91-L94 PolarHBondContact O-N 3.06Å; T91-L94 VanDerWaalsContact O-N 3.08Å; E92-L94 VanDerWaalsContact C-N 3.32Å; E92-L94 PolarHBondContact O-N 2.73Å; L94-S96 PolarHBondContact O-N 2.83Å; L94-I97 PolarHBondContact O-N 2.75Å
95	D	57.1	Low	59.1	Low	153 Å²	153	114.3 Å²	114.3	82%	0.818	66%	0.655	S	S	*	*	H	α-helix	trans	-68.4	-11.5	175.2	-149.7	46.5	0	0	0	112.3	T91	T91-D95 WeakPolarHBondContact O-CB 3.32Å; T91-D95 PolarHBondContact O-N 2.94Å
96	S	49.8	Very low	57.1	Low	90 Å²	90	113.7 Å²	113.7	63%	0.629	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.8	1.7	177.2	-64.2	0	0	0	0	114.7	E92 L94	E92-S96 PolarHBondContact O-N 2.92Å; E92-S96 PolarHBondContact O-OG 2.87Å; L94-S96 PolarHBondContact O-N 2.83Å
97	I	55.4	Low	54.6	Low	108 Å²	108	117.6 Å²	117.6	55%	0.554	67%	0.672	S	S	*	*	S	Bend	trans	-104	113.4	-178.6	-56.1	176.2	0	0	0	109.8	L94 V99	L94-I97 PolarHBondContact O-N 2.75Å; I97-V99 PolarHBondContact O-N 3.01Å
98	P	48.1	Very low	52.6	Low	115 Å²	115	122.2 Å²	122.2	75%	0.747	69%	0.691	S	S	*	*			trans	-71.9	126	177.7	29	-33.3	0	0	0	111.3
99	V	46	Very low	50.6	Low	116 Å²	116	123.3 Å²	123.3	70%	0.703	70%	0.7	S	S	*	*			trans	-103.3	108.3	168.8	178.5	0	0	0	0	108.1	I97	I97-V99 PolarHBondContact O-N 3.01Å
100	D	37.2	Very low	48.9	Very low	162 Å²	162	126.3 Å²	126.3	87%	0.866	71%	0.713	S	S	*	*			trans	-89.6	116.8	167.3	-79	-44.9	0	0	0	109.1
101	E	43	Very low	47.2	Very low	168 Å²	168	127.2 Å²	127.2	79%	0.785	73%	0.733	S	S	*	*			trans	-76.3	130.5	175.7	-73.3	-91.2	126.3	0	0	111.6
102	D	43.4	Very low	45.2	Very low	166 Å²	166	129.6 Å²	129.6	89%	0.888	74%	0.743	S	S	*	*			trans	-178.6	114.1	135.8	-104.3	-26.4	0	0	0	113.1
103	G	39.6	Very low	43.4	Very low	76 Å²	76	126.1 Å²	126.1	78%	0.784	74%	0.744	S	S	*	*			trans	90.7	100.2	147.9	0	0	0	0	0	120.2
104	L	39.9	Very low	41.7	Very low	167 Å²	167	128.2 Å²	128.2	87%	0.874	75%	0.752	S	S	*	*			trans	-67.5	166.9	159.8	-63.4	174	0	0	0	112
105	P	40.9	Very low	40.4	Very low	124 Å²	124	130 Å²	130	81%	0.805	77%	0.767	S	S	*	*				-136.5	151.8	101.7	38.1	-28.9	0	0	0	115.8
106	S	34.2	Very low	39.3	Very low	97 Å²	97	126.8 Å²	126.8	68%	0.678	75%	0.754	S	S	*	*			trans	-51.6	160	171.3	56	0	0	0	0	116
107	F	27.3	Very low	38.3	Very low	192 Å²	192	129.8 Å²	129.8	84%	0.842	76%	0.763	S	S	*	*				-153.1	128.4	119.7	-127.9	-79.4	0	0	0	114.1	A109	F107-A109 HydrophobicContact CD1-CB 4.03Å
108	E	38.4	Very low	37	Very low	190 Å²	190	128.5 Å²	128.5	89%	0.888	77%	0.769	S	S	*	*			trans	-88.5	106.9	165.4	178	-172.3	-175.2	0	0	108.1
109	A	33.6	Very low	36.1	Very low	72 Å²	72	129 Å²	129	60%	0.595	77%	0.774	S	S	*	*			trans	-154.7	128.6	178.7	0	0	0	0	0	114	F107	F107-A109 HydrophobicContact CD1-CB 4.03Å
110	L	42.3	Very low	35.2	Very low	140 Å²	140	129.6 Å²	129.6	73%	0.733	77%	0.774	S	S	*	*			trans	58	83.7	152	-57.5	176.7	0	0	0	117.2	D112	L110-D112 PolarHBondContact O-N 3.08Å
111	A	35.3	Very low	34.9	Very low	111 Å²	111	132.5 Å²	132.5	92%	0.917	77%	0.773	S	S	*	*			trans	-71.1	71.5	142.5	0	0	0	0	0	110.2
112	D	35.9	Very low	34.2	Very low	138 Å²	138	128.9 Å²	128.9	74%	0.738	77%	0.766	S	S	*	*			trans	-147.6	136.5	166.9	-85.5	-50.2	0	0	0	105.4	L110	L110-D112 PolarHBondContact O-N 3.08Å
113	G	35.5	Very low	33.6	Very low	65 Å²	65	126.8 Å²	126.8	67%	0.67	76%	0.763	S	S	*	*			cis	160	156.2	5	0	0	0	0	0	107.9
114	D	30.4	Very low	33.7	Very low	125 Å²	125	128.5 Å²	128.5	67%	0.668	76%	0.76	S	S	*	*			trans	56.2	105.2	171.4	-165.1	45.8	0	0	0	118.7	T116	D114-T116 PolarHBondContact O-N 2.81Å; D114-T116 WeakPolarHBondContact OD1-CG2 3.31Å; D114-T116 WeakPolarHBondContact OD2-CB 3.3Å; D114-T116 WeakPolarHBondContact OD2-CG2 3.17Å; D114-T116 PolarHBondContact OD2-OG1 3.12Å
115	V	35.9	Very low	33	Very low	154 Å²	154	125.5 Å²	125.5	93%	0.933	75%	0.753	S	S	*	*			trans	-96.5	80.7	163.3	-177.5	0	0	0	0	108.9
116	T	33.4	Very low	32.5	Very low	86 Å²	86	124.7 Å²	124.7	53%	0.528	75%	0.751	S	S	.	*			trans	-85.3	121.5	176.9	23.6	0	0	0	0	112.9	D114	D114-T116 PolarHBondContact O-N 2.81Å; D114-T116 WeakPolarHBondContact OD1-CG2 3.31Å; D114-T116 WeakPolarHBondContact OD2-CB 3.3Å; D114-T116 WeakPolarHBondContact OD2-CG2 3.17Å; D114-T116 PolarHBondContact OD2-OG1 3.12Å
117	N	28.7	Very low	33	Very low	153 Å²	153	125.7 Å²	125.7	82%	0.818	75%	0.754	S	S	*	*			trans	59.8	146.1	149.6	-58.4	-62.1	0	0	0	118.3
118	A	28.5	Very low	32.9	Very low	82 Å²	82	124.2 Å²	124.2	68%	0.678	76%	0.756	S	S	*	*			cis	-157.5	157.4	23	0	0	0	0	0	112.7
119	S	29.7	Very low	32.4	Very low	124 Å²	124	118.9 Å²	118.9	87%	0.867	74%	0.744	S	S	*	*	S	Bend	trans	-147.5	93.3	137	-80.9	0	0	0	0	109.2
120	D	25.9	Very low	32.2	Very low	130 Å²	130	120.8 Å²	120.8	70%	0.695	75%	0.753	S	S	*	*			trans	31.6	121.6	161.2	-83.2	-58.9	0	0	0	121.9
121	R	31.8	Very low	32.4	Very low	223 Å²	223	118.7 Å²	118.7	84%	0.842	75%	0.748	S	S	*	*				63.4	137.7	128	-67.8	170.5	170	-151	-7.6	119.9
122	S	28.4	Very low	32.1	Very low	92 Å²	92	122 Å²	122	64%	0.643	74%	0.744	S	S	*	*			cis	-174.9	137.2	-2.9	46.5	0	0	0	0	112.1
123	C	30.2	Very low	31.7	Very low	121 Å²	121	121.6 Å²	121.6	82%	0.818	75%	0.746	S	S	*	*			trans	57.2	160.4	135	-60	0	0	0	0	121.4
124	P	41.1	Very low	31.9	Very low	112 Å²	112	124.2 Å²	124.2	73%	0.727	75%	0.751	S	S	*	*			cis	-137.5	-168.3	-29.4	34.8	-14.1	0	0	0	113.9
125	S	25	Very low	31.7	Very low	104 Å²	104	126.5 Å²	126.5	73%	0.727	76%	0.758	S	S	*	*			trans	71.9	105.3	150.9	46.4	0	0	0	0	121.5
126	S	30	Very low	31.9	Very low	108 Å²	108	124.5 Å²	124.5	76%	0.755	75%	0.749	S	S	*	*			trans	-42.4	171	137.6	55.1	0	0	0	0	115
127	P	45.4	Very low	32.1	Very low	117 Å²	117	128.7 Å²	128.7	76%	0.76	76%	0.762	S	S	*	*			cis	-144.3	179.8	24	45.1	-26.7	0	0	0	117.3
128	D	25	Very low	32.7	Very low	162 Å²	162	128 Å²	128	87%	0.866	75%	0.754	S	S	*	*				-178.8	175.4	105.8	-150.9	-5.3	0	0	0	112.4
129	A	27.6	Very low	33.4	Very low	78 Å²	78	128.2 Å²	128.2	65%	0.645	75%	0.748	S	S	*	*			trans	-89.6	144.1	-174.7	0	0	0	0	0	114
130	S	30.9	Very low	34.2	Very low	112 Å²	112	125.7 Å²	125.7	78%	0.783	73%	0.73	S	S	*	*				76.7	153.4	68.9	-150.4	0	0	0	0	113.4
131	P	46.7	Very low	35.5	Very low	96 Å²	96	124.6 Å²	124.6	62%	0.623	72%	0.724	S	S	*	*			cis	-132.6	168.1	4	42.1	-26.3	0	0	0	116.6
132	H	28.4	Very low	36.1	Very low	180 Å²	180	119.1 Å²	119.1	83%	0.833	71%	0.711	S	S	*	*				178.6	156.7	118.6	-98.3	-70.7	0	0	0	112.5
133	T	28	Very low	37	Very low	129 Å²	129	118.9 Å²	118.9	79%	0.791	70%	0.698	S	S	*	*			trans	-99.1	170.2	-175.4	40.5	0	0	0	0	112.1
134	P	39.2	Very low	38.2	Very low	120 Å²	120	118.9 Å²	118.9	78%	0.779	68%	0.684	S	S	*	*			cis	-137.3	-174.9	19.4	44.1	-25.8	0	0	0	118.1
135	E	26.3	Very low	38.6	Very low	174 Å²	174	120.1 Å²	120.1	81%	0.813	68%	0.684	S	S	*	*			trans	-27.7	169	153	-89.8	-168.9	110.3	0	0	119.1
136	P	39.3	Very low	39.7	Very low	112 Å²	112	119.6 Å²	119.6	73%	0.727	67%	0.673	S	S	*	*			cis	-130.7	-178.7	11.2	34.8	-15.2	0	0	0	116.4
137	E	38.7	Very low	40.2	Very low	174 Å²	174	121 Å²	121	81%	0.813	67%	0.671	S	S	*	*			trans	-61.1	152.3	163.8	-45.9	174.1	145.3	0	0	112.8
138	E	39.8	Very low	39.5	Very low	139 Å²	139	119.2 Å²	119.2	65%	0.65	67%	0.666	S	S	*	*			trans	-154	126.1	135.7	-131.8	175.9	-146.5	0	0	113.1	K143	E138-K143 VanDerWaalsContact CD-NZ 3.27Å; E138-K143 HydrophobicContact CG-CD 3.99Å; E138-K143 WeakPolarHBondContact OE1-CD 3.18Å; E138-K143 IonicContact OE1-NZ 2.63Å; E138-K143 PolarHBondContact OE1-NZ 2.71Å
139	P	44.5	Very low	40.7	Very low	85 Å²	85	117.3 Å²	117.3	55%	0.552	66%	0.663	S	S	*	*			trans	-94	148.6	-175.5	34.7	-34.6	0	0	0	113.3
140	S	46.6	Very low	41	Very low	71 Å²	71	118.2 Å²	118.2	50%	0.497	67%	0.67	S	S	.	*	T	Hydrogen-bonded Turn	trans	58.6	177.9	170.2	66.4	0	0	0	0	113.5	L142	S140-L142 VanDerWaalsContact C-N 3.32Å; S140-L142 WeakPolarHBondContact OG-CA 3.26Å; S140-L142 WeakPolarHBondContact OG-CB 3.48Å; S140-L142 PolarHBondContact OG-N 3.29Å
141	L	51.9	Low	41.1	Very low	107 Å²	107	120.1 Å²	120.1	56%	0.56	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	cis	69.5	-8.3	22.8	-44.8	-172.2	0	0	0	116.4	A474 T475	L141-A474 HydrophobicContact CB-CB 4.4Å; L141-A474 HydrophobicContact CD2-CB 3.71Å; L141-T475 WeakPolarHBondContact CA-OG1 3.43Å; L141-T475 VanDerWaalsContact N-CG2 3.3Å; L141-T475 PolarHBondContact N-OG1 2.87Å; L141-T475 VanDerWaalsContact O-CA 3.29Å; L141-T475 WeakPolarHBondContact O-CA 3.14Å; L141-T475 PolarHBondContact O-N 2.85Å
142	L	45.1	Very low	40.7	Very low	109 Å²	109	119.8 Å²	119.8	57%	0.571	67%	0.672	S	S	*	*	S	Bend	trans	-139.3	43.6	173.6	-56.3	171.9	0	0	0	118.2	S140 S476	S140-L142 VanDerWaalsContact C-N 3.32Å; S140-L142 WeakPolarHBondContact OG-CA 3.26Å; S140-L142 WeakPolarHBondContact OG-CB 3.48Å; S140-L142 PolarHBondContact OG-N 3.29Å; L142-S476 WeakPolarHBondContact CB-OG 3.36Å; L142-S476 PolarHBondContact O-OG 2.74Å
143	K	46.8	Very low	40.9	Very low	86 Å²	86	118.5 Å²	118.5	37%	0.374	67%	0.666	S	S	.	*	S	Bend	trans	-137.2	-58	164.3	-78.8	173.2	170.9	174.6	0	119.4	E138 T475 S476	E138-K143 VanDerWaalsContact CD-NZ 3.27Å; E138-K143 HydrophobicContact CG-CD 3.99Å; E138-K143 WeakPolarHBondContact OE1-CD 3.18Å; E138-K143 IonicContact OE1-NZ 2.63Å; E138-K143 PolarHBondContact OE1-NZ 2.71Å; K143-T475 CarbonylContact C-O 3.54Å; K143-T475 HydrophobicContact CB-CG2 3.8Å; K143-T475 VanDerWaalsContact N-CA 3.27Å; K143-T475 VanDerWaalsContact N-CB 3.3Å; K143-T475 CarbonylContact O-C 3.56Å; K143-T475 VanDerWaalsContact O-O 3.13Å; K143-S476 VanDerWaalsContact CA-O 3.26Å; K143-S476 WeakPolarHBondContact CA-O 3.26Å
144	K	55.7	Low	41.2	Very low	121 Å²	121	119.1 Å²	119.1	53%	0.526	66%	0.664	S	S	.	*	G	3₁₀ helix	trans	-67.4	-53.8	-162.5	-52.3	161.7	68.8	171.4	0	120.4	L146 L147 P472 T475	K144-L146 PolarHBondContact O-N 3.48Å; K144-L147 PolarHBondContact O-N 3.48Å; K144-P472 PolarHBondContact NZ-O 3.2Å; K144-T475 CarbonylContact C-O 3.47Å; K144-T475 VanDerWaalsContact C-O 3.26Å; K144-T475 HydrophobicContact CB-CG2 4.05Å; K144-T475 HydrophobicContact CD-CG2 4.06Å; K144-T475 HydrophobicContact CG-CG2 3.77Å; K144-T475 VanDerWaalsContact N-C 3.26Å; K144-T475 PolarHBondContact N-O 2.89Å; K144-T475 VanDerWaalsContact N-O 3.07Å
145	L	50.1	Low	40.6	Very low	139 Å²	139	117.8 Å²	117.8	73%	0.728	66%	0.657	S	S	*	*	G	3₁₀ helix	trans	-43.9	-22.1	169.5	-99.8	176.3	0	0	0	113.4	A474 T475	L145-A474 VanDerWaalsContact CB-O 3.26Å; L145-A474 WeakPolarHBondContact CB-O 3.29Å; L145-A474 HydrophobicContact CD1-CB 4.43Å; L145-A474 VanDerWaalsContact CG-C 3.43Å; L145-A474 VanDerWaalsContact CG-O 3.3Å; L145-A474 WeakPolarHBondContact CG-O 3.41Å; L145-A474 PolarHBondContact N-O 3.49Å; L145-T475 CarbonylContact C-O 3.5Å; L145-T475 WeakPolarHBondContact CA-O 3.24Å; L145-T475 WeakPolarHBondContact CB-O 3.44Å; L145-T475 PolarHBondContact N-O 3.32Å
146	L	47.8	Very low	40.6	Very low	93 Å²	93	118.5 Å²	118.5	49%	0.487	65%	0.653	S	S	.	*	G	3₁₀ helix	trans	-119	32.6	177.5	-92.5	154.8	0	0	0	114.8	K144 T475 T477	K144-L146 PolarHBondContact O-N 3.48Å; L146-T475 PolarHBondContact N-O 2.94Å; L146-T477 VanDerWaalsContact CB-N 3.34Å; L146-T477 WeakPolarHBondContact CD1-O 3.41Å
147	L	39.8	Very low	40.2	Very low	138 Å²	138	118.2 Å²	118.2	72%	0.723	65%	0.646	S	S	*	*			trans	-113.1	77.2	143.1	-82.4	88.7	0	0	0	108.1	K144	K144-L147 PolarHBondContact O-N 3.48Å
148	A	32.1	Very low	39.9	Very low	78 Å²	78	116.7 Å²	116.7	65%	0.645	64%	0.639	S	S	*	*				79.5	175.7	66	0	0	0	0	0	112.3
149	P	49.9	Very low	39.4	Very low	123 Å²	123	119 Å²	119	80%	0.799	64%	0.643	S	S	*	*				-134.8	156	-113.6	33.3	-11.6	0	0	0	118.1
150	A	33.1	Very low	38.7	Very low	97 Å²	97	121.5 Å²	121.5	80%	0.802	66%	0.657	S	S	*	*			trans	-160	130.8	152	0	0	0	0	0	109
151	N	34.1	Very low	37.8	Very low	152 Å²	152	121.7 Å²	121.7	81%	0.813	67%	0.67	S	S	*	*			cis	95.9	134.4	15.1	-154.7	5.6	0	0	0	115.7
152	S	38.3	Very low	36.6	Very low	89 Å²	89	120.2 Å²	120.2	62%	0.622	68%	0.681	S	S	*	*			trans	67.2	152.3	-178.3	82.7	0	0	0	0	116
153	Q	32.4	Very low	35.8	Very low	152 Å²	152	125 Å²	125	71%	0.71	70%	0.697	S	S	*	*			cis	-141.7	155.4	14.4	-66.7	-69.3	-6.3	0	0	107.7
154	L	34.3	Very low	35	Very low	143 Å²	143	125.1 Å²	125.1	75%	0.749	71%	0.714	S	S	*	*			cis	-148.1	167.3	-6.3	-91	155.3	0	0	0	105.6
155	S	26.5	Very low	33.7	Very low	91 Å²	91	127.2 Å²	127.2	64%	0.636	73%	0.726	S	S	*	*				63.8	137.9	54.8	-136.9	0	0	0	0	114.7
156	Y	25.9	Very low	32.6	Very low	189 Å²	189	126.1 Å²	126.1	74%	0.741	72%	0.721	S	S	*	*			cis	-160.9	158.5	25.9	-151	-27.7	0	0	0	111
157	N	30.6	Very low	31.7	Very low	107 Å²	107	129.6 Å²	129.6	57%	0.572	73%	0.734	S	S	*	*			trans	82	143.8	155	-66.3	-44.2	0	0	0	119.3
158	Q	31.6	Very low	31.1	Very low	141 Å²	141	127.2 Å²	127.2	66%	0.659	73%	0.734	S	S	*	*			cis	-163.1	154.7	-19.4	-127.1	174.3	32.2	0	0	112.7
159	Y	29.5	Very low	31	Very low	187 Å²	187	127.6 Å²	127.6	73%	0.733	74%	0.737	S	S	*	*			trans	61.7	127	152.2	-77.2	-57.9	0	0	0	124.9
160	T	30	Very low	30	Very low	138 Å²	138	124.4 Å²	124.4	85%	0.847	72%	0.718	S	S	*	*			trans	68.8	149.4	146.5	59.3	0	0	0	0	120.8
161	G	27.2	Very low	29.9	Very low	76 Å²	76	122.8 Å²	122.8	78%	0.784	70%	0.701	S	S	*	*			cis	148.1	97.7	-16.5	0	0	0	0	0	118.4
162	G	28.3	Very low	29.8	Very low	75 Å²	75	120.9 Å²	120.9	77%	0.773	69%	0.691	S	S	*	*			trans	92.3	155.9	136	0	0	0	0	0	121.5
163	K	27.5	Very low	29.6	Very low	209 Å²	209	124.2 Å²	124.2	91%	0.909	70%	0.696	S	S	*	*			trans	71.3	131.7	169.6	-55.1	-177.9	-178.9	-179.8	0	116.4
164	A	29.8	Very low	29.5	Very low	89 Å²	89	127.8 Å²	127.8	74%	0.736	70%	0.703	S	S	*	*			cis	105.9	123.1	13	0	0	0	0	0	116.3
165	Q	29.9	Very low	29.4	Very low	165 Å²	165	127.1 Å²	127.1	77%	0.771	70%	0.699	S	S	*	*			trans	72.8	125.9	146.2	-149.6	-177.3	-35.6	0	0	119.4
166	N	26.6	Very low	29.6	Very low	117 Å²	117	133.8 Å²	133.8	63%	0.626	71%	0.71	S	S	*	*				158.8	132.4	118.2	-81.8	-58.5	0	0	0	116.6
167	H	27.4	Very low	30.4	Very low	166 Å²	166	129.9 Å²	129.9	77%	0.769	71%	0.708	S	S	*	*			trans	44.2	119.7	142.6	-60.2	-59	0	0	0	126.1
168	A	28.3	Very low	31.1	Very low	88 Å²	88	130.4 Å²	130.4	73%	0.727	72%	0.717	S	S	*	*				79.4	107.7	115.9	0	0	0	0	0	124.6
169	A	30.6	Very low	31.4	Very low	85 Å²	85	129.6 Å²	129.6	70%	0.702	72%	0.724	S	S	*	*				78	164.3	113.2	0	0	0	0	0	124.3
170	S	27.3	Very low	31.3	Very low	57 Å²	57	125.2 Å²	125.2	40%	0.399	73%	0.726	S	S	.	*			trans	80.5	111.6	159.5	-91.7	0	0	0	0	120.8
171	S	31.7	Very low	31.5	Very low	63 Å²	63	125.2 Å²	125.2	44%	0.441	73%	0.726	S	S	.	*				80.2	140.6	75	174.7	0	0	0	0	113.3	R731	S171-R731 PolarHBondContact O-NE 3.37Å; S171-R731 PolarHBondContact O-NH2 2.96Å
172	N	31.9	Very low	31.6	Very low	112 Å²	112	127.6 Å²	127.6	60%	0.599	73%	0.725	S	S	*	*			cis	-158.8	170.5	-13.7	-105.6	-18.7	0	0	0	113.4
173	H	35.4	Very low	31.8	Very low	159 Å²	159	132.9 Å²	132.9	74%	0.736	73%	0.727	S	S	*	*			trans	-18.2	155.6	168.1	-21.5	-58.9	0	0	0	121.4
174	R	29.4	Very low	31.9	Very low	227 Å²	227	128.1 Å²	128.1	86%	0.857	72%	0.715	S	S	*	*			trans	-147.1	106.4	132.8	-137.9	166.8	-166.5	-157.4	0.8	116.4
175	I	33.2	Very low	31.7	Very low	128 Å²	128	131.5 Å²	131.5	66%	0.656	72%	0.716	S	S	*	*			trans	62.3	116.5	133.4	-61.3	-179.8	0	0	0	120.5
176	R	30.1	Very low	31.9	Very low	232 Å²	232	128.8 Å²	128.8	88%	0.875	72%	0.715	S	S	*	*				25.9	166.7	120.6	-85.7	-178.8	179.1	171.3	-1.3	121.1
177	P	41.6	Very low	32.5	Very low	107 Å²	107	128.2 Å²	128.2	70%	0.695	72%	0.717	S	S	*	*			cis	-131.4	-179	-19.5	33.7	-13.1	0	0	0	113.2
178	P	46.7	Very low	32.6	Very low	118 Å²	118	131.6 Å²	131.6	77%	0.766	72%	0.724	S	S	*	*			trans	-83.8	178.4	172.1	36.5	-38.5	0	0	0	113
179	P	37	Very low	32.7	Very low	123 Å²	123	133.9 Å²	133.9	80%	0.799	72%	0.724	S	S	*	*				-148.8	168	120	41.2	-27.4	0	0	0	117.9
180	A	26.8	Very low	32.6	Very low	95 Å²	95	132.6 Å²	132.6	79%	0.785	72%	0.719	S	S	*	*			trans	69.8	111	141.3	0	0	0	0	0	122.5
181	V	35.6	Very low	32.6	Very low	139 Å²	139	139.4 Å²	139.4	84%	0.842	74%	0.741	S	S	*	*			trans	-68.9	132.8	154.5	171.7	0	0	0	0	112.1
182	V	29.6	Very low	32.5	Very low	126 Å²	126	140.7 Å²	140.7	76%	0.764	76%	0.756	S	S	*	*			trans	-144	117.7	145.9	-172.5	0	0	0	0	104.2
183	K	31.6	Very low	32.3	Very low	185 Å²	185	147.4 Å²	147.4	80%	0.804	77%	0.772	S	S	*	*				70.1	156.3	65	-143.8	-176.5	-176.1	-171.3	0	112.3
184	T	30.4	Very low	31.9	Very low	109 Å²	109	143.3 Å²	143.3	67%	0.669	77%	0.773	S	S	*	*			trans	71.6	137.1	-177.2	-58.7	0	0	0	0	114.3
185	E	25.6	Very low	31.8	Very low	161 Å²	161	135.9 Å²	135.9	75%	0.752	77%	0.768	S	S	*	*			cis	-160.1	159.7	-31.5	-113.2	133	-107.8	0	0	108.4
186	S	34.1	Very low	31.6	Very low	107 Å²	107	136 Å²	136	75%	0.748	78%	0.78	S	S	*	*			trans	-86.7	145.6	169.9	62	0	0	0	0	111.2
187	P	37.8	Very low	31.5	Very low	105 Å²	105	128.9 Å²	128.9	68%	0.682	78%	0.778	S	S	*	*				-146.9	139	117.6	35.8	-20.4	0	0	0	116.3
188	W	29.1	Very low	31	Very low	238 Å²	238	132.5 Å²	132.5	90%	0.902	79%	0.786	S	S	*	*			trans	67.3	118.9	130.5	-67.2	18.3	0	0	0	118.6
189	N	30.8	Very low	30.1	Very low	135 Å²	135	134.6 Å²	134.6	72%	0.722	79%	0.785	S	S	*	*				74.7	122.9	91.2	-174.3	36	0	0	0	113.4
190	G	28.3	Very low	29.7	Very low	58 Å²	58	135.9 Å²	135.9	60%	0.598	79%	0.786	S	S	*	*			cis	151.6	178.2	1.3	0	0	0	0	0	111
191	K	28.5	Very low	30	Very low	201 Å²	201	141.9 Å²	141.9	87%	0.874	79%	0.788	S	S	*	*			trans	66	159.8	175.6	-57.2	169.2	-177.6	176.2	0	115
192	A	29	Very low	30.1	Very low	90 Å²	90	141.1 Å²	141.1	74%	0.744	79%	0.786	S	S	*	*			cis	-170.5	167.2	-29.5	0	0	0	0	0	109
193	R	28.9	Very low	30	Very low	252 Å²	252	140.9 Å²	140.9	95%	0.951	79%	0.785	S	S	*	*			trans	68.2	141.2	168.7	-171.9	-173.5	-69.8	-135.8	-0.1	114.8
194	G	27	Very low	30	Very low	73 Å²	73	143.9 Å²	143.9	75%	0.753	79%	0.791	S	S	*	*			cis	156.2	160.4	-8.3	0	0	0	0	0	111.4
195	G	27.1	Very low	30.5	Very low	72 Å²	72	150.2 Å²	150.2	74%	0.742	80%	0.802	S	S	*	*			trans	111.3	114.2	163.2	0	0	0	0	0	118.4
196	S	28.1	Very low	31.6	Very low	131 Å²	131	146.6 Å²	146.6	92%	0.916	79%	0.793	S	S	*	*			trans	39.6	125.9	139.4	58.4	0	0	0	0	122.8
197	G	27.8	Very low	31.5	Very low	81 Å²	81	148 Å²	148	84%	0.835	80%	0.801	S	S	*	*			trans	-177.8	126.5	155	0	0	0	0	0	111.1
198	Q	30.6	Very low	32.1	Very low	184 Å²	184	147.3 Å²	147.3	86%	0.86	80%	0.795	S	S	*	*			trans	-90.5	147	177.3	-73	-167	-6.3	0	0	111.7
199	Q	29.4	Very low	33	Very low	161 Å²	161	142.5 Å²	142.5	75%	0.752	78%	0.783	S	S	*	*				177.6	164.3	103.2	-95.7	-169.8	5.3	0	0	113.5
200	N	28.6	Very low	33.6	Very low	151 Å²	151	143.6 Å²	143.6	81%	0.807	79%	0.788	S	S	*	*			trans	71.2	137	161.2	-63	-39.5	0	0	0	120.4
201	R	33	Very low	34.5	Very low	221 Å²	221	146.9 Å²	146.9	83%	0.834	79%	0.791	S	S	*	*			trans	-149	134.9	177.1	-162.8	-170.6	-163.3	-174.3	7.1	107.6
202	P	37	Very low	35.1	Very low	122 Å²	122	143.7 Å²	143.7	79%	0.792	78%	0.777	S	S	*	*			trans	-108.3	124	134.6	-11.8	30	0	0	0	108.2
203	V	28.2	Very low	35.7	Very low	122 Å²	122	148 Å²	148	74%	0.739	78%	0.775	S	S	*	*				63	97.5	70.9	-177.7	0	0	0	0	111.3
204	R	29.9	Very low	36.2	Very low	248 Å²	248	143.2 Å²	143.2	94%	0.936	77%	0.768	S	S	*	*			trans	-130.6	125.9	158.3	-111.1	-169.1	177.9	-174.3	-0.7	107.8
205	R	41.2	Very low	37.1	Very low	241 Å²	241	145.2 Å²	145.2	91%	0.909	77%	0.765	S	S	*	*			trans	-161.2	163	168.3	-86.6	-170.2	177	165.2	-2.9	107.1
206	P	48.7	Very low	37.5	Very low	86 Å²	86	145.1 Å²	145.1	56%	0.558	76%	0.758	S	S	*	*			cis	-118.9	165.3	-12.4	37.5	-24.5	0	0	0	113
207	C	33.2	Very low	37.8	Very low	136 Å²	136	144.5 Å²	144.5	92%	0.919	75%	0.749	S	S	*	*			trans	-140.4	54.2	160.3	-61.3	0	0	0	0	109
208	T	50.3	Low	38.3	Very low	90 Å²	90	147.5 Å²	147.5	55%	0.552	75%	0.745	S	S	*	*			trans	-148.1	62.5	-174.4	55	0	0	0	0	111.1
209	E	47.7	Very low	38.4	Very low	137 Å²	137	146.5 Å²	146.5	64%	0.64	75%	0.746	S	S	*	*	S	Bend	trans	-105.9	-41.9	170.3	-61	-161.2	142	0	0	111.4	L211 K212 Y213	E209-L211 VanDerWaalsContact C-N 3.27Å; E209-L211 PolarHBondContact O-N 3.2Å; E209-K212 WeakPolarHBondContact O-CA 3.37Å; E209-K212 WeakPolarHBondContact O-CB 3.47Å; E209-K212 PolarHBondContact O-N 2.88Å; E209-Y213 VanDerWaalsContact O-CD2 3.31Å; E209-Y213 WeakPolarHBondContact O-CD2 3.15Å
210	L	44.2	Very low	38.6	Very low	158 Å²	158	146.7 Å²	146.7	83%	0.827	75%	0.75	S	S	*	*	H	α-helix	trans	-60	-34.1	172	-69.8	170	0	0	0	113.2	K212	L210-K212 PolarHBondContact O-N 3.48Å
211	L	47.2	Very low	38.8	Very low	128 Å²	128	146.6 Å²	146.6	67%	0.67	75%	0.749	S	S	*	*	H	α-helix	trans	-74.9	-3.3	174.4	-156.5	70.9	0	0	0	113.4	E209	E209-L211 VanDerWaalsContact C-N 3.27Å; E209-L211 PolarHBondContact O-N 3.2Å
212	K	39.9	Very low	38.9	Very low	133 Å²	133	142.8 Å²	142.8	58%	0.578	75%	0.745	S	S	*	*	H	α-helix	trans	-93.6	-23.9	179.1	-168.6	-170.3	169.1	-161.3	0	112.4	E209 L210 A216	E209-K212 WeakPolarHBondContact O-CA 3.37Å; E209-K212 WeakPolarHBondContact O-CB 3.47Å; E209-K212 PolarHBondContact O-N 2.88Å; L210-K212 PolarHBondContact O-N 3.48Å; K212-A216 WeakPolarHBondContact O-CB 3.43Å
213	Y	41.1	Very low	38.4	Very low	181 Å²	181	144.2 Å²	144.2	71%	0.71	74%	0.74	S	S	*	*	H	α-helix	trans	-93.5	-18.4	-176.5	-72	-80.1	0	0	0	114.2	E209	E209-Y213 VanDerWaalsContact O-CD2 3.31Å; E209-Y213 WeakPolarHBondContact O-CD2 3.15Å
214	L	40.5	Very low	38.4	Very low	152 Å²	152	142 Å²	142	80%	0.796	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	-0.8	179.6	-78.3	167.1	0	0	0	114.9
215	T	44.6	Very low	38.3	Very low	114 Å²	114	138.9 Å²	138.9	70%	0.699	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-141.1	41.4	-178.6	68.4	0	0	0	0	111.7
216	A	36.2	Very low	37.7	Very low	70 Å²	70	129.6 Å²	129.6	58%	0.579	70%	0.696	S	S	*	*			trans	-129	29.2	-167.8	0	0	0	0	0	115.1	K212	K212-A216 WeakPolarHBondContact O-CB 3.43Å
217	T	34.8	Very low	36.8	Very low	119 Å²	119	130.3 Å²	130.3	73%	0.73	70%	0.703	S	S	*	*			trans	-148.3	131.6	160.6	34.8	0	0	0	0	105.2
218	D	37.9	Very low	36.6	Very low	143 Å²	143	130.1 Å²	130.1	77%	0.765	69%	0.693	S	S	*	*	S	Bend	cis	-134.2	-160.5	14.3	-74.1	-57.3	0	0	0	113.5
219	D	33.1	Very low	35.7	Very low	164 Å²	164	130.5 Å²	130.5	88%	0.877	70%	0.704	S	S	*	*			trans	73.3	83.5	167.5	-67	-19	0	0	0	119.7
220	I	34.2	Very low	34.9	Very low	164 Å²	164	133 Å²	133	84%	0.841	71%	0.713	S	S	*	*			trans	-97.8	109.5	159.4	-64.6	164.9	0	0	0	109
221	L	31.9	Very low	34.2	Very low	150 Å²	150	130.4 Å²	130.4	79%	0.785	71%	0.708	S	S	*	*			trans	174.9	143.9	134.8	-98.7	161.9	0	0	0	117.4
222	L	34.2	Very low	33.3	Very low	141 Å²	141	127.7 Å²	127.7	74%	0.738	70%	0.704	S	S	*	*			trans	76	90.3	155.7	-60.7	177.2	0	0	0	123.2
223	H	28.3	Very low	32.7	Very low	151 Å²	151	133.7 Å²	133.7	70%	0.699	72%	0.724	S	S	*	*				21.2	145.9	106.6	-60.4	-89.3	0	0	0	121
224	T	28.2	Very low	32.1	Very low	77 Å²	77	128.8 Å²	128.8	47%	0.472	73%	0.728	S	S	.	*			cis	-174.4	143.3	-1.7	22.4	0	0	0	0	113.4	V681	T224-V681 WeakPolarHBondContact O-CG1 3.49Å; T224-V681 WeakPolarHBondContact O-CG2 3.46Å
225	K	27.4	Very low	31.3	Very low	182 Å²	182	125.2 Å²	125.2	79%	0.791	73%	0.728	S	S	*	*			trans	55.3	110	131.3	-168.7	-165.7	178.8	-173.2	0	124.6
226	A	27.8	Very low	31.6	Very low	46 Å²	46	125.6 Å²	125.6	38%	0.38	73%	0.732	S	S	.	*			trans	-179.2	127	138.8	0	0	0	0	0	109.7	V681	A226-V681 HydrophobicContact CB-CG1 4.05Å; A226-V681 VanDerWaalsContact N-CG1 3.34Å
227	S	30.5	Very low	31.2	Very low	101 Å²	101	127.6 Å²	127.6	71%	0.706	74%	0.742	S	S	*	*			cis	95.4	115.3	40.2	73.4	0	0	0	0	115.4
228	D	28	Very low	30.9	Very low	132 Å²	132	127 Å²	127	71%	0.706	74%	0.743	S	S	*	*			trans	-79	163.3	-165.7	-49.5	-102.8	0	0	0	118.6	P684	D228-P684 VanDerWaalsContact OD1-CB 3.25Å; D228-P684 WeakPolarHBondContact OD1-CB 3.4Å
229	A	32.5	Very low	30.6	Very low	97 Å²	97	131.2 Å²	131.2	80%	0.802	75%	0.748	S	S	*	*			trans	-158.9	112.4	151.2	0	0	0	0	0	116.6
230	K	29.6	Very low	30.3	Very low	189 Å²	189	130.3 Å²	130.3	82%	0.822	74%	0.743	S	S	*	*				77.5	97.9	119.6	-162.3	172.3	-177.9	179.5	0	122.9
231	S	30	Very low	30.3	Very low	104 Å²	104	131 Å²	131	73%	0.727	74%	0.74	S	S	*	*				40.7	149.8	122.4	75.6	0	0	0	0	122.3
232	A	29.6	Very low	30.1	Very low	71 Å²	71	129.2 Å²	129.2	59%	0.587	74%	0.74	S	S	*	*			cis	-176.2	-173.6	3.5	0	0	0	0	0	111.4
233	W	27	Very low	29.8	Very low	260 Å²	260	127.4 Å²	127.4	99%	0.985	74%	0.739	S	S	*	*			trans	70.3	152	174.1	-40.1	92	0	0	0	114.6
234	G	27.1	Very low	30	Very low	78 Å²	78	129 Å²	129	80%	0.804	75%	0.752	S	S	*	*			cis	179.3	160.4	-6.3	0	0	0	0	0	109.9
235	G	23.9	Very low	30	Very low	77 Å²	77	128.5 Å²	128.5	79%	0.794	76%	0.762	S	S	*	*			trans	-114.5	-165.9	172.4	0	0	0	0	0	112.1
236	P	51.9	Low	30.1	Very low	121 Å²	121	128.6 Å²	128.6	79%	0.786	77%	0.771	S	S	*	*			cis	-136.9	-162.9	-2.7	43.3	-25.6	0	0	0	113.9
237	S	26.5	Very low	30.2	Very low	112 Å²	112	131.7 Å²	131.7	78%	0.783	79%	0.789	S	S	*	*			trans	71.8	159	165	81.2	0	0	0	0	117.3
238	S	28.9	Very low	30	Very low	108 Å²	108	131.3 Å²	131.3	76%	0.755	79%	0.792	S	S	*	*			cis	-159.9	162	-22.5	45.2	0	0	0	0	111.9
239	R	32.2	Very low	30.1	Very low	231 Å²	231	130.6 Å²	130.6	87%	0.872	80%	0.797	S	S	*	*			trans	-3.3	130.4	164.2	-61	176.3	178.3	177.1	-1.4	119.7
240	D	27.1	Very low	30	Very low	145 Å²	145	130.7 Å²	130.7	78%	0.775	79%	0.792	S	S	*	*				-174.4	173.7	116	-97.7	-16	0	0	0	110.4
241	K	33.2	Very low	30.1	Very low	179 Å²	179	127 Å²	127	78%	0.778	79%	0.79	S	S	*	*			cis	176.6	95.5	-43.4	177.1	-178.2	178.3	-172.6	0	111.9
242	S	28.2	Very low	30	Very low	112 Å²	112	126.9 Å²	126.9	78%	0.783	79%	0.789	S	S	*	*			trans	-179	146.9	162.7	49.1	0	0	0	0	110.7
243	S	28.4	Very low	30	Very low	102 Å²	102	128.9 Å²	128.9	71%	0.713	80%	0.799	S	S	*	*			cis	117.6	99.3	-5.1	77.4	0	0	0	0	116.5
244	L	31.9	Very low	30.1	Very low	185 Å²	185	121.9 Å²	121.9	97%	0.969	79%	0.79	S	S	*	*			trans	68.2	143.2	165	-45.3	176.5	0	0	0	116.1
245	G	28.7	Very low	31.2	Very low	67 Å²	67	123.8 Å²	123.8	69%	0.691	79%	0.788	S	S	*	*			cis	-166.2	160	-7.5	0	0	0	0	0	108.9
246	L	29.9	Very low	31.4	Very low	184 Å²	184	124.6 Å²	124.6	96%	0.963	78%	0.781	S	S	*	*				-174.1	177.1	88	-87.2	172.5	0	0	0	112
247	S	29.5	Very low	30.3	Very low	111 Å²	111	124.4 Å²	124.4	78%	0.776	78%	0.783	S	S	*	*			trans	-85.7	154.8	-161.9	54.4	0	0	0	0	119.5
248	A	26.9	Very low	30.4	Very low	92 Å²	92	123.7 Å²	123.7	76%	0.76	78%	0.778	S	S	*	*				-168.3	139.8	129.1	0	0	0	0	0	114.4
249	S	29.3	Very low	30.4	Very low	117 Å²	117	124.2 Å²	124.2	82%	0.818	78%	0.782	S	S	*	*			trans	24.4	151	143.4	-50.2	0	0	0	0	123.6
250	S	29.8	Very low	30.1	Very low	99 Å²	99	120.4 Å²	120.4	69%	0.692	79%	0.785	S	S	*	*			cis	-173.9	155.5	-12.6	-85.6	0	0	0	0	110.9
251	S	31.2	Very low	30.2	Very low	112 Å²	112	119 Å²	119	78%	0.783	79%	0.786	S	S	*	*			trans	49.5	148.4	150.1	52.7	0	0	0	0	122.7
252	S	29.3	Very low	30.1	Very low	101 Å²	101	115.3 Å²	115.3	71%	0.706	78%	0.783	S	S	*	*			cis	-173	156.6	-11.6	48.9	0	0	0	0	112.8
253	S	28.4	Very low	30.1	Very low	113 Å²	113	118.8 Å²	118.8	79%	0.79	78%	0.784	S	S	*	*			trans	59.3	129.6	150.7	53.5	0	0	0	0	123.2
254	S	30.3	Very low	30.1	Very low	114 Å²	114	118.7 Å²	118.7	80%	0.797	78%	0.784	S	S	*	*			trans	-99.8	-156.8	163.2	-34	0	0	0	0	109.6
255	P	48.7	Very low	29.9	Very low	117 Å²	117	114.5 Å²	114.5	76%	0.76	77%	0.77	S	S	*	*			cis	-128.8	-161.5	7.8	29.3	-0.6	0	0	0	112.2
256	S	27.9	Very low	29.7	Very low	94 Å²	94	119 Å²	119	66%	0.657	78%	0.777	S	S	*	*			cis	-165.5	154.2	31.1	-59.8	0	0	0	0	115.2
257	S	30.2	Very low	29.4	Very low	117 Å²	117	114.7 Å²	114.7	82%	0.818	76%	0.763	S	S	*	*			trans	62.2	148.7	144.1	-61.5	0	0	0	0	120.9
258	S	28.5	Very low	29.2	Very low	98 Å²	98	114.3 Å²	114.3	69%	0.685	76%	0.76	S	S	*	*			cis	-163.5	121.5	-12.3	42.1	0	0	0	0	108.8
259	S	29.3	Very low	29	Very low	119 Å²	119	116.4 Å²	116.4	83%	0.832	76%	0.763	S	S	*	*				74.1	111.9	93.5	-50.7	0	0	0	0	115.9
260	T	25.1	Very low	28.7	Very low	151 Å²	151	116.4 Å²	116.4	93%	0.926	76%	0.763	S	S	*	*			trans	-127.5	144.1	155.2	52.4	0	0	0	0	109
261	S	29.8	Very low	28.5	Very low	116 Å²	116	117 Å²	117	81%	0.811	77%	0.768	S	S	*	*			trans	-124.2	137.4	-171.4	57.2	0	0	0	0	112.7
262	S	30	Very low	28.3	Very low	101 Å²	101	116.7 Å²	116.7	71%	0.706	77%	0.765	S	S	*	*			trans	-63.6	178.2	157.4	-43.2	0	0	0	0	110
263	F	29.3	Very low	28.1	Very low	184 Å²	184	116.8 Å²	116.8	81%	0.807	77%	0.766	S	S	*	*			cis	-168	168.9	28.4	39.9	-100.1	0	0	0	110.7
264	S	28.6	Very low	28.3	Very low	101 Å²	101	116.6 Å²	116.6	71%	0.706	76%	0.764	S	S	*	*			trans	32.1	162.3	139.1	-67.7	0	0	0	0	124.5
265	S	27.5	Very low	28.4	Very low	97 Å²	97	116 Å²	116	68%	0.678	76%	0.76	S	S	*	*			cis	-179.9	162	-24.2	-82.8	0	0	0	0	108.5
266	L	24.6	Very low	27.5	Very low	160 Å²	160	116.3 Å²	116.3	84%	0.838	76%	0.76	S	S	*	*			trans	74.3	110.6	158.7	-64.4	166.5	0	0	0	121.6
267	S	23.4	Very low	27.6	Very low	95 Å²	95	118.6 Å²	118.6	66%	0.664	77%	0.77	S	S	*	*				75.3	98.1	116.4	-56.8	0	0	0	0	124.2
268	S	25.6	Very low	27.7	Very low	103 Å²	103	117.5 Å²	117.5	72%	0.72	76%	0.763	S	S	*	*				78.1	139.3	114.1	-55.3	0	0	0	0	123.6
269	T	22.8	Very low	27.8	Very low	135 Å²	135	122.3 Å²	122.3	83%	0.828	77%	0.771	S	S	*	*			trans	73.7	150.9	167	87.8	0	0	0	0	115
270	S	23.1	Very low	27.9	Very low	118 Å²	118	126.3 Å²	126.3	83%	0.825	77%	0.774	S	S	*	*			cis	-138.6	-179.8	6.3	-73.6	0	0	0	0	112
271	S	25.3	Very low	28.3	Very low	112 Å²	112	127.9 Å²	127.9	78%	0.783	77%	0.768	S	S	*	*			trans	-87.6	165.3	-167	-42.7	0	0	0	0	117.7
272	S	25.7	Very low	28.3	Very low	105 Å²	105	127.9 Å²	127.9	73%	0.734	77%	0.768	S	S	*	*			trans	95.4	89	143.3	-55.4	0	0	0	0	121.9
273	S	26.8	Very low	28.2	Very low	103 Å²	103	127.5 Å²	127.5	72%	0.72	77%	0.771	S	S	*	*				68	131.9	118.2	66.4	0	0	0	0	124.4
274	S	31.3	Very low	28.5	Very low	108 Å²	108	125.2 Å²	125.2	76%	0.755	77%	0.771	S	S	*	*			trans	75.8	151.9	141.5	70.4	0	0	0	0	120.2
275	S	32.3	Very low	29.2	Very low	101 Å²	101	125.7 Å²	125.7	71%	0.706	77%	0.772	S	S	*	*			cis	-174.9	-175.5	-24	59.6	0	0	0	0	108.3
276	T	30.6	Very low	29.2	Very low	125 Å²	125	128.7 Å²	128.7	77%	0.767	78%	0.78	S	S	*	*			cis	-159.6	137.7	10	-20	0	0	0	0	110.7
277	T	30.4	Very low	29.3	Very low	141 Å²	141	132.2 Å²	132.2	87%	0.865	78%	0.782	S	S	*	*			trans	-157.1	149.3	171.7	43.8	0	0	0	0	111.4
278	S	31.8	Very low	29.4	Very low	94 Å²	94	131.4 Å²	131.4	66%	0.657	79%	0.788	S	S	*	*			cis	-164.7	151.1	-29.4	79.7	0	0	0	0	109.1
279	K	30.1	Very low	29.6	Very low	199 Å²	199	133.9 Å²	133.9	87%	0.865	79%	0.793	S	S	*	*			trans	65.4	131.4	176.3	-58.6	171.7	-175.5	171.3	0	113.9
280	K	32	Very low	30	Very low	203 Å²	203	138.1 Å²	138.1	88%	0.883	79%	0.793	S	S	*	*			cis	-148.8	168.2	2.5	-88.1	164.4	-177.7	174	0	106.2
281	K	34.1	Very low	30.1	Very low	185 Å²	185	138.6 Å²	138.6	80%	0.804	79%	0.791	S	S	*	*			cis	-168.1	137.7	-18.4	169.6	-151	169.8	-170.6	0	106.4
282	S	29	Very low	30.4	Very low	115 Å²	115	140.8 Å²	140.8	80%	0.804	79%	0.789	S	S	*	*			trans	68.2	146.9	175.3	-95.9	0	0	0	0	116.3
283	A	27.1	Very low	30.6	Very low	93 Å²	93	142.5 Å²	142.5	77%	0.769	79%	0.786	S	S	*	*			cis	-132	-171.3	-0.1	0	0	0	0	0	112.3
284	V	36.3	Very low	30.5	Very low	136 Å²	136	148.1 Å²	148.1	82%	0.824	79%	0.791	S	S	*	*			trans	-140.8	154.6	-161.6	163.1	0	0	0	0	108.1
285	P	44.2	Very low	30.1	Very low	111 Å²	111	150.6 Å²	150.6	72%	0.721	80%	0.795	S	S	*	*			cis	-115.5	-159.6	11.1	45.6	-33.8	0	0	0	112.7
286	L	26.2	Very low	29.7	Very low	161 Å²	161	151.6 Å²	151.6	84%	0.843	80%	0.801	S	S	*	*			cis	-141.8	-117.3	3.4	-167.1	60.9	0	0	0	112
287	R	26.6	Very low	29.3	Very low	234 Å²	234	149.9 Å²	149.9	88%	0.883	79%	0.794	S	S	*	*			trans	-153.5	138.7	-175.8	-79.3	-176.4	168.6	161.9	-4.2	112.8
288	G	25.7	Very low	29	Very low	77 Å²	77	152.9 Å²	152.9	79%	0.794	80%	0.795	S	S	*	*			trans	-97	164.6	154.1	0	0	0	0	0	111.1
289	L	31	Very low	28.8	Very low	155 Å²	155	156.8 Å²	156.8	81%	0.812	80%	0.803	S	S	*	*			trans	-110.2	143.5	-168.8	-141.9	78.7	0	0	0	114.2
290	R	29.8	Very low	28.5	Very low	224 Å²	224	157.1 Å²	157.1	85%	0.845	80%	0.804	S	S	*	*			trans	24.5	140.8	148.7	-73.4	179.1	171.3	175.1	-3.1	121.5
291	T	26.2	Very low	28.2	Very low	128 Å²	128	158.5 Å²	158.5	79%	0.785	80%	0.804	S	S	*	*			trans	-49.7	162.7	148.9	39.6	0	0	0	0	112.5
292	Q	31.3	Very low	27.7	Very low	158 Å²	158	156.2 Å²	156.2	74%	0.738	81%	0.805	S	S	*	*			cis	-167.7	152	40.6	-151.7	-176.5	31.8	0	0	113.1
293	Q	29.6	Very low	27.7	Very low	141 Å²	141	160.2 Å²	160.2	66%	0.659	81%	0.808	S	S	*	*			trans	63.8	141.5	145.9	-95.4	-175.3	47.1	0	0	125.2
294	R	25.3	Very low	28.6	Very low	221 Å²	221	161 Å²	161	83%	0.834	81%	0.805	S	S	*	*			trans	88.3	101.5	143.9	-78.7	-179.2	179.6	-143.4	-5.1	122.5
295	L	23	Very low	28.3	Very low	160 Å²	160	160.2 Å²	160.2	84%	0.838	80%	0.801	S	S	*	*				87.8	104.9	124.8	-148.1	73.1	0	0	0	120.5
296	C	23.3	Very low	27.4	Very low	123 Å²	123	161.1 Å²	161.1	83%	0.831	81%	0.805	S	S	*	*			trans	23.2	115.4	150.2	-57.1	0	0	0	0	120.7
297	S	22.8	Very low	27.8	Very low	88 Å²	88	160.8 Å²	160.8	62%	0.615	80%	0.803	S	S	*	*			trans	-104.7	139.5	161.6	179.9	0	0	0	0	112.7	H299	S297-H299 PolarHBondContact OG-CE1 3.11Å; S297-H299 VanDerWaalsContact OG-CE1 3.23Å; S297-H299 PolarHBondContact OG-ND1 3.26Å; S297-H299 VanDerWaalsContact OG-ND1 3.1Å
298	K	23.3	Very low	28.8	Very low	204 Å²	204	155.6 Å²	155.6	89%	0.887	80%	0.8	S	S	*	*			trans	-102.4	122.4	153.3	-76.4	179.7	179.4	173.1	0	107.5
299	H	27.7	Very low	29.1	Very low	177 Å²	177	159.2 Å²	159.2	82%	0.819	80%	0.8	S	S	*	*			trans	-128.6	141.6	172.7	-82.8	-0.3	0	0	0	113.6	S297	S297-H299 PolarHBondContact OG-CE1 3.11Å; S297-H299 VanDerWaalsContact OG-CE1 3.23Å; S297-H299 PolarHBondContact OG-ND1 3.26Å; S297-H299 VanDerWaalsContact OG-ND1 3.1Å
300	K	24.7	Very low	29.6	Very low	205 Å²	205	157.4 Å²	157.4	89%	0.891	80%	0.797	S	S	*	*			trans	-117.4	130.7	162.3	-76.6	-177.7	174.6	179.2	0	107.9
301	R	25.3	Very low	29.6	Very low	233 Å²	233	154.6 Å²	154.6	88%	0.879	80%	0.798	S	S	*	*			trans	37.8	115.9	136.6	-179.7	-167.7	177.8	166.1	0.6	119
302	T	23.8	Very low	29.9	Very low	137 Å²	137	154.7 Å²	154.7	84%	0.84	80%	0.799	S	S	*	*				-167.6	166.3	120.8	20.7	0	0	0	0	113.5
303	K	29.1	Very low	30.6	Very low	199 Å²	199	152.7 Å²	152.7	87%	0.865	80%	0.8	S	S	*	*			trans	-108.6	-165.5	171.7	-64.6	-175.6	173.2	-174.6	0	108.1
304	P	46.4	Very low	30.4	Very low	109 Å²	109	155 Å²	155	71%	0.708	81%	0.81	S	S	*	*			cis	-154.8	-169.3	13.3	48.4	-26.3	0	0	0	119.5
305	T	29.3	Very low	30.8	Very low	119 Å²	119	149.5 Å²	149.5	73%	0.73	81%	0.806	S	S	*	*			trans	63.1	145.7	152.3	-32.3	0	0	0	0	118.1
306	T	25.5	Very low	32	Very low	130 Å²	130	147 Å²	147	80%	0.798	80%	0.799	S	S	*	*				-161.2	176.6	50.8	-48.4	0	0	0	0	114.4
307	L	34.3	Very low	32.3	Very low	154 Å²	154	147.5 Å²	147.5	81%	0.806	79%	0.794	S	S	*	*			trans	-101.2	-177.8	-167.8	-77.3	173.7	0	0	0	113.8
308	P	48	Very low	32.8	Very low	126 Å²	126	149.5 Å²	149.5	82%	0.818	80%	0.797	S	S	*	*			cis	-149	-162.2	35.7	44.6	-20.2	0	0	0	120.1
309	L	30.8	Very low	33.5	Very low	153 Å²	153	147.7 Å²	147.7	80%	0.801	79%	0.792	S	S	*	*			trans	-113.7	173	-167.6	-65.9	163.9	0	0	0	114.2
310	P	42.4	Very low	33.7	Very low	116 Å²	116	149.3 Å²	149.3	75%	0.753	80%	0.797	S	S	*	*				-142.7	134.8	102	36.7	-21.7	0	0	0	114.6
311	L	29.2	Very low	34	Very low	165 Å²	165	143.1 Å²	143.1	86%	0.864	79%	0.791	S	S	*	*				87.7	147	86.4	-69.3	176.4	0	0	0	117.2
312	T	32.7	Very low	34.9	Very low	130 Å²	130	137.6 Å²	137.6	80%	0.798	79%	0.788	S	S	*	*			trans	-132.5	173.1	-171.1	54.4	0	0	0	0	112.6
313	P	45.3	Very low	35.5	Very low	117 Å²	117	135.9 Å²	135.9	76%	0.76	78%	0.779	S	S	*	*				-136.3	-178.1	108.9	42	-31.3	0	0	0	111.7
314	E	25.4	Very low	35.6	Very low	188 Å²	188	136.5 Å²	136.5	88%	0.879	78%	0.782	S	S	*	*			cis	-150.7	166.5	11	-153.2	168.3	174.4	0	0	111.2
315	S	34.3	Very low	35	Very low	107 Å²	107	138 Å²	138	75%	0.748	78%	0.78	S	S	*	*			trans	-168.3	146.8	-179.6	-176.6	0	0	0	0	110.8
316	P	48.2	Very low	35.3	Very low	107 Å²	107	139.6 Å²	139.6	70%	0.695	78%	0.784	S	S	*	*				-156.4	143	104.8	39.9	-21.5	0	0	0	115.1
317	N	29.3	Very low	36.1	Very low	134 Å²	134	141 Å²	141	72%	0.717	78%	0.779	S	S	*	*				-176.6	139.4	70.8	-81.6	-83.3	0	0	0	106.5
318	D	33.1	Very low	36.2	Very low	129 Å²	129	139.6 Å²	139.6	69%	0.69	78%	0.777	S	S	*	*				72.4	134.4	70.5	-92.1	-38	0	0	0	115.4
319	H	38.1	Very low	35.8	Very low	167 Å²	167	139.8 Å²	139.8	77%	0.773	77%	0.77	S	S	*	*			cis	-132	167.9	6	-69.9	-58.3	0	0	0	113.6
320	K	31.7	Very low	36	Very low	211 Å²	211	138.8 Å²	138.8	92%	0.917	76%	0.761	S	S	*	*			trans	-82.8	138.2	166.2	-69.6	-78.1	-173.2	-178.5	0	111.3
321	G	32.3	Very low	35.7	Very low	75 Å²	75	142.4 Å²	142.4	77%	0.773	76%	0.76	S	S	*	*			trans	-173.5	107.6	167.1	0	0	0	0	0	113.9
322	S	44.4	Very low	36.1	Very low	117 Å²	117	140.2 Å²	140.2	82%	0.818	75%	0.753	S	S	*	*			trans	-104.9	127.1	165.3	171.4	0	0	0	0	109
323	P	35.9	Very low	36.4	Very low	101 Å²	101	141.5 Å²	141.5	66%	0.656	75%	0.754	S	S	*	*			trans	-128.7	119.4	159	33.7	-18.7	0	0	0	111.5	E325	P323-E325 HydrophobicContact CB-CG 4.48Å; P323-E325 PolarHBondContact O-N 3.02Å
324	F	32	Very low	36	Very low	211 Å²	211	140.6 Å²	140.6	93%	0.925	75%	0.751	S	S	*	*			trans	-79	103.3	150.5	-99.7	-87.3	0	0	0	107.1
325	E	32.4	Very low	36.6	Very low	141 Å²	141	137.7 Å²	137.7	66%	0.659	75%	0.746	S	S	*	*			trans	-101.1	125.8	165.7	-80.6	-151.8	97.4	0	0	110.2	P323 K327	P323-E325 HydrophobicContact CB-CG 4.48Å; P323-E325 PolarHBondContact O-N 3.02Å; E325-K327 WeakPolarHBondContact OE1-CE 3.21Å; E325-K327 IonicContact OE1-NZ 2.66Å; E325-K327 PolarHBondContact OE1-NZ 3.02Å; E325-K327 IonicContact OE2-NZ 2.73Å; E325-K327 PolarHBondContact OE2-NZ 3.1Å
326	N	36.5	Very low	36.9	Very low	152 Å²	152	141.1 Å²	141.1	81%	0.813	75%	0.75	S	S	*	*			trans	-74.8	145	161.2	-68	-40.1	0	0	0	109.5
327	K	40.9	Very low	36.7	Very low	161 Å²	161	143.6 Å²	143.6	70%	0.7	76%	0.755	S	S	*	*			trans	-156.2	127.4	153.9	-116.4	147.1	-77.4	177.7	0	111	E325	E325-K327 WeakPolarHBondContact OE1-CE 3.21Å; E325-K327 IonicContact OE1-NZ 2.66Å; E325-K327 PolarHBondContact OE1-NZ 3.02Å; E325-K327 IonicContact OE2-NZ 2.73Å; E325-K327 PolarHBondContact OE2-NZ 3.1Å
328	T	37.7	Very low	37.1	Very low	124 Å²	124	141.7 Å²	141.7	76%	0.761	76%	0.758	S	S	*	*			trans	-90.6	168.9	176.5	-11.6	0	0	0	0	110.6
329	I	39.5	Very low	37.3	Very low	129 Å²	129	138.3 Å²	138.3	66%	0.662	75%	0.754	S	S	*	*			trans	79.9	121.6	150.5	-76.4	165.6	0	0	0	118.1
330	E	34.7	Very low	37.5	Very low	132 Å²	132	137.1 Å²	137.1	62%	0.617	76%	0.759	S	S	*	*			trans	44	117.4	148.7	-63.7	162.9	-154.9	0	0	120.8
331	R	36.2	Very low	38.2	Very low	193 Å²	193	133 Å²	133	73%	0.728	75%	0.754	S	S	*	*				-171.5	147.9	102.8	-101.4	145.5	-165.5	71.3	17.7	115.3
332	T	38	Very low	38.3	Very low	118 Å²	118	132.8 Å²	132.8	72%	0.724	75%	0.752	S	S	*	*			trans	-35.9	147.1	161.8	50.1	0	0	0	0	116.4
333	L	38.8	Very low	38.1	Very low	157 Å²	157	134.8 Å²	134.8	82%	0.822	75%	0.752	S	S	*	*				178.4	150.6	116.8	-94	164.6	0	0	0	113
334	S	35.9	Very low	38.5	Very low	99 Å²	99	136.3 Å²	136.3	69%	0.692	76%	0.76	S	S	*	*			trans	26.2	131.7	152.7	-52.4	0	0	0	0	121.3
335	V	39.1	Very low	40	Very low	127 Å²	127	131.7 Å²	131.7	77%	0.77	75%	0.751	S	S	*	*			cis	73.3	135.4	23.9	-172.7	0	0	0	0	115.8
336	E	40.3	Very low	40.7	Very low	178 Å²	178	130.1 Å²	130.1	83%	0.832	75%	0.753	S	S	*	*			trans	67	156.3	177.7	-77.4	166.5	-166.3	0	0	116.4
337	I	43.3	Very low	40.4	Very low	159 Å²	159	129.4 Å²	129.4	82%	0.815	75%	0.754	S	S	*	*			cis	-137.3	148.3	21.9	-61.9	165.3	0	0	0	107.2
338	A	39	Very low	40.4	Very low	94 Å²	94	128.2 Å²	128.2	78%	0.777	76%	0.761	S	S	*	*			cis	-155.5	-179.9	3.8	0	0	0	0	0	107.9
339	G	36.6	Very low	40.5	Very low	59 Å²	59	126.7 Å²	126.7	61%	0.608	75%	0.753	S	S	*	*			cis	131.9	111.4	-3.4	0	0	0	0	0	114.5
340	T	43.1	Very low	40.8	Very low	141 Å²	141	126.7 Å²	126.7	87%	0.865	76%	0.761	S	S	*	*			trans	69.4	161.2	163.7	69	0	0	0	0	118.8
341	P	46.6	Very low	40.8	Very low	126 Å²	126	129 Å²	129	82%	0.818	77%	0.771	S	S	*	*			cis	-138.2	174.5	-39	35.7	-19	0	0	0	115
342	G	33.1	Very low	40.9	Very low	70 Å²	70	129.4 Å²	129.4	72%	0.722	78%	0.779	S	S	*	*			trans	137.5	103	130.8	0	0	0	0	0	122.3
343	L	40.3	Very low	40.8	Very low	159 Å²	159	128 Å²	128	83%	0.832	78%	0.779	S	S	*	*				65.2	90	129.6	-55.5	-177.2	0	0	0	123.5
344	T	44.3	Very low	40.4	Very low	132 Å²	132	125.5 Å²	125.5	81%	0.81	77%	0.774	S	S	*	*				65.9	150.5	121.3	49.5	0	0	0	0	124.1
345	P	62.8	Low	40.2	Very low	114 Å²	114	128.4 Å²	128.4	74%	0.74	78%	0.777	S	S	*	*			trans	-102.9	-172	-168.5	44.2	-38.5	0	0	0	114.4
346	P	48.4	Very low	39.8	Very low	108 Å²	108	129.7 Å²	129.7	70%	0.701	78%	0.775	S	S	*	*				-154.5	-170.3	94.6	39.7	-19	0	0	0	117.2
347	T	30.3	Very low	39.9	Very low	137 Å²	137	127.8 Å²	127.8	84%	0.84	77%	0.77	S	S	*	*			trans	87.8	153.1	162	62.1	0	0	0	0	121.9
348	T	39.6	Very low	40.1	Very low	136 Å²	136	125.4 Å²	125.4	83%	0.834	77%	0.765	S	S	*	*			trans	-125.6	-163	-162.1	50.7	0	0	0	0	110.7
349	P	40.8	Very low	39.7	Very low	92 Å²	92	129.7 Å²	129.7	60%	0.597	77%	0.767	S	S	*	*				-116.8	-161.5	-75.3	40.4	-25.6	0	0	0	110.7
350	P	45.3	Very low	39.5	Very low	129 Å²	129	136.1 Å²	136.1	84%	0.838	78%	0.778	S	S	*	*			trans	-118.8	151.6	149	35.4	-27.1	0	0	0	113.6
351	H	34.3	Very low	38.9	Very low	180 Å²	180	133.8 Å²	133.8	83%	0.833	77%	0.773	S	S	*	*			trans	-111.3	171.3	-172.9	-103	-101.5	0	0	0	114.2
352	K	39.2	Very low	38.1	Very low	203 Å²	203	132.5 Å²	132.5	88%	0.883	77%	0.767	S	S	*	*			trans	-71.7	158.6	178.8	-57.5	-177.1	178.4	-175.7	0	114.8
353	A	35.1	Very low	38.1	Very low	88 Å²	88	136 Å²	136	73%	0.727	77%	0.768	S	S	*	*			trans	-138	134.8	140.2	0	0	0	0	0	106.8
354	S	30.3	Very low	37.5	Very low	104 Å²	104	136.7 Å²	136.7	73%	0.727	77%	0.765	S	S	*	*			cis	101.9	150.5	24.4	74.8	0	0	0	0	113.7
355	Q	32.6	Very low	36.9	Very low	161 Å²	161	136.3 Å²	136.3	75%	0.752	76%	0.762	S	S	*	*			trans	69.6	146.1	-174.9	-90.2	175.2	-58.6	0	0	115.7
356	E	29.7	Very low	35.3	Very low	153 Å²	153	139.1 Å²	139.1	72%	0.715	76%	0.763	S	S	*	*			cis	-148.2	158.8	-5.3	-165	146.6	-119	0	0	111.9
357	N	42.8	Very low	34.5	Very low	139 Å²	139	141.1 Å²	141.1	74%	0.743	77%	0.767	S	S	*	*			trans	-134.7	120.2	178.7	-155.4	-9.7	0	0	0	108.4
358	P	48.6	Very low	34.4	Very low	109 Å²	109	139.5 Å²	139.5	71%	0.708	76%	0.761	S	S	*	*			trans	-132.3	124	155	31.4	-16.1	0	0	0	113.3
359	F	29.9	Very low	33.8	Very low	183 Å²	183	137.6 Å²	137.6	80%	0.803	75%	0.753	S	S	*	*			trans	-50.2	157.9	153.1	-59.1	-95.7	0	0	0	109.5
360	K	32.2	Very low	33	Very low	195 Å²	195	138.2 Å²	138.2	85%	0.848	76%	0.759	S	S	*	*				177.6	172.1	56.1	-152.7	166.1	-172.5	171.6	0	110.3
361	A	29.7	Very low	32	Very low	91 Å²	91	137.3 Å²	137.3	75%	0.752	75%	0.754	S	S	*	*			trans	73.4	146.1	155.1	0	0	0	0	0	117.9
362	S	30.3	Very low	31.7	Very low	100 Å²	100	133.7 Å²	133.7	70%	0.699	75%	0.749	S	S	*	*			cis	-168.1	177.9	-18.6	-170.2	0	0	0	0	110.1
363	L	32.6	Very low	31.3	Very low	142 Å²	142	129.1 Å²	129.1	74%	0.743	74%	0.742	S	S	*	*			trans	78.9	119.4	166.8	-48.6	-179.3	0	0	0	115.1
364	K	28.8	Very low	30.9	Very low	175 Å²	175	129.1 Å²	129.1	76%	0.761	74%	0.743	S	S	*	*				80.1	109.8	50.8	-174.6	-171.4	179.6	-174.8	0	110.2
365	T	31.5	Very low	31	Very low	124 Å²	124	131.6 Å²	131.6	76%	0.761	75%	0.747	S	S	*	*				-168.6	128.4	89.9	-64.8	0	0	0	0	107.9
366	K	30.1	Very low	30.8	Very low	173 Å²	173	129.3 Å²	129.3	75%	0.752	74%	0.744	S	S	*	*			cis	83.3	127.3	45.7	-89.9	-72.9	-175	-176	0	115.6
367	L	30.6	Very low	30.6	Very low	149 Å²	149	126.2 Å²	126.2	78%	0.78	74%	0.738	S	S	*	*			trans	78.3	129.1	170.1	-55.1	178.7	0	0	0	114.2
368	S	27.7	Very low	30.1	Very low	103 Å²	103	128.6 Å²	128.6	72%	0.72	74%	0.742	S	S	*	*				76.7	148.8	54.5	91.6	0	0	0	0	113.1
369	S	26.8	Very low	29	Very low	96 Å²	96	135 Å²	135	67%	0.671	75%	0.752	S	S	*	*			cis	-164.4	156.7	9.8	-165.6	0	0	0	0	111.6
370	C	25.9	Very low	28.8	Very low	106 Å²	106	130.1 Å²	130.1	72%	0.716	75%	0.745	S	S	*	*			trans	39.4	154.3	148.1	72.5	0	0	0	0	125.9
371	C	23.9	Very low	28.7	Very low	110 Å²	110	131.8 Å²	131.8	74%	0.743	75%	0.746	S	S	*	*			trans	78.2	104.2	143.5	-72.6	0	0	0	0	123.9
372	S	27.2	Very low	28.8	Very low	103 Å²	103	134.1 Å²	134.1	72%	0.72	75%	0.745	S	S	*	*				84.7	133.7	108.6	-57.2	0	0	0	0	124.7
373	S	30.2	Very low	28.6	Very low	107 Å²	107	133.9 Å²	133.9	75%	0.748	74%	0.744	S	S	*	*			trans	76.2	104	133.1	61.3	0	0	0	0	123.9
374	A	27.9	Very low	28.7	Very low	89 Å²	89	135.1 Å²	135.1	74%	0.736	75%	0.746	S	S	*	*				70.7	177.9	117.7	0	0	0	0	0	121.8
375	L	31.1	Very low	29	Very low	156 Å²	156	135.2 Å²	135.2	82%	0.817	75%	0.754	S	S	*	*			trans	79.6	147.9	173	-45.3	-177.6	0	0	0	116.1
376	T	29	Very low	28.9	Very low	113 Å²	113	132.6 Å²	132.6	69%	0.693	75%	0.751	S	S	*	*			cis	-163.5	149.3	-15.8	18.9	0	0	0	0	113.9
377	C	26	Very low	29	Very low	87 Å²	87	129.9 Å²	129.9	59%	0.588	76%	0.761	S	S	*	*			trans	57.7	116.1	136.7	-69.8	0	0	0	0	125.4
378	K	31.3	Very low	29	Very low	189 Å²	189	126.5 Å²	126.5	82%	0.822	76%	0.762	S	S	*	*				81.4	138.7	116	-65.3	169.1	-174	162	0	122.6
379	R	26.1	Very low	29	Very low	244 Å²	244	126.2 Å²	126.2	92%	0.921	77%	0.766	S	S	*	*			trans	101.4	145.3	138.3	-156.2	179.9	-165.4	94.1	-3	117.1
380	A	26.7	Very low	29.1	Very low	80 Å²	80	130.2 Å²	130.2	66%	0.661	78%	0.779	S	S	*	*			cis	-176.3	167.1	-44.6	0	0	0	0	0	109.8
381	R	29.8	Very low	29.5	Very low	230 Å²	230	129.6 Å²	129.6	87%	0.868	78%	0.782	S	S	*	*			trans	75.1	156.1	163.3	-69.1	-165.8	172.4	-167	-3.8	117.9
382	L	30.3	Very low	30.4	Very low	140 Å²	140	130.4 Å²	130.4	73%	0.733	79%	0.785	S	S	*	*			cis	-174.4	169.9	-34.1	-118.3	176.8	0	0	0	109.8
383	S	27.9	Very low	30.5	Very low	95 Å²	95	129.7 Å²	129.7	66%	0.664	79%	0.786	S	S	*	*			trans	73.3	158.9	155.9	-64.8	0	0	0	0	120.2
384	E	33.7	Very low	30.9	Very low	169 Å²	169	130.7 Å²	130.7	79%	0.79	79%	0.79	S	S	*	*			cis	-170.2	178.5	-42.2	-132.9	176.6	141.1	0	0	111.9
385	L	35.7	Very low	30.9	Very low	176 Å²	176	129.7 Å²	129.7	92%	0.921	79%	0.788	S	S	*	*			trans	77.5	137.3	178.1	-56.3	166	0	0	0	116.9
386	G	28.5	Very low	31	Very low	69 Å²	69	127.4 Å²	127.4	71%	0.711	79%	0.792	S	S	*	*			cis	170.9	145	-12.4	0	0	0	0	0	115.9
387	A	33.8	Very low	31.2	Very low	117 Å²	117	127.5 Å²	127.5	97%	0.967	80%	0.797	S	S	*	*			trans	61.3	144.5	170	0	0	0	0	0	119
388	G	28.7	Very low	31.3	Very low	77 Å²	77	128.2 Å²	128.2	79%	0.794	81%	0.809	S	S	*	*			cis	-170.9	-179.3	-4.2	0	0	0	0	0	109.7
389	A	28.4	Very low	31.1	Very low	97 Å²	97	123.3 Å²	123.3	80%	0.802	81%	0.812	S	S	*	*			cis	-161.3	177.5	3	0	0	0	0	0	112
390	L	29.4	Very low	31.3	Very low	181 Å²	181	115.3 Å²	115.3	95%	0.948	81%	0.805	S	S	*	*			trans	79.5	153.3	174.5	-58.5	178.1	0	0	0	118.4
391	A	33.2	Very low	32.2	Very low	93 Å²	93	117.5 Å²	117.5	77%	0.769	81%	0.813	S	S	*	*			trans	-162.4	-176.4	-155.3	0	0	0	0	0	108.9
392	P	42.9	Very low	32.2	Very low	126 Å²	126	110.9 Å²	110.9	82%	0.818	81%	0.807	S	S	*	*			cis	-133.9	-178.5	5.8	41	-21.5	0	0	0	116.9
393	A	29.5	Very low	32.4	Very low	89 Å²	89	115.5 Å²	115.5	74%	0.736	82%	0.815	S	S	*	*			trans	-91	-158.1	176.4	0	0	0	0	0	111.1
394	P	38.9	Very low	32.7	Very low	128 Å²	128	121 Å²	121	83%	0.831	83%	0.827	S	S	*	*			cis	-126.3	-169.7	-6.4	38.7	-18.3	0	0	0	112.7
395	G	28.7	Very low	32.5	Very low	68 Å²	68	116 Å²	116	70%	0.701	82%	0.821	S	S	*	*			cis	118.3	153.9	-1.6	0	0	0	0	0	114.6
396	A	31.9	Very low	33.3	Very low	108 Å²	108	112.9 Å²	112.9	89%	0.893	81%	0.811	S	S	*	*			trans	84.3	149	166.1	0	0	0	0	0	120.3
397	S	32.8	Very low	33.5	Very low	115 Å²	115	116.8 Å²	116.8	80%	0.804	81%	0.811	S	S	*	*			cis	-173.6	167.9	-24.5	-164.3	0	0	0	0	113.1
398	A	28.7	Very low	33.5	Very low	102 Å²	102	118.4 Å²	118.4	84%	0.843	80%	0.798	S	S	*	*			trans	78.1	139.2	143.6	0	0	0	0	0	122.6
399	G	28.4	Very low	34.1	Very low	85 Å²	85	119.9 Å²	119.9	88%	0.876	79%	0.792	S	S	*	*			trans	157.3	92.4	158.4	0	0	0	0	0	117.4
400	G	28.4	Very low	34.4	Very low	76 Å²	76	123.1 Å²	123.1	78%	0.784	79%	0.791	S	S	*	*			trans	-118.2	-165.9	151.1	0	0	0	0	0	109.4
401	P	47.7	Very low	34.5	Very low	127 Å²	127	121.3 Å²	121.3	83%	0.825	78%	0.781	S	S	*	*			cis	-139.7	174.2	1.9	43.2	-25.8	0	0	0	116.4
402	A	29.1	Very low	34.7	Very low	90 Å²	90	126.6 Å²	126.6	74%	0.744	78%	0.783	S	S	*	*			trans	25.1	146.6	146	0	0	0	0	0	125.4
403	R	34	Very low	34.4	Very low	238 Å²	238	124.7 Å²	124.7	90%	0.898	78%	0.777	S	S	*	*			trans	85.1	109.1	156.7	-57.2	-170.4	177.1	-152.7	-1.8	119.8
404	K	34.8	Very low	34.7	Very low	210 Å²	210	127.9 Å²	127.9	91%	0.913	78%	0.777	S	S	*	*				167.6	151.1	113.1	-95	-178.7	178.5	-173.9	0	112.1
405	G	29.7	Very low	34.4	Very low	64 Å²	64	128.7 Å²	128.7	66%	0.66	77%	0.774	S	S	*	*			trans	-119.3	-167.9	142.8	0	0	0	0	0	108.8
406	P	52.4	Low	34.3	Very low	111 Å²	111	129.8 Å²	129.8	72%	0.721	77%	0.77	S	S	*	*			cis	-124.4	-163.1	-2.7	42.7	-27.5	0	0	0	112.6
407	E	33.1	Very low	34.4	Very low	150 Å²	150	134.6 Å²	134.6	70%	0.701	77%	0.771	S	S	*	*			trans	74.7	123.9	149.7	-78	179.3	-117.4	0	0	123.2
408	Q	33.2	Very low	34.2	Very low	151 Å²	151	133.2 Å²	133.2	71%	0.706	77%	0.767	S	S	*	*			trans	80.3	136.4	134.1	-66.8	-167.7	61.7	0	0	123.5
409	T	40.2	Very low	34.3	Very low	109 Å²	109	133.2 Å²	133.2	67%	0.669	76%	0.761	S	S	*	*			trans	64.1	111.3	146.3	51.6	0	0	0	0	122.6
410	E	36.4	Very low	34.3	Very low	165 Å²	165	135.4 Å²	135.4	77%	0.771	76%	0.757	S	S	*	*				73.9	131.8	121	-67.9	-158.9	138.2	0	0	124.5
411	L	31.6	Very low	34.2	Very low	142 Å²	142	136 Å²	136	74%	0.743	76%	0.755	S	S	*	*			trans	69.6	96.2	138.3	-64.7	169.9	0	0	0	122
412	Y	35.8	Very low	33.4	Very low	205 Å²	205	137.2 Å²	137.2	80%	0.804	75%	0.754	S	S	*	*				55.3	94.5	116.2	-165.5	-95.1	0	0	0	120
413	A	37.3	Very low	34.4	Very low	85 Å²	85	138.3 Å²	138.3	70%	0.702	75%	0.753	S	S	*	*			trans	-147.3	118.2	151.9	0	0	0	0	0	108.4
414	Q	35.1	Very low	34.2	Very low	157 Å²	157	136.5 Å²	136.5	73%	0.734	75%	0.748	S	S	*	*				59.6	139	89.2	-66.6	-173.9	6.8	0	0	115.2
415	L	32.5	Very low	34.1	Very low	144 Å²	144	129.6 Å²	129.6	75%	0.754	73%	0.73	S	S	*	*			cis	-174	139.1	-20.7	-121.3	173.4	0	0	0	108
416	S	28.3	Very low	34.3	Very low	91 Å²	91	133.7 Å²	133.7	64%	0.636	74%	0.735	S	S	*	*			trans	35	125.9	149.8	65	0	0	0	0	122.7
417	K	32.1	Very low	33.4	Very low	210 Å²	210	131.7 Å²	131.7	91%	0.913	73%	0.728	S	S	*	*			trans	-173.7	141.3	139.2	-93.6	136.1	-170.4	172	0	108.3
418	A	28.7	Very low	33.5	Very low	85 Å²	85	131.9 Å²	131.9	70%	0.702	73%	0.729	S	S	*	*			cis	-145.1	149	-8	0	0	0	0	0	108.5
419	S	32.7	Very low	33.3	Very low	103 Å²	103	134.8 Å²	134.8	72%	0.72	73%	0.734	S	S	*	*				45.6	131.4	99.4	-155.6	0	0	0	0	114.4
420	T	27.9	Very low	32.8	Very low	130 Å²	130	133.9 Å²	133.9	80%	0.798	74%	0.737	S	S	*	*			cis	-151	170.7	33	-30.6	0	0	0	0	107.5
421	A	25.6	Very low	32.5	Very low	90 Å²	90	134.4 Å²	134.4	74%	0.744	74%	0.744	S	S	*	*			cis	-156.8	-167	27	0	0	0	0	0	114.3
422	L	31.3	Very low	32.2	Very low	152 Å²	152	131.1 Å²	131.1	80%	0.796	75%	0.745	S	S	*	*			trans	-149.3	166.2	178.9	-121.1	173.3	0	0	0	107.1
423	P	49.1	Very low	31.8	Very low	113 Å²	113	125.4 Å²	125.4	73%	0.734	75%	0.748	S	S	*	*				-150	-176.3	77.2	47.4	-29.2	0	0	0	112.7
424	Y	29.5	Very low	31.2	Very low	199 Å²	199	124.8 Å²	124.8	78%	0.78	75%	0.75	S	S	*	*			cis	-157.1	145	3.5	-163.4	-135.1	0	0	0	111.1
425	A	34.3	Very low	30.8	Very low	66 Å²	66	124.4 Å²	124.4	55%	0.545	75%	0.752	S	S	.	*			trans	49.6	155.5	142.9	0	0	0	0	0	122.3
426	I	33.1	Very low	30.7	Very low	149 Å²	149	125.5 Å²	125.5	76%	0.764	75%	0.753	S	S	*	*			cis	-167.3	166.5	-9.9	-109.6	167.9	0	0	0	106.4
427	A	34.1	Very low	30.8	Very low	69 Å²	69	124 Å²	124	57%	0.57	75%	0.752	S	S	*	*			cis	175.6	169.6	-42.8	0	0	0	0	0	108.2
428	Q	34.7	Very low	30.9	Very low	155 Å²	155	122.1 Å²	122.1	72%	0.724	75%	0.746	S	S	*	*			trans	70.8	152	163.5	-74.2	-174.8	91.9	0	0	118.1
429	R	29.9	Very low	30.9	Very low	212 Å²	212	123.6 Å²	123.6	80%	0.8	75%	0.75	S	S	*	*			cis	-154.5	161.6	-15.2	-165.7	-173.5	-71.9	-158.3	0.8	108.2
430	A	28.3	Very low	31	Very low	90 Å²	90	121.7 Å²	121.7	74%	0.744	75%	0.747	S	S	*	*			trans	-72	160.6	173.5	0	0	0	0	0	114.3
431	L	30.5	Very low	31.2	Very low	176 Å²	176	122.6 Å²	122.6	92%	0.921	75%	0.752	S	S	*	*				168.3	126.7	127.4	-172.6	72.1	0	0	0	113.8
432	G	25.8	Very low	31.6	Very low	73 Å²	73	121 Å²	121	75%	0.753	74%	0.744	S	S	*	*			trans	75.4	156	143	0	0	0	0	0	121.7
433	G	26.7	Very low	31.8	Very low	84 Å²	84	120.4 Å²	120.4	87%	0.866	74%	0.742	S	S	*	*			trans	79.4	140.7	166.9	0	0	0	0	0	116.2
434	G	24.9	Very low	31.3	Very low	72 Å²	72	120.5 Å²	120.5	74%	0.742	74%	0.736	S	S	*	*			cis	109.2	127.4	-8.8	0	0	0	0	0	115.2
435	L	27.7	Very low	31.8	Very low	150 Å²	150	118.8 Å²	118.8	79%	0.785	73%	0.733	S	S	*	*			trans	66.5	121.5	173.9	-90.2	60.6	0	0	0	115.4
436	E	29.6	Very low	31.8	Very low	167 Å²	167	127.1 Å²	127.1	78%	0.78	75%	0.75	S	S	*	*				78.6	139.9	97	-74.8	-174.5	140.6	0	0	114.8
437	G	30.7	Very low	31.8	Very low	59 Å²	59	124.2 Å²	124.2	61%	0.608	75%	0.749	S	S	*	*			cis	165	-145.8	-0.4	0	0	0	0	0	112.8
438	H	34.3	Very low	31.7	Very low	171 Å²	171	126.2 Å²	126.2	79%	0.792	77%	0.765	S	S	*	*			trans	71.1	146	171.4	-60.7	-57.6	0	0	0	118.5
439	C	29.1	Very low	31.5	Very low	116 Å²	116	122 Å²	122	78%	0.784	76%	0.763	S	S	*	*			cis	-173.8	172.9	-29.1	-115.4	0	0	0	0	109.5
440	G	34	Very low	31.8	Very low	63 Å²	63	120.4 Å²	120.4	65%	0.649	77%	0.765	S	S	*	*			trans	87.7	92.1	160.2	0	0	0	0	0	114.2
441	T	32.9	Very low	31.9	Very low	148 Å²	148	122.6 Å²	122.6	91%	0.908	76%	0.764	S	S	*	*			cis	71.1	119.2	33.6	-38.3	0	0	0	0	113.9
442	G	33.9	Very low	31.8	Very low	56 Å²	56	117.3 Å²	117.3	58%	0.577	75%	0.752	S	S	*	*			trans	177.4	99.7	168.9	0	0	0	0	0	117.5
443	N	34.6	Very low	32.3	Very low	141 Å²	141	122.9 Å²	122.9	75%	0.754	76%	0.758	S	S	*	*			trans	71.3	154.9	152.2	-55.5	-49.4	0	0	0	118.3
444	N	38.5	Very low	32.4	Very low	114 Å²	114	124.3 Å²	124.3	61%	0.61	76%	0.755	S	S	*	*			cis	-172.4	161.8	-18.8	-93.3	-21	0	0	0	108.2
445	K	40.3	Very low	32.9	Very low	163 Å²	163	127.5 Å²	127.5	71%	0.709	76%	0.755	S	S	*	*			cis	-174.7	145.8	-27.6	-108.6	-179	-176.9	97.6	0	108.4
446	R	34.3	Very low	33.9	Very low	241 Å²	241	128.9 Å²	128.9	91%	0.909	76%	0.757	S	S	*	*			trans	72.6	151.8	163.9	-67.4	178.1	-177.4	175.6	0.9	118.7
447	A	32.8	Very low	34.3	Very low	89 Å²	89	128.1 Å²	128.1	74%	0.736	76%	0.758	S	S	*	*			cis	-166.5	161	-14.5	0	0	0	0	0	113.9
448	A	32.7	Very low	34.1	Very low	110 Å²	110	133.4 Å²	133.4	91%	0.909	76%	0.761	S	S	*	*			trans	63.8	142.7	161.6	0	0	0	0	0	120
449	G	29.4	Very low	34.1	Very low	67 Å²	67	130.9 Å²	130.9	69%	0.691	76%	0.761	S	S	*	*			cis	167.2	157.5	-10.6	0	0	0	0	0	114.4
450	Q	36.1	Very low	34.3	Very low	179 Å²	179	132.7 Å²	132.7	84%	0.836	76%	0.758	S	S	*	*			trans	65.1	145.5	166.8	-63.5	-174.2	-104.1	0	0	118.2
451	D	30.1	Very low	34	Very low	136 Å²	136	133.6 Å²	133.6	73%	0.727	76%	0.76	S	S	*	*			cis	-155.9	164.5	-13.4	-89.5	-27.6	0	0	0	107.8
452	G	30.1	Very low	33.9	Very low	65 Å²	65	134.6 Å²	134.6	67%	0.67	76%	0.759	S	S	*	*			cis	-168.4	-169	5.2	0	0	0	0	0	113.3
453	H	35.4	Very low	33.6	Very low	190 Å²	190	136.4 Å²	136.4	88%	0.88	77%	0.768	S	S	*	*			trans	-87.5	-176.9	-166.8	-65.4	-89.1	0	0	0	113.8
454	S	29.8	Very low	33.3	Very low	114 Å²	114	134 Å²	134	80%	0.797	77%	0.767	S	S	*	*			cis	-162.7	168.6	26.7	-167.5	0	0	0	0	114.4
455	D	34.6	Very low	32.8	Very low	138 Å²	138	133.6 Å²	133.6	74%	0.738	77%	0.774	S	S	*	*			trans	-81	169.2	177.2	-71.3	-66.8	0	0	0	115.8
456	H	48	Very low	32.5	Very low	180 Å²	180	132.6 Å²	132.6	83%	0.833	78%	0.775	S	S	*	*			trans	-6.5	139.3	161.2	-67.6	-91.9	0	0	0	120.5
457	D	38.2	Very low	32	Very low	150 Å²	150	129 Å²	129	80%	0.802	77%	0.769	S	S	*	*				-157.8	156.6	126.3	-137.6	-23.5	0	0	0	115.5
458	Y	27	Very low	31.7	Very low	170 Å²	170	132.7 Å²	132.7	67%	0.667	77%	0.773	S	S	*	*			trans	58.1	131.3	154	-119.9	-109.5	0	0	0	125.2	Q460	Y458-Q460 HydrophobicContact CD1-CB 4.27Å; Y458-Q460 HydrophobicContact CE1-CB 4.11Å; Y458-Q460 HydrophobicContact CE1-CG 4.39Å; Y458-Q460 PolarHBondContact OH-NE2 3.24Å
459	C	34.7	Very low	31.3	Very low	118 Å²	118	133.1 Å²	133.1	80%	0.797	76%	0.764	S	S	*	*			trans	-113.6	124.4	157.4	-66.1	0	0	0	0	110.8
460	Q	33	Very low	31.2	Very low	155 Å²	155	139.3 Å²	139.3	72%	0.724	77%	0.772	S	S	*	*			trans	178.6	162.5	158.2	-104.5	158.5	74.3	0	0	109.5	Y458	Y458-Q460 HydrophobicContact CD1-CB 4.27Å; Y458-Q460 HydrophobicContact CE1-CB 4.11Å; Y458-Q460 HydrophobicContact CE1-CG 4.39Å; Y458-Q460 PolarHBondContact OH-NE2 3.24Å
461	A	27.7	Very low	31	Very low	82 Å²	82	136.4 Å²	136.4	68%	0.678	77%	0.767	S	S	*	*			cis	179	119.9	-39.9	0	0	0	0	0	107.8
462	L	29.8	Very low	31.6	Very low	169 Å²	169	134.4 Å²	134.4	89%	0.885	76%	0.762	S	S	*	*			trans	-147.7	120.8	156.8	-73.3	-177.7	0	0	0	106
463	A	28.8	Very low	31.3	Very low	94 Å²	94	133.2 Å²	133.2	78%	0.777	75%	0.75	S	S	*	*				74.7	128.8	62.6	0	0	0	0	0	112
464	A	28.4	Very low	31.1	Very low	89 Å²	89	126.5 Å²	126.5	74%	0.736	73%	0.727	S	S	*	*			cis	-163.5	179.7	-4	0	0	0	0	0	110.8
465	S	28.4	Very low	31.3	Very low	107 Å²	107	121.4 Å²	121.4	75%	0.748	69%	0.691	S	S	*	*			trans	70.8	158.6	160.3	-62.1	0	0	0	0	117.6
466	L	32.3	Very low	31.1	Very low	142 Å²	142	116.7 Å²	116.7	74%	0.743	67%	0.668	S	S	*	*			cis	-165.4	162.2	-31.7	-110.2	165.7	0	0	0	106
467	E	25.1	Very low	30.3	Very low	164 Å²	164	112.5 Å²	112.5	77%	0.766	66%	0.656	S	S	*	*			trans	48.7	113.6	156.4	-75.9	177.5	135.6	0	0	119.8
468	M	26.8	Very low	29.8	Very low	167 Å²	167	108.8 Å²	108.8	82%	0.823	65%	0.653	S	S	*	*				82	136.1	76.6	-75.2	-75.1	-154.4	0	0	115.8
469	T	24	Very low	29.9	Very low	119 Å²	119	110.2 Å²	110.2	73%	0.73	66%	0.663	S	S	*	*			trans	84.7	96.9	149.3	-54.3	0	0	0	0	121.5
470	F	26.4	Very low	29.6	Very low	197 Å²	197	110.5 Å²	110.5	86%	0.864	66%	0.661	S	S	*	*			trans	67.7	154.7	131.3	-90.5	-99.7	0	0	0	125.6
471	T	31.5	Very low	29.3	Very low	118 Å²	118	110.5 Å²	110.5	72%	0.724	66%	0.661	S	S	*	*			trans	-80.1	-174.2	167.7	54	0	0	0	0	111.7
472	P	43.1	Very low	29.3	Very low	95 Å²	95	112 Å²	112	62%	0.617	66%	0.657	S	S	*	*			cis	-131.6	-176.8	0.6	43.8	-26.8	0	0	0	114.9	K144	K144-P472 PolarHBondContact NZ-O 3.2Å
473	G	25	Very low	29.3	Very low	40 Å²	40	113.6 Å²	113.6	41%	0.412	65%	0.652	S	S	.	*			cis	144.7	157.7	3.6	0	0	0	0	0	111.8	T475	G473-T475 PolarHBondContact O-OG1 3Å
474	A	31.4	Very low	29.1	Very low	48 Å²	48	115.6 Å²	115.6	40%	0.397	65%	0.645	S	S	.	*			trans	40.7	-146.5	171.6	0	0	0	0	0	118.4	L141 L145	L141-A474 HydrophobicContact CB-CB 4.4Å; L141-A474 HydrophobicContact CD2-CB 3.71Å; L145-A474 VanDerWaalsContact CB-O 3.26Å; L145-A474 WeakPolarHBondContact CB-O 3.29Å; L145-A474 HydrophobicContact CD1-CB 4.43Å; L145-A474 VanDerWaalsContact CG-C 3.43Å; L145-A474 VanDerWaalsContact CG-O 3.3Å; L145-A474 WeakPolarHBondContact CG-O 3.41Å; L145-A474 PolarHBondContact N-O 3.49Å
475	T	32.1	Very low	29	Very low	8 Å²	8	118.2 Å²	118.2	5%	0.049	65%	0.651	C	S	.	*			trans	105.4	115.2	147.9	-39.1	0	0	0	0	114	L141 K143 K144 L145 L146 G473	L141-T475 WeakPolarHBondContact CA-OG1 3.43Å; L141-T475 VanDerWaalsContact N-CG2 3.3Å; L141-T475 PolarHBondContact N-OG1 2.87Å; L141-T475 VanDerWaalsContact O-CA 3.29Å; L141-T475 WeakPolarHBondContact O-CA 3.14Å; L141-T475 PolarHBondContact O-N 2.85Å; K143-T475 CarbonylContact C-O 3.54Å; K143-T475 HydrophobicContact CB-CG2 3.8Å; K143-T475 VanDerWaalsContact N-CA 3.27Å; K143-T475 VanDerWaalsContact N-CB 3.3Å; K143-T475 CarbonylContact O-C 3.56Å; K143-T475 VanDerWaalsContact O-O 3.13Å; K144-T475 CarbonylContact C-O 3.47Å; K144-T475 VanDerWaalsContact C-O 3.26Å; K144-T475 HydrophobicContact CB-CG2 4.05Å; K144-T475 HydrophobicContact CD-CG2 4.06Å; K144-T475 HydrophobicContact CG-CG2 3.77Å; K144-T475 VanDerWaalsContact N-C 3.26Å; K144-T475 PolarHBondContact N-O 2.89Å; K144-T475 VanDerWaalsContact N-O 3.07Å; L145-T475 CarbonylContact C-O 3.5Å; L145-T475 WeakPolarHBondContact CA-O 3.24Å; L145-T475 WeakPolarHBondContact CB-O 3.44Å; L145-T475 PolarHBondContact N-O 3.32Å; L146-T475 PolarHBondContact N-O 2.94Å; G473-T475 PolarHBondContact O-OG1 3Å
476	S	32	Very low	29.1	Very low	38 Å²	38	117.4 Å²	117.4	27%	0.266	64%	0.642	S	S	.	*			trans	-104.8	176.2	-156.5	78.2	0	0	0	0	123	L142 K143	L142-S476 WeakPolarHBondContact CB-OG 3.36Å; L142-S476 PolarHBondContact O-OG 2.74Å; K143-S476 VanDerWaalsContact CA-O 3.26Å; K143-S476 WeakPolarHBondContact CA-O 3.26Å
477	T	30.9	Very low	28.8	Very low	92 Å²	92	117.8 Å²	117.8	56%	0.564	64%	0.64	S	S	*	*			trans	166.2	152.8	138.8	30.7	0	0	0	0	112	L146	L146-T477 VanDerWaalsContact CB-N 3.34Å; L146-T477 WeakPolarHBondContact CD1-O 3.41Å
478	G	28	Very low	29	Very low	73 Å²	73	115.3 Å²	115.3	75%	0.753	64%	0.639	S	S	*	*			cis	163.2	157.1	-11.8	0	0	0	0	0	114.4
479	K	28.6	Very low	29.1	Very low	199 Å²	199	114.8 Å²	114.8	87%	0.865	64%	0.637	S	S	*	*			trans	90.6	108.2	153.4	-155.9	171.1	-175.4	172.7	0	123.5
480	V	28.9	Very low	29.1	Very low	125 Å²	125	115.5 Å²	115.5	76%	0.758	64%	0.636	S	S	*	*			trans	72.3	141.8	140.8	173.1	0	0	0	0	117.9
481	E	25.3	Very low	29.1	Very low	154 Å²	154	110.9 Å²	110.9	72%	0.72	63%	0.628	S	S	*	*			cis	-145.9	153.8	29.1	-151.3	-172.1	155.2	0	0	114.7
482	N	27.5	Very low	28.8	Very low	113 Å²	113	112.4 Å²	112.4	60%	0.604	64%	0.637	S	S	*	*			trans	56.2	137.2	154.3	-75.7	-22.6	0	0	0	122.3
483	R	30.3	Very low	27.9	Very low	204 Å²	204	115.6 Å²	115.6	77%	0.77	65%	0.645	S	S	*	*			cis	-167.3	150.2	-14.6	-146.4	179.4	162.7	147.2	-3.7	113
484	Q	25.8	Very low	27.9	Very low	135 Å²	135	118 Å²	118	63%	0.631	66%	0.656	S	S	*	*			trans	58.9	94.2	154.5	-122.7	79.1	50.7	0	0	119.1	V486	Q484-V486 HydrophobicContact CG-CG2 4.3Å
485	V	25.8	Very low	27.6	Very low	144 Å²	144	121.6 Å²	121.6	87%	0.873	67%	0.673	S	S	*	*			trans	-107.6	158.8	139.8	173.3	0	0	0	0	106.4
486	V	29.8	Very low	27.1	Very low	91 Å²	91	125.6 Å²	125.6	55%	0.552	70%	0.702	S	S	*	*			trans	-134	136.3	-178.5	173.4	0	0	0	0	109.7	Q484	Q484-V486 HydrophobicContact CG-CG2 4.3Å
487	E	26.6	Very low	26.8	Very low	150 Å²	150	132.7 Å²	132.7	70%	0.701	73%	0.728	S	S	*	*			trans	9.5	140.4	173.7	-67.7	93.8	-109.9	0	0	121.6
488	C	29.3	Very low	26.5	Very low	111 Å²	111	135.6 Å²	135.6	75%	0.75	74%	0.739	S	S	*	*			cis	71.1	155.5	39.7	-49	0	0	0	0	112.8
489	M	28.7	Very low	26.3	Very low	156 Å²	156	137.1 Å²	137.1	77%	0.768	74%	0.738	S	S	*	*			cis	-154.2	179.6	26.1	-81.1	-63.7	-175.5	0	0	108.6
490	D	23.7	Very low	26.2	Very low	135 Å²	135	133.1 Å²	133.1	72%	0.722	74%	0.735	S	S	*	*			cis	-170	-171.2	-35.3	-166.1	1.8	0	0	0	108
491	S	27.7	Very low	26	Very low	99 Å²	99	132.2 Å²	132.2	69%	0.692	74%	0.735	S	S	*	*			trans	-88.1	152.9	-168.4	-45.9	0	0	0	0	114.2
492	V	25	Very low	25.9	Very low	150 Å²	150	130.1 Å²	130.1	91%	0.909	74%	0.736	S	S	*	*			trans	-136.4	155.6	157.8	-171.2	0	0	0	0	109.8
493	M	24.6	Very low	25.7	Very low	162 Å²	162	129.7 Å²	129.7	80%	0.798	74%	0.742	S	S	*	*			trans	-110.8	171.7	-160.5	-46.2	171.2	67.4	0	0	115.2
494	S	25.2	Very low	25.4	Very low	92 Å²	92	126 Å²	126	64%	0.643	74%	0.742	S	S	*	*			trans	87.2	155.5	132.5	-75.1	0	0	0	0	122.6
495	T	23.7	Very low	25.4	Very low	123 Å²	123	124.5 Å²	124.5	76%	0.755	75%	0.747	S	S	*	*			trans	69.2	91.8	160.5	43.6	0	0	0	0	119.9
496	S	22.8	Very low	25.5	Very low	92 Å²	92	122.7 Å²	122.7	64%	0.643	74%	0.74	S	S	*	*				40.8	135.6	104.6	-44.1	0	0	0	0	121.7
497	F	24.4	Very low	25.3	Very low	186 Å²	186	123.2 Å²	123.2	82%	0.816	75%	0.748	S	S	*	*			trans	117.4	131.9	137.7	-68.9	-60.6	0	0	0	120
498	L	25.1	Very low	25.2	Very low	153 Å²	153	121.3 Å²	121.3	80%	0.801	75%	0.751	S	S	*	*			trans	72.5	100.4	148.2	-67.4	164.3	0	0	0	120.6
499	S	24.2	Very low	25.1	Very low	105 Å²	105	123.1 Å²	123.1	73%	0.734	75%	0.753	S	S	*	*				10.9	134.5	122.8	-44.1	0	0	0	0	119.6
500	S	25.8	Very low	24.9	Very low	115 Å²	115	120.2 Å²	120.2	80%	0.804	75%	0.748	S	S	*	*				-171.4	126.2	111.2	-80.1	0	0	0	0	115
501	S	25.5	Very low	25	Very low	107 Å²	107	121.2 Å²	121.2	75%	0.748	75%	0.748	S	S	*	*			trans	28.4	135.2	134.3	-47.7	0	0	0	0	124.2
502	C	22.7	Very low	25	Very low	109 Å²	109	123.2 Å²	123.2	74%	0.736	75%	0.75	S	S	*	*			trans	69.9	109.6	131.6	73.8	0	0	0	0	123.8
503	S	23.5	Very low	25.1	Very low	104 Å²	104	121.4 Å²	121.4	73%	0.727	74%	0.739	S	S	*	*				80.5	113	115.7	-55.7	0	0	0	0	123.3
504	T	24.7	Very low	25.3	Very low	126 Å²	126	122.7 Å²	122.7	77%	0.773	74%	0.741	S	S	*	*			trans	51	119.9	131.7	63.1	0	0	0	0	119.7
505	S	25.9	Very low	25.5	Very low	105 Å²	105	125.4 Å²	125.4	73%	0.734	74%	0.743	S	S	*	*				176.9	152.3	76.7	-68.3	0	0	0	0	115.1
506	S	26.2	Very low	25.6	Very low	106 Å²	106	127.9 Å²	127.9	74%	0.741	75%	0.746	S	S	*	*			trans	56.1	116.1	142.8	64.7	0	0	0	0	124.6
507	S	26.1	Very low	25.6	Very low	101 Å²	101	131.3 Å²	131.3	71%	0.706	75%	0.749	S	S	*	*				76.6	110.6	124	67.1	0	0	0	0	124.9
508	S	25.6	Very low	25.6	Very low	110 Å²	110	131.6 Å²	131.6	77%	0.769	75%	0.751	S	S	*	*			trans	70.4	152.5	131.7	76.5	0	0	0	0	119.9
509	L	25.3	Very low	25.7	Very low	150 Å²	150	130.5 Å²	130.5	79%	0.785	75%	0.75	S	S	*	*			cis	-158.1	145.4	5.2	-161.7	84.3	0	0	0	112.5
510	S	26.5	Very low	26.7	Very low	95 Å²	95	130.6 Å²	130.6	66%	0.664	75%	0.748	S	S	*	*			trans	67.8	170.5	155	73.6	0	0	0	0	118.5
511	H	25.4	Very low	26.7	Very low	156 Å²	156	130.8 Å²	130.8	72%	0.722	74%	0.744	S	S	*	*			cis	-165.3	168.9	20.7	-152.9	-73.5	0	0	0	114.2
512	L	26.3	Very low	26.8	Very low	140 Å²	140	133 Å²	133	73%	0.733	75%	0.747	S	S	*	*			trans	72.5	147.8	167.3	-76.4	109.3	0	0	0	119.3
513	T	28.8	Very low	27.1	Very low	112 Å²	112	131.5 Å²	131.5	69%	0.687	75%	0.751	S	S	*	*			cis	-169.7	155.8	-21.1	21.5	0	0	0	0	112.3
514	K	27.8	Very low	27.3	Very low	190 Å²	190	134.3 Å²	134.3	83%	0.826	76%	0.758	S	S	*	*				155.7	149.8	124.5	-89.7	-159.5	172.1	176.7	0	111.8
515	E	29	Very low	27.5	Very low	149 Å²	149	131.8 Å²	131.8	70%	0.696	75%	0.75	S	S	*	*			cis	-161.8	179.3	-11.3	-127.6	-78.9	145.9	0	0	110.3
516	Q	27.1	Very low	27.5	Very low	174 Å²	174	132.6 Å²	132.6	81%	0.813	75%	0.754	S	S	*	*			trans	74.6	145.2	170.1	-50.4	-170.5	30.1	0	0	120.4
517	K	22.6	Very low	27.6	Very low	165 Å²	165	138.8 Å²	138.8	72%	0.717	76%	0.761	S	S	*	*			cis	-178.9	129.3	-35.2	167.7	170.4	177.6	177.6	0	109.1
518	F	23.8	Very low	27.6	Very low	192 Å²	192	140.1 Å²	140.1	84%	0.842	77%	0.765	S	S	*	*			trans	175.1	150.2	139.2	-96.9	-64.2	0	0	0	112.1
519	V	26.6	Very low	27.7	Very low	129 Å²	129	146.1 Å²	146.1	78%	0.782	77%	0.77	S	S	*	*			trans	-165.4	161.4	-160.1	165.3	0	0	0	0	107.1
520	P	44.8	Very low	27.8	Very low	107 Å²	107	142.1 Å²	142.1	70%	0.695	77%	0.765	S	S	*	*			cis	-128	-173.9	-2.7	25.9	-1.5	0	0	0	115.4
521	V	26.5	Very low	27.9	Very low	120 Å²	120	146.3 Å²	146.3	73%	0.727	78%	0.779	S	S	*	*				167.2	121.2	110.5	162.7	0	0	0	0	113.7
522	D	27.1	Very low	28	Very low	152 Å²	152	142.7 Å²	142.7	81%	0.813	78%	0.784	S	S	*	*			trans	38.1	121.7	151	-54.3	-18.4	0	0	0	126.4
523	G	29	Very low	28.2	Very low	79 Å²	79	143.6 Å²	143.6	81%	0.814	79%	0.785	S	S	*	*				86.4	154.1	112.3	0	0	0	0	0	121
524	D	27.7	Very low	28.2	Very low	163 Å²	163	148.2 Å²	148.2	87%	0.872	79%	0.79	S	S	*	*			cis	-163.4	171	-19.8	-171.1	23.3	0	0	0	110.4
525	A	29.2	Very low	28.1	Very low	73 Å²	73	145.7 Å²	145.7	60%	0.603	79%	0.79	S	S	*	*			trans	64.7	91.1	151.5	0	0	0	0	0	122.6
526	C	26.8	Very low	28	Very low	122 Å²	122	145.8 Å²	145.8	82%	0.824	80%	0.795	S	S	*	*				54.1	112.2	112.1	-73.4	0	0	0	0	124.7
527	R	27.7	Very low	28.6	Very low	236 Å²	236	142.6 Å²	142.6	89%	0.891	79%	0.789	S	S	*	*				87.1	160.7	111	-151.5	-178.4	-159	-135.2	7.2	120.2
528	V	26.8	Very low	28.7	Very low	129 Å²	129	142.9 Å²	142.9	78%	0.782	79%	0.793	S	S	*	*			trans	82.6	141.9	165.8	-177.4	0	0	0	0	115.9
529	R	27.2	Very low	28.8	Very low	236 Å²	236	139.6 Å²	139.6	89%	0.891	79%	0.789	S	S	*	*			cis	-178.8	143.7	-26.2	-179.2	-171.6	-161.1	-160.8	7.6	109
530	G	26.6	Very low	28.9	Very low	65 Å²	65	138.6 Å²	138.6	67%	0.67	78%	0.783	S	S	*	*			trans	128.3	121.3	143.5	0	0	0	0	0	120.5
531	L	28.9	Very low	28.1	Very low	183 Å²	183	142.1 Å²	142.1	96%	0.958	79%	0.79	S	S	*	*			trans	13.1	143.5	145.3	-72.1	72.5	0	0	0	122.2
532	G	28.7	Very low	28.1	Very low	81 Å²	81	144 Å²	144	84%	0.835	79%	0.794	S	S	*	*			trans	173.3	119.8	152.6	0	0	0	0	0	112.8
533	E	30.7	Very low	28.8	Very low	159 Å²	159	141.9 Å²	141.9	74%	0.743	79%	0.789	S	S	*	*			trans	-97.1	152.2	-178.1	-95.8	-161	101.4	0	0	114.2
534	R	27.7	Very low	28.6	Very low	209 Å²	209	143.5 Å²	143.5	79%	0.789	78%	0.784	S	S	*	*			trans	43	129.2	147	-61.5	174.8	-178.2	-131.1	-6.2	120
535	T	26.5	Very low	28.6	Very low	137 Å²	137	144.7 Å²	144.7	84%	0.84	78%	0.784	S	S	*	*				175.9	138.7	102.9	-74.2	0	0	0	0	111.5
536	L	26.2	Very low	28.4	Very low	151 Å²	151	145.3 Å²	145.3	79%	0.791	80%	0.797	S	S	*	*			trans	-88.2	154.2	168.7	-123.5	85.8	0	0	0	109.4
537	P	39.3	Very low	28.4	Very low	107 Å²	107	143.3 Å²	143.3	70%	0.695	80%	0.797	S	S	*	*				-150.2	171.6	62.2	40.2	-20.3	0	0	0	117.8
538	Q	25.8	Very low	28.4	Very low	171 Å²	171	139.1 Å²	139.1	80%	0.799	80%	0.798	S	S	*	*			trans	32.6	126.4	146.2	-63.8	173.7	1.3	0	0	120.5
539	T	25.3	Very low	28.5	Very low	123 Å²	123	137.9 Å²	137.9	76%	0.755	80%	0.801	S	S	*	*				168.3	111.3	115.7	-75	0	0	0	0	112.8
540	T	27.9	Very low	28.7	Very low	108 Å²	108	133.2 Å²	133.2	66%	0.663	80%	0.799	S	S	*	*			trans	61.5	131.3	138.9	-55.9	0	0	0	0	122.8
541	Q	28.4	Very low	28.8	Very low	180 Å²	180	141.3 Å²	141.3	84%	0.841	81%	0.809	S	S	*	*			trans	71	108.4	157.4	-78.6	169.3	69.1	0	0	120.8
542	I	27	Very low	29.2	Very low	159 Å²	159	139.7 Å²	139.7	82%	0.815	80%	0.801	S	S	*	*			trans	-58.5	158.9	139.9	15.5	174.4	0	0	0	109.8
543	P	41.5	Very low	29	Very low	108 Å²	108	144.9 Å²	144.9	70%	0.701	80%	0.804	S	S	*	*			cis	-147.8	-179.1	37.2	34.6	-10.4	0	0	0	119.3
544	T	25.1	Very low	29	Very low	114 Å²	114	144.6 Å²	144.6	70%	0.699	81%	0.807	S	S	*	*			trans	93.1	130.3	140.9	12.5	0	0	0	0	123.1
545	Q	27.5	Very low	29	Very low	188 Å²	188	142.8 Å²	142.8	88%	0.879	81%	0.807	S	S	*	*			trans	74.7	130.4	151.2	-56.6	-156	38.5	0	0	122
546	G	25.5	Very low	29.5	Very low	85 Å²	85	144.9 Å²	144.9	88%	0.876	81%	0.812	S	S	*	*			trans	86.1	82.2	130.3	0	0	0	0	0	117.8
547	G	26.4	Very low	29.6	Very low	80 Å²	80	140.8 Å²	140.8	83%	0.825	80%	0.797	S	S	*	*			trans	-150.2	104	172.7	0	0	0	0	0	113.6
548	T	27.7	Very low	29.8	Very low	148 Å²	148	141.1 Å²	141.1	91%	0.908	81%	0.808	S	S	*	*			trans	-78.8	125.7	168.8	47.9	0	0	0	0	111.2
549	A	28.7	Very low	30	Very low	103 Å²	103	138.2 Å²	138.2	85%	0.851	80%	0.802	S	S	*	*			trans	-163.7	136.2	150.2	0	0	0	0	0	111.7
550	V	32.3	Very low	30.5	Very low	139 Å²	139	136.4 Å²	136.4	84%	0.842	80%	0.795	S	S	*	*			trans	-93.7	122.4	162.1	169.8	0	0	0	0	108.1
551	R	28.4	Very low	31.6	Very low	234 Å²	234	143.4 Å²	143.4	88%	0.883	81%	0.809	S	S	*	*				-165.8	151.2	128.9	-127.7	174.7	176.2	142.7	-0	113.3
552	D	35.8	Very low	33	Very low	149 Å²	149	142.6 Å²	142.6	80%	0.797	80%	0.802	S	S	*	*			trans	-69.1	143	-177.9	-43.2	-94.3	0	0	0	112.5
553	Q	26.1	Very low	34.3	Very low	190 Å²	190	141 Å²	141	89%	0.888	80%	0.802	S	S	*	*			trans	-137.2	114.1	152.7	-172.2	165.9	106.9	0	0	110.7
554	L	30.1	Very low	35.2	Very low	154 Å²	154	141 Å²	141	81%	0.806	80%	0.796	S	S	*	*			trans	0.4	114.7	156.5	-68.3	159.8	0	0	0	117.2
555	Q	26.9	Very low	37.4	Very low	170 Å²	170	138.9 Å²	138.9	79%	0.794	79%	0.785	S	S	*	*				-142.8	112.2	127.7	-118.6	178.6	14.9	0	0	111.3	S557	Q555-S557 VanDerWaalsContact C-N 3.27Å; Q555-S557 PolarHBondContact O-N 3.33Å
556	L	37.8	Very low	39.9	Very low	181 Å²	181	134.4 Å²	134.4	95%	0.948	77%	0.767	S	S	*	*			trans	-68.1	91.7	159.5	-84.4	167.4	0	0	0	107.7
557	S	28.6	Very low	42.5	Very low	66 Å²	66	137 Å²	137	46%	0.462	76%	0.757	S	S	.	*			trans	-124.2	86.3	175.5	51.4	0	0	0	0	108.7	Q555 T559	Q555-S557 VanDerWaalsContact C-N 3.27Å; Q555-S557 PolarHBondContact O-N 3.33Å; S557-T559 PolarHBondContact O-N 2.91Å
558	A	42.8	Very low	45.3	Very low	113 Å²	113	138.2 Å²	138.2	93%	0.934	74%	0.741	S	S	*	*			trans	-70	83.3	169.9	0	0	0	0	0	108.9
559	T	30.2	Very low	48.1	Very low	111 Å²	111	134.6 Å²	134.6	68%	0.681	72%	0.715	S	S	*	*			trans	-115.2	117.6	-175.6	54.4	0	0	0	0	111.7	S557	S557-T559 PolarHBondContact O-N 2.91Å
560	S	36.9	Very low	50.8	Low	85 Å²	85	135.7 Å²	135.7	59%	0.594	70%	0.697	S	S	*	*			trans	45.6	108.9	151	-166.5	0	0	0	0	117.4	K562	S560-K562 PolarHBondContact O-N 3.47Å; S560-K562 WeakPolarHBondContact OG-CG 3.24Å; S560-K562 PolarHBondContact OG-N 3.33Å
561	R	49.8	Very low	53	Low	254 Å²	254	131.9 Å²	131.9	96%	0.958	68%	0.68	S	S	*	*			trans	-64.4	79.3	148.9	-76.7	-177.7	173.4	173.3	-2.4	108.6
562	K	58	Low	55.7	Low	163 Å²	163	125.3 Å²	125.3	71%	0.709	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-60.9	135.9	165.5	-63	-176.8	-179.3	-180	0	107.3	S560 L564	S560-K562 PolarHBondContact O-N 3.47Å; S560-K562 WeakPolarHBondContact OG-CG 3.24Å; S560-K562 PolarHBondContact OG-N 3.33Å; K562-L564 PolarHBondContact O-N 2.83Å; K562-L564 VanDerWaalsContact O-N 3.12Å
563	P	54.5	Low	58	Low	125 Å²	125	122.5 Å²	122.5	81%	0.812	64%	0.644	S	S	*	*	P	Polyproline II helix	trans	-59.6	120.3	165.7	26.5	-31.8	0	0	0	107	C565	P563-C565 PolarHBondContact O-N 3.06Å
564	L	60.6	Low	60.7	Low	109 Å²	109	116.6 Å²	116.6	57%	0.571	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-56.3	136.7	176.5	-73.5	172.1	0	0	0	108.5	K562 D566 I569	K562-L564 PolarHBondContact O-N 2.83Å; K562-L564 VanDerWaalsContact O-N 3.12Å; L564-D566 PolarHBondContact O-N 3.42Å; L564-I569 HydrophobicContact CB-CD1 4.08Å; L564-I569 HydrophobicContact CB-CG1 3.74Å; L564-I569 HydrophobicContact CD1-CG1 4.39Å
565	C	70.3	Confident	63.4	Low	70 Å²	70	116.1 Å²	116.1	47%	0.473	61%	0.61	S	S	.	*	P	Polyproline II helix	trans	-63	142.4	176.4	-171.9	0	0	0	0	108.8	P563 Q567 E568 I569	P563-C565 PolarHBondContact O-N 3.06Å; C565-Q567 HydrophobicContact CB-CB 4.46Å; C565-Q567 PolarHBondContact O-N 3.45Å; C565-E568 HydrophobicContact CB-CG 4.15Å; C565-E568 WeakPolarHBondContact CB-OE2 3.13Å; C565-E568 PolarHBondContact N-OE2 3.19Å; C565-E568 WeakPolarHBondContact O-CA 3.13Å; C565-E568 WeakPolarHBondContact O-CB 3.28Å; C565-E568 PolarHBondContact O-N 2.87Å; C565-I569 PolarHBondContact O-N 3.3Å
566	D	81.6	Confident	65.9	Low	94 Å²	94	114 Å²	114	50%	0.503	60%	0.6	S	S	.	*	H	α-helix	trans	-48.3	-29.7	172.9	-136.6	32.5	0	0	0	112.1	L564 R570	L564-D566 PolarHBondContact O-N 3.42Å; D566-R570 VanDerWaalsContact CG-NH1 3.29Å; D566-R570 WeakPolarHBondContact O-CB 3.5Å; D566-R570 WeakPolarHBondContact O-CD 3.47Å; D566-R570 WeakPolarHBondContact O-CG 3.43Å; D566-R570 PolarHBondContact O-N 2.76Å; D566-R570 VanDerWaalsContact O-N 3.14Å; D566-R570 IonicContact OD1-NH2 3.86Å; D566-R570 IonicContact OD2-CZ 3.09Å; D566-R570 IonicContact OD2-NH1 2.78Å; D566-R570 PolarHBondContact OD2-NH1 3.24Å; D566-R570 IonicContact OD2-NH2 2.66Å; D566-R570 PolarHBondContact OD2-NH2 3.48Å
567	Q	80.1	Confident	68.1	Low	139 Å²	139	113.6 Å²	113.6	65%	0.65	59%	0.591	S	S	*	*	H	α-helix	trans	-69.9	-40.5	174	-159.9	72.4	-4.2	0	0	113.8	C565 A571	C565-Q567 HydrophobicContact CB-CB 4.46Å; C565-Q567 PolarHBondContact O-N 3.45Å; Q567-A571 WeakPolarHBondContact O-CB 3.24Å; Q567-A571 PolarHBondContact O-N 3.07Å
568	E	85	Confident	70.5	Confident	106 Å²	106	112 Å²	112	50%	0.495	58%	0.584	S	S	.	*	H	α-helix	trans	-73.3	-41.9	178.8	-64.4	171.7	127.4	0	0	110.6	C565 R570 A571 E572	C565-E568 HydrophobicContact CB-CG 4.15Å; C565-E568 WeakPolarHBondContact CB-OE2 3.13Å; C565-E568 PolarHBondContact N-OE2 3.19Å; C565-E568 WeakPolarHBondContact O-CA 3.13Å; C565-E568 WeakPolarHBondContact O-CB 3.28Å; C565-E568 PolarHBondContact O-N 2.87Å; E568-R570 VanDerWaalsContact C-N 3.33Å; E568-R570 PolarHBondContact O-N 3.18Å; E568-A571 PolarHBondContact O-N 2.94Å; E568-A571 VanDerWaalsContact O-N 3.1Å; E568-E572 WeakPolarHBondContact O-CB 3.38Å; E568-E572 PolarHBondContact O-N 3.11Å
569	I	85.6	Confident	71.8	Confident	71 Å²	71	111.4 Å²	111.4	36%	0.364	57%	0.571	S	S	.	*	H	α-helix	trans	-59.1	-45.9	173.7	-59.1	173.7	0	0	0	109.8	L564 C565 A571 E572 L573	L564-I569 HydrophobicContact CB-CD1 4.08Å; L564-I569 HydrophobicContact CB-CG1 3.74Å; L564-I569 HydrophobicContact CD1-CG1 4.39Å; C565-I569 PolarHBondContact O-N 3.3Å; I569-A571 PolarHBondContact O-N 3.05Å; I569-E572 PolarHBondContact O-N 2.8Å; I569-L573 HydrophobicContact CG2-CD1 3.92Å; I569-L573 HydrophobicContact CG2-CG 4.45Å; I569-L573 WeakPolarHBondContact O-CB 3.12Å; I569-L573 VanDerWaalsContact O-CG 3.25Å; I569-L573 WeakPolarHBondContact O-CG 3.21Å; I569-L573 PolarHBondContact O-N 3.36Å
570	R	85.8	Confident	73.6	Confident	126 Å²	126	111.2 Å²	111.2	48%	0.475	57%	0.572	S	S	.	*	H	α-helix	trans	-62.1	-38.8	173.4	-75.2	171.6	-173.4	115.1	15.4	112.7	D566 E568 N574	D566-R570 VanDerWaalsContact CG-NH1 3.29Å; D566-R570 WeakPolarHBondContact O-CB 3.5Å; D566-R570 WeakPolarHBondContact O-CD 3.47Å; D566-R570 WeakPolarHBondContact O-CG 3.43Å; D566-R570 PolarHBondContact O-N 2.76Å; D566-R570 VanDerWaalsContact O-N 3.14Å; D566-R570 IonicContact OD1-NH2 3.86Å; D566-R570 IonicContact OD2-CZ 3.09Å; D566-R570 IonicContact OD2-NH1 2.78Å; D566-R570 PolarHBondContact OD2-NH1 3.24Å; D566-R570 IonicContact OD2-NH2 2.66Å; D566-R570 PolarHBondContact OD2-NH2 3.48Å; E568-R570 VanDerWaalsContact C-N 3.33Å; E568-R570 PolarHBondContact O-N 3.18Å; R570-N574 WeakPolarHBondContact O-CB 3.41Å; R570-N574 PolarHBondContact O-N 2.97Å; R570-N574 PolarHBondContact O-ND2 2.95Å; R570-N574 VanDerWaalsContact O-ND2 3.17Å
571	A	79.1	Confident	74.3	Confident	59 Å²	59	115.3 Å²	115.3	49%	0.488	59%	0.586	S	S	.	*	H	α-helix	trans	-67.5	-44.2	178.4	0	0	0	0	0	112.4	Q567 E568 I569 N574 K575	Q567-A571 WeakPolarHBondContact O-CB 3.24Å; Q567-A571 PolarHBondContact O-N 3.07Å; E568-A571 PolarHBondContact O-N 2.94Å; E568-A571 VanDerWaalsContact O-N 3.1Å; I569-A571 PolarHBondContact O-N 3.05Å; A571-N574 PolarHBondContact O-N 2.89Å; A571-K575 VanDerWaalsContact O-CB 3.25Å; A571-K575 WeakPolarHBondContact O-CB 3.44Å; A571-K575 PolarHBondContact O-N 3.11Å
572	E	84.8	Confident	74.1	Confident	96 Å²	96	111.9 Å²	111.9	45%	0.449	58%	0.581	S	S	.	*	H	α-helix	trans	-65.4	-42.8	176.9	-166.3	94.8	-96.6	0	0	111.3	E568 I569 K575 H576	E568-E572 WeakPolarHBondContact O-CB 3.38Å; E568-E572 PolarHBondContact O-N 3.11Å; I569-E572 PolarHBondContact O-N 2.8Å; E572-K575 WeakPolarHBondContact O-CB 3.37Å; E572-K575 PolarHBondContact O-N 2.79Å; E572-K575 IonicContact OE1-NZ 2.63Å; E572-K575 PolarHBondContact OE1-NZ 3.02Å; E572-H576 PolarHBondContact O-CD2 2.92Å; E572-H576 VanDerWaalsContact O-CD2 3.27Å; E572-H576 PolarHBondContact O-N 3.29Å
573	L	83.1	Confident	73.2	Confident	90 Å²	90	108.7 Å²	108.7	47%	0.471	59%	0.585	S	S	.	*	H	α-helix	trans	-64.8	-45.7	173.8	-70.6	173.5	0	0	0	111.8	I569 K575 H576 F577	I569-L573 HydrophobicContact CG2-CD1 3.92Å; I569-L573 HydrophobicContact CG2-CG 4.45Å; I569-L573 WeakPolarHBondContact O-CB 3.12Å; I569-L573 VanDerWaalsContact O-CG 3.25Å; I569-L573 WeakPolarHBondContact O-CG 3.21Å; I569-L573 PolarHBondContact O-N 3.36Å; L573-K575 PolarHBondContact O-N 2.83Å; L573-H576 PolarHBondContact O-N 3.26Å; L573-H576 VanDerWaalsContact O-N 3.08Å; L573-F577 HydrophobicContact CD2-CD2 4.09Å; L573-F577 HydrophobicContact CD2-CE2 3.95Å; L573-F577 WeakPolarHBondContact O-CD2 3.32Å; L573-F577 PolarHBondContact O-N 2.83Å
574	N	83.5	Confident	72.1	Confident	67 Å²	67	110.7 Å²	110.7	36%	0.358	59%	0.588	S	S	.	*	H	α-helix	trans	-64.2	-28.7	176.5	-71.6	-20.5	0	0	0	112.5	R570 A571 G578 P580	R570-N574 WeakPolarHBondContact O-CB 3.41Å; R570-N574 PolarHBondContact O-N 2.97Å; R570-N574 PolarHBondContact O-ND2 2.95Å; R570-N574 VanDerWaalsContact O-ND2 3.17Å; A571-N574 PolarHBondContact O-N 2.89Å; N574-G578 CarbonylContact O-C 3.46Å; N574-G578 WeakPolarHBondContact O-CA 3.43Å; N574-G578 PolarHBondContact O-N 2.96Å; N574-G578 PolarHBondContact OD1-O 3.4Å; N574-P580 WeakPolarHBondContact OD1-CD 3.26Å
575	K	87	Confident	70.7	Confident	144 Å²	144	115 Å²	115	63%	0.626	60%	0.598	S	S	*	*	H	α-helix	trans	-68.9	-31.4	172.7	160.8	-171.1	161.5	-160.7	0	112.6	A571 E572 L573	A571-K575 VanDerWaalsContact O-CB 3.25Å; A571-K575 WeakPolarHBondContact O-CB 3.44Å; A571-K575 PolarHBondContact O-N 3.11Å; E572-K575 WeakPolarHBondContact O-CB 3.37Å; E572-K575 PolarHBondContact O-N 2.79Å; E572-K575 IonicContact OE1-NZ 2.63Å; E572-K575 PolarHBondContact OE1-NZ 3.02Å; L573-K575 PolarHBondContact O-N 2.83Å
576	H	78.9	Confident	68.8	Low	125 Å²	125	118.2 Å²	118.2	58%	0.579	62%	0.616	S	S	*	*	H	α-helix	trans	-97.5	-28.1	-179.1	-76.3	-63.3	0	0	0	114.9	E572 L573	E572-H576 PolarHBondContact O-CD2 2.92Å; E572-H576 VanDerWaalsContact O-CD2 3.27Å; E572-H576 PolarHBondContact O-N 3.29Å; L573-H576 PolarHBondContact O-N 3.26Å; L573-H576 VanDerWaalsContact O-N 3.08Å
577	F	84.1	Confident	66.5	Low	173 Å²	173	121.6 Å²	121.6	76%	0.759	63%	0.629	S	S	*	*	H	α-helix	trans	-121.1	-6.8	-175	-59.6	-75.1	0	0	0	114.2	L573	L573-F577 HydrophobicContact CD2-CD2 4.09Å; L573-F577 HydrophobicContact CD2-CE2 3.95Å; L573-F577 WeakPolarHBondContact O-CD2 3.32Å; L573-F577 PolarHBondContact O-N 2.83Å
578	G	79.6	Confident	64.1	Low	31 Å²	31	118.2 Å²	118.2	32%	0.32	63%	0.631	S	S	.	*			trans	79.4	164.9	-170.9	0	0	0	0	0	112.8	N574	N574-G578 CarbonylContact O-C 3.46Å; N574-G578 WeakPolarHBondContact O-CA 3.43Å; N574-G578 PolarHBondContact O-N 2.96Å; N574-G578 PolarHBondContact OD1-O 3.4Å
579	P	69.7	Low	61.4	Low	102 Å²	102	121.8 Å²	121.8	66%	0.662	65%	0.647	S	S	*	*	S	Bend	trans	-61.4	137.4	171.9	-20	32.6	0	0	0	110.9	L581	P579-L581 PolarHBondContact O-N 3.18Å
580	P	66.9	Low	58.8	Low	106 Å²	106	126 Å²	126	69%	0.688	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-62.5	131.2	177.7	25.3	-33.8	0	0	0	110.7	N574 Q582	N574-P580 WeakPolarHBondContact OD1-CD 3.26Å; P580-Q582 PolarHBondContact O-N 2.78Å
581	L	52.5	Low	56.1	Low	171 Å²	171	126.3 Å²	126.3	90%	0.895	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-64	125.6	177.3	-66.6	175.5	0	0	0	110	P579 A583	P579-L581 PolarHBondContact O-N 3.18Å; L581-A583 PolarHBondContact O-N 2.88Å
582	Q	44.7	Very low	53.6	Low	182 Å²	182	133.5 Å²	133.5	85%	0.85	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-59.2	131	177.8	-69	176.6	-17.1	0	0	110.5	P580 L584	P580-Q582 PolarHBondContact O-N 2.78Å; Q582-L584 PolarHBondContact O-N 2.86Å
583	A	39.3	Very low	50.9	Low	97 Å²	97	134.3 Å²	134.3	80%	0.802	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-63	128.7	173.8	0	0	0	0	0	109.9	L581 Y585	L581-A583 PolarHBondContact O-N 2.88Å; A583-Y585 PolarHBondContact O-N 3.48Å
584	L	32.2	Very low	48.1	Very low	167 Å²	167	137.1 Å²	137.1	87%	0.874	71%	0.71	S	S	*	*			trans	-72.6	87.4	-174.4	-69.4	172.8	0	0	0	111.8	Q582 T586	Q582-L584 PolarHBondContact O-N 2.86Å; L584-T586 PolarHBondContact O-N 2.96Å
585	Y	30.7	Very low	45.3	Very low	200 Å²	200	138.6 Å²	138.6	78%	0.784	73%	0.725	S	S	*	*			trans	-74	111.1	164.7	-169.1	-95.4	0	0	0	109.5	A583 Q587	A583-Y585 PolarHBondContact O-N 3.48Å; Y585-Q587 HydrophobicContact CD1-CB 4.23Å; Y585-Q587 HydrophobicContact CE1-CB 4.14Å; Y585-Q587 PolarHBondContact O-N 3.4Å
586	T	31	Very low	42.4	Very low	136 Å²	136	136.7 Å²	136.7	83%	0.834	73%	0.73	S	S	*	*			trans	-87.3	100.1	180	52.5	0	0	0	0	111.1	L584	L584-T586 PolarHBondContact O-N 2.96Å
587	Q	33.7	Very low	40.2	Very low	166 Å²	166	140.4 Å²	140.4	78%	0.776	75%	0.745	S	S	*	*			trans	-104.5	132.3	168.6	-170.9	167.4	-6.5	0	0	109.8	Y585	Y585-Q587 HydrophobicContact CD1-CB 4.23Å; Y585-Q587 HydrophobicContact CE1-CB 4.14Å; Y585-Q587 PolarHBondContact O-N 3.4Å
588	G	28.4	Very low	38.5	Very low	67 Å²	67	137.2 Å²	137.2	69%	0.691	74%	0.741	S	S	*	*			trans	-95.6	125.5	-175.3	0	0	0	0	0	113.7
589	E	29.1	Very low	36	Very low	182 Å²	182	143.3 Å²	143.3	85%	0.85	77%	0.766	S	S	*	*			trans	52.1	116.5	150.8	-54.3	-177	147.2	0	0	118
590	Q	30.4	Very low	34.1	Very low	158 Å²	158	147.9 Å²	147.9	74%	0.738	78%	0.776	S	S	*	*				58.7	136.3	74.3	-84.4	-166.5	-59.2	0	0	114.3
591	E	28.4	Very low	33.2	Very low	134 Å²	134	148.3 Å²	148.3	63%	0.626	78%	0.779	S	S	*	*			cis	-170.9	149.7	-2.5	-178.4	170.5	-100.8	0	0	110.2
592	R	28.3	Very low	31.9	Very low	210 Å²	210	146.3 Å²	146.3	79%	0.792	77%	0.774	S	S	*	*				158.1	125.8	129	-87.7	-174.5	177.5	-179.8	-0.7	116.8
593	D	26.5	Very low	31	Very low	112 Å²	112	143.6 Å²	143.6	60%	0.599	77%	0.77	S	S	*	*				33.1	106.7	122.4	-39.8	-25	0	0	0	119.9
594	N	25.8	Very low	30.9	Very low	149 Å²	149	143.9 Å²	143.9	80%	0.797	76%	0.763	S	S	*	*				171.9	148.3	86.4	-95	-54.4	0	0	0	116.1
595	S	23.9	Very low	30.5	Very low	98 Å²	98	144.3 Å²	144.3	69%	0.685	76%	0.761	S	S	*	*			trans	48	118.4	146.1	66.6	0	0	0	0	123.3
596	S	27.2	Very low	30.3	Very low	104 Å²	104	139.9 Å²	139.9	73%	0.727	76%	0.759	S	S	*	*				78.8	109.7	126.2	67.8	0	0	0	0	123.5
597	K	32.2	Very low	30.9	Very low	204 Å²	204	137.9 Å²	137.9	89%	0.887	75%	0.749	S	S	*	*			trans	79.3	151.3	132.3	-72.9	-173.9	176.4	-177.2	0	119.8
598	P	47.7	Very low	30.6	Very low	105 Å²	105	139.1 Å²	139.1	68%	0.682	75%	0.754	S	S	*	*			trans	-95.3	169.1	-171.7	39.4	-37.4	0	0	0	113.3
599	N	27.7	Very low	30.5	Very low	159 Å²	159	139.6 Å²	139.6	85%	0.85	76%	0.76	S	S	*	*				-176.2	147.3	128.9	-92.1	-18.8	0	0	0	112.9
600	K	29.4	Very low	30.5	Very low	198 Å²	198	134.7 Å²	134.7	86%	0.861	76%	0.757	S	S	*	*			trans	-95.4	170.5	149.7	-83.6	-176.1	177.1	178.4	0	107.7
601	P	48.9	Very low	30.5	Very low	116 Å²	116	135.3 Å²	135.3	75%	0.753	76%	0.76	S	S	*	*			cis	-127.2	-151.4	-2	35.9	-15	0	0	0	112
602	T	25.4	Very low	30.8	Very low	128 Å²	128	135.5 Å²	135.5	79%	0.785	76%	0.764	S	S	*	*			trans	120.5	102.5	144.9	-55.4	0	0	0	0	116.8
603	T	25	Very low	31	Very low	126 Å²	126	131.6 Å²	131.6	77%	0.773	76%	0.759	S	S	*	*			trans	-73.3	175.3	155.5	14.2	0	0	0	0	111.7
604	P	36.7	Very low	31.4	Very low	102 Å²	102	134.6 Å²	134.6	66%	0.662	77%	0.767	S	S	*	*			cis	-136.2	-173.7	-15.6	38.5	-19.1	0	0	0	114.1
605	Q	23.4	Very low	31.6	Very low	177 Å²	177	138.1 Å²	138.1	83%	0.827	77%	0.771	S	S	*	*			trans	41.8	125.4	136.9	-80.4	-178.2	-4.9	0	0	123.8
606	S	27.2	Very low	31.8	Very low	106 Å²	106	138.5 Å²	138.5	74%	0.741	77%	0.773	S	S	*	*				75.8	179.9	124	-132.2	0	0	0	0	118
607	P	44.4	Very low	32	Very low	95 Å²	95	140.3 Å²	140.3	62%	0.617	77%	0.771	S	S	*	*				-131.2	-175.3	-70.5	37.1	-20.9	0	0	0	115.1
608	E	26.2	Very low	31.9	Very low	191 Å²	191	140.5 Å²	140.5	89%	0.893	77%	0.766	S	S	*	*			trans	56.6	140.2	146.3	-77.9	171.7	139.1	0	0	122.2
609	G	27.6	Very low	31.4	Very low	78 Å²	78	142.6 Å²	142.6	80%	0.804	77%	0.77	S	S	*	*			trans	149.5	80.9	152.4	0	0	0	0	0	118.7
610	G	29.2	Very low	31.6	Very low	78 Å²	78	140.3 Å²	140.3	80%	0.804	77%	0.767	S	S	*	*			trans	71.3	170.2	160.7	0	0	0	0	0	117.7
611	E	29.3	Very low	31.7	Very low	171 Å²	171	133.7 Å²	133.7	80%	0.799	76%	0.755	S	S	*	*			cis	-162.4	150.8	-14.6	-149.7	-175.2	-163.7	0	0	110
612	I	34.7	Very low	30.9	Very low	139 Å²	139	133.7 Å²	133.7	71%	0.713	76%	0.758	S	S	*	*			trans	55.7	155.9	168.5	29.3	179.5	0	0	0	118
613	D	33.6	Very low	31.2	Very low	128 Å²	128	132.3 Å²	132.3	68%	0.684	75%	0.753	S	S	*	*			cis	-156.2	-179.5	17.2	-144	-29.2	0	0	0	113.7
614	F	34.2	Very low	31.7	Very low	175 Å²	175	136 Å²	136	77%	0.768	75%	0.754	S	S	*	*			trans	74.1	86	163	-86.6	-79.9	0	0	0	123
615	Y	30.2	Very low	31.5	Very low	223 Å²	223	137.4 Å²	137.4	88%	0.875	76%	0.755	S	S	*	*			trans	63.3	161.3	132.7	-96.6	-99.5	0	0	0	123.1
616	S	28.3	Very low	31.5	Very low	105 Å²	105	137.2 Å²	137.2	73%	0.734	75%	0.754	S	S	*	*			trans	-131	156.4	-149.7	-41.9	0	0	0	0	116.2
617	Q	30.1	Very low	32.6	Very low	143 Å²	143	137.7 Å²	137.7	67%	0.668	76%	0.755	S	S	*	*				145.1	130.6	108.6	-173.8	166.9	113.1	0	0	117.3
618	R	30.4	Very low	31.7	Very low	208 Å²	208	136.3 Å²	136.3	79%	0.785	76%	0.758	S	S	*	*			trans	67.1	142.8	169.9	-69.7	171.6	-126.8	-144	3.7	116.1
619	L	37.6	Very low	31.7	Very low	149 Å²	149	137 Å²	137	78%	0.78	76%	0.758	S	S	*	*			cis	-168.3	163.9	-4.2	-103.5	163.6	0	0	0	106.1
620	S	31	Very low	31.8	Very low	111 Å²	111	140.3 Å²	140.3	78%	0.776	76%	0.757	S	S	*	*			cis	-165.5	170.2	-6.9	-149.1	0	0	0	0	106.8
621	G	32	Very low	31.7	Very low	59 Å²	59	141.7 Å²	141.7	61%	0.608	75%	0.754	S	S	*	*			cis	150.2	141.6	-7.5	0	0	0	0	0	112.8
622	S	32.2	Very low	31.6	Very low	116 Å²	116	142 Å²	142	81%	0.811	75%	0.753	S	S	*	*			trans	70.7	141.8	171	-65.3	0	0	0	0	119.6
623	S	31.9	Very low	31.1	Very low	99 Å²	99	142.2 Å²	142.2	69%	0.692	75%	0.751	S	S	*	*			cis	-179.5	159.5	-7.1	49.4	0	0	0	0	110
624	Y	36.4	Very low	30.8	Very low	204 Å²	204	141.6 Å²	141.6	80%	0.8	75%	0.748	S	S	*	*			cis	-167	154	-8.1	-115.4	-162.2	0	0	0	112.6
625	L	32.8	Very low	30.6	Very low	130 Å²	130	139.9 Å²	139.9	68%	0.681	74%	0.742	S	S	*	*			trans	39.6	117.7	142.7	-53.9	-178.6	0	0	0	125.1
626	H	21.4	Very low	30.6	Very low	174 Å²	174	135 Å²	135	81%	0.806	73%	0.731	S	S	*	*				44.9	167.7	103.1	-96	-12.4	0	0	0	123
627	P	51.1	Low	30.6	Very low	116 Å²	116	137.4 Å²	137.4	75%	0.753	73%	0.73	S	S	*	*			cis	-141.1	179.5	-47.2	38.6	-19.8	0	0	0	115.3
628	G	26.3	Very low	30.8	Very low	66 Å²	66	137.2 Å²	137.2	68%	0.68	73%	0.733	S	S	*	*			trans	131.7	130.4	140.6	0	0	0	0	0	121.4
629	F	25	Very low	30.5	Very low	204 Å²	204	134.6 Å²	134.6	90%	0.895	74%	0.735	S	S	*	*			trans	32.7	124.7	152.8	-62.6	-87	0	0	0	122.9
630	L	29.5	Very low	30.1	Very low	149 Å²	149	133.1 Å²	133.1	78%	0.78	73%	0.727	S	S	*	*				-176.4	164.3	104.2	-102.2	173	0	0	0	113.2	F632	L630-F632 HydrophobicContact CD2-CD2 4.18Å; L630-F632 HydrophobicContact CD2-CE2 3.97Å
631	S	27	Very low	29.9	Very low	107 Å²	107	130.3 Å²	130.3	75%	0.748	72%	0.716	S	S	*	*			trans	-105.8	-157	164.5	-59.9	0	0	0	0	109.7
632	F	28.2	Very low	29.9	Very low	178 Å²	178	136.3 Å²	136.3	78%	0.781	72%	0.72	S	S	*	*			trans	95.6	114.7	-179.1	-54.4	-69.5	0	0	0	113.9	L630	L630-F632 HydrophobicContact CD2-CD2 4.18Å; L630-F632 HydrophobicContact CD2-CE2 3.97Å
633	Q	24.5	Very low	29.6	Very low	143 Å²	143	137.5 Å²	137.5	67%	0.668	71%	0.713	S	S	*	*			cis	81.7	127.5	25.5	-164	65.2	28.2	0	0	112.7
634	D	26.8	Very low	29.4	Very low	114 Å²	114	136.8 Å²	136.8	61%	0.61	71%	0.708	S	S	*	*			trans	68.8	150.4	154.5	-70.5	-6.3	0	0	0	118.5
635	E	29.7	Very low	29	Very low	140 Å²	140	137.6 Å²	137.6	65%	0.654	71%	0.71	S	S	*	*			cis	-168.4	178.3	1.7	-129.6	-179.6	147.7	0	0	114
636	L	31.4	Very low	28.7	Very low	121 Å²	121	139.5 Å²	139.5	63%	0.634	71%	0.713	S	S	*	*			trans	62.1	148.5	142.9	-68.6	165.6	0	0	0	120.2
637	E	28.1	Very low	29	Very low	154 Å²	154	139 Å²	139	72%	0.72	71%	0.714	S	S	*	*			cis	-168.2	-174.6	-21.4	-148.6	-178.6	-164.2	0	0	109.2
638	L	32.6	Very low	27.8	Very low	139 Å²	139	142.3 Å²	142.3	73%	0.728	72%	0.717	S	S	*	*			trans	66.7	116.5	171.1	-87.6	60	0	0	0	115.7
639	D	25.3	Very low	28.3	Very low	154 Å²	154	143.9 Å²	143.9	82%	0.824	72%	0.715	S	S	*	*			cis	94.9	155.3	32.4	-166.6	44	0	0	0	114.4
640	D	28.5	Very low	28.3	Very low	117 Å²	117	145.2 Å²	145.2	63%	0.626	72%	0.715	S	S	*	*			trans	69.5	123.8	-175.9	-160.7	20.5	0	0	0	115.7	R642	D640-R642 IonicContact OD1-NH1 3.8Å; D640-R642 PolarHBondContact OD1-NH1 2.88Å; D640-R642 IonicContact OD2-CZ 3.34Å; D640-R642 IonicContact OD2-NH1 2.73Å; D640-R642 PolarHBondContact OD2-NH1 3.38Å; D640-R642 IonicContact OD2-NH2 3.34Å
641	G	27.8	Very low	28.3	Very low	52 Å²	52	147.7 Å²	147.7	54%	0.536	72%	0.722	S	S	.	*			trans	-104	-164.5	176.9	0	0	0	0	0	111.3
642	R	30.7	Very low	28.3	Very low	185 Å²	185	145.6 Å²	145.6	70%	0.698	72%	0.717	S	S	*	*			trans	159.8	165.5	130.6	66.2	-164.1	154.1	-89.7	16.8	114.6	D640	D640-R642 IonicContact OD1-NH1 3.8Å; D640-R642 PolarHBondContact OD1-NH1 2.88Å; D640-R642 IonicContact OD2-CZ 3.34Å; D640-R642 IonicContact OD2-NH1 2.73Å; D640-R642 PolarHBondContact OD2-NH1 3.38Å; D640-R642 IonicContact OD2-NH2 3.34Å
643	E	27.5	Very low	28.4	Very low	141 Å²	141	143.6 Å²	143.6	66%	0.659	72%	0.72	S	S	*	*			trans	50.4	100.3	167.7	-81.9	65	-84.8	0	0	120.8
644	S	27.6	Very low	29.4	Very low	84 Å²	84	142.1 Å²	142.1	59%	0.587	72%	0.722	S	S	*	*			trans	-35	142.8	142.1	175.4	0	0	0	0	116
645	R	27	Very low	29.6	Very low	221 Å²	221	144.3 Å²	144.3	83%	0.834	73%	0.733	S	S	*	*				-164.5	158.6	116.8	-106.1	160.7	-66.1	-158.2	4.8	114.7
646	F	27.7	Very low	29.7	Very low	170 Å²	170	144 Å²	144	75%	0.746	74%	0.736	S	S	*	*			trans	-84.9	168.2	-177	-63	-108.3	0	0	0	112.6
647	I	25.9	Very low	29.8	Very low	163 Å²	163	146.1 Å²	146.1	84%	0.836	75%	0.747	S	S	*	*				177.4	148.4	105.9	-92.6	174.8	0	0	0	112.4
648	F	26.6	Very low	30.1	Very low	187 Å²	187	144.4 Å²	144.4	82%	0.82	74%	0.743	S	S	*	*			trans	-90.7	164.2	172.1	-73.8	-104.1	0	0	0	112
649	P	36.4	Very low	29.9	Very low	98 Å²	98	146.3 Å²	146.3	64%	0.636	75%	0.745	S	S	*	*			trans	-122.4	144.6	146.3	38.9	-29.5	0	0	0	110.6
650	W	26.1	Very low	30	Very low	233 Å²	233	146 Å²	146	88%	0.883	74%	0.743	S	S	*	*			cis	-128.6	165.3	14.6	-68.3	87.1	0	0	0	109.4
651	E	29	Very low	29.8	Very low	201 Å²	201	145.6 Å²	145.6	94%	0.939	75%	0.749	S	S	*	*				-161.1	144	61.5	-177.5	166.1	-135.9	0	0	111.7
652	G	26.3	Very low	29.8	Very low	62 Å²	62	148.6 Å²	148.6	64%	0.639	76%	0.761	S	S	*	*			trans	148.7	137.3	176.1	0	0	0	0	0	115.9
653	T	31.9	Very low	30.3	Very low	136 Å²	136	145 Å²	145	83%	0.834	76%	0.762	S	S	*	*			trans	-137.7	169	170.2	55.7	0	0	0	0	107.9
654	P	44.9	Very low	30.3	Very low	112 Å²	112	150 Å²	150	73%	0.727	78%	0.775	S	S	*	*			cis	-135.7	-155.8	6.8	34.4	-10.4	0	0	0	113.5
655	L	31.7	Very low	30.2	Very low	161 Å²	161	151.4 Å²	151.4	84%	0.843	78%	0.784	S	S	*	*			trans	110.7	148.8	157.5	-66.5	169.1	0	0	0	119
656	D	29.9	Very low	31.2	Very low	134 Å²	134	146.5 Å²	146.5	72%	0.717	78%	0.781	S	S	*	*			trans	-75.8	151.8	-170.4	-64.4	-78.1	0	0	0	114.5
657	L	34.2	Very low	31.1	Very low	164 Å²	164	143.6 Å²	143.6	86%	0.859	78%	0.782	S	S	*	*				-166.5	133	109.6	-102	167.7	0	0	0	112.2
658	L	33.6	Very low	31	Very low	119 Å²	119	142 Å²	142	62%	0.623	78%	0.784	S	S	*	*			trans	-67	158.1	155.3	-75.4	59.1	0	0	0	107.6
659	F	29.8	Very low	31	Very low	178 Å²	178	138.7 Å²	138.7	78%	0.781	78%	0.784	S	S	*	*			cis	-140.1	-178	29.3	-68.5	-97.9	0	0	0	108.8
660	D	26.9	Very low	32	Very low	147 Å²	147	139.3 Å²	139.3	79%	0.786	79%	0.788	S	S	*	*			cis	-152.2	177.2	17.6	-154.2	-7.6	0	0	0	112.3
661	C	24.4	Very low	32.8	Very low	109 Å²	109	133.5 Å²	133.5	74%	0.736	78%	0.781	S	S	*	*			trans	-113.4	149	-160.9	-80.3	0	0	0	0	116.2
662	S	26.9	Very low	32.7	Very low	115 Å²	115	128.7 Å²	128.7	80%	0.804	77%	0.769	S	S	*	*			trans	69.1	177.5	142.8	-85.3	0	0	0	0	118.4
663	P	42.8	Very low	32.6	Very low	109 Å²	109	131.4 Å²	131.4	71%	0.708	77%	0.773	S	S	*	*			cis	-127.6	160.1	-13.7	24.4	-4.6	0	0	0	114.9
664	R	26.8	Very low	32.3	Very low	247 Å²	247	130.8 Å²	130.8	93%	0.932	77%	0.773	S	S	*	*				-173.9	98.6	125.4	-104	170.3	-170.3	-157.8	2.7	114
665	S	25.4	Very low	31.5	Very low	113 Å²	113	130.9 Å²	130.9	79%	0.79	78%	0.776	S	S	*	*			trans	-88.2	-172	155.6	-38.1	0	0	0	0	109.1
666	P	47.3	Very low	31.9	Very low	118 Å²	118	128.6 Å²	128.6	77%	0.766	77%	0.771	S	S	*	*			cis	-135.6	179.4	-9.2	41.7	-25.8	0	0	0	114.8
667	S	25.5	Very low	31.7	Very low	109 Å²	109	126.9 Å²	126.9	76%	0.762	77%	0.77	S	S	*	*				-169.7	135.2	122.8	42.5	0	0	0	0	114.6
668	C	24.5	Very low	31.5	Very low	129 Å²	129	131 Å²	131	87%	0.872	77%	0.774	S	S	*	*			trans	54.3	142.3	149.1	-61.8	0	0	0	0	123.4
669	S	26.3	Very low	31.1	Very low	119 Å²	119	128.4 Å²	128.4	83%	0.832	78%	0.776	S	S	*	*			trans	-124.4	-155	-179.7	-46.9	0	0	0	0	111.1
670	P	57.3	Low	31	Very low	111 Å²	111	124.2 Å²	124.2	72%	0.721	77%	0.768	S	S	*	*				-122.9	-171	-125.4	39.2	-18.2	0	0	0	115.4
671	P	42.6	Very low	31.1	Very low	111 Å²	111	121.1 Å²	121.1	72%	0.721	76%	0.755	S	S	*	*				-128	148.5	115.3	6.5	15.6	0	0	0	111.6
672	S	26.7	Very low	31.3	Very low	100 Å²	100	120 Å²	120	70%	0.699	75%	0.748	S	S	*	*				64.8	138.6	65.6	102.1	0	0	0	0	113.6
673	T	25.8	Very low	32.6	Very low	118 Å²	118	119.3 Å²	119.3	72%	0.724	74%	0.741	S	S	*	*			cis	-161.7	163.5	16.6	-19	0	0	0	0	113
674	C	24.9	Very low	32.2	Very low	123 Å²	123	117.7 Å²	117.7	83%	0.831	73%	0.73	S	S	*	*			trans	68.7	120.8	153.4	-69.6	0	0	0	0	123.2
675	S	27.9	Very low	32.3	Very low	114 Å²	114	110.6 Å²	110.6	80%	0.797	72%	0.719	S	S	*	*			trans	-73.7	174	154.9	-28.4	0	0	0	0	111.7
676	P	40.5	Very low	32.4	Very low	114 Å²	114	110.3 Å²	110.3	74%	0.74	72%	0.717	S	S	*	*				-159.2	161.2	71.3	42.5	-20.9	0	0	0	120.8
677	S	26	Very low	31.6	Very low	98 Å²	98	111.7 Å²	111.7	69%	0.685	72%	0.717	S	S	*	*			trans	82.4	127.3	133.6	68.8	0	0	0	0	125.5
678	R	28.6	Very low	31.9	Very low	251 Å²	251	113.7 Å²	113.7	95%	0.947	72%	0.718	S	S	*	*			trans	85.2	128.6	132.3	-77.9	167.6	172.8	-93.5	-1.5	122.7
679	G	26.3	Very low	32.1	Very low	64 Å²	64	116 Å²	116	66%	0.66	72%	0.721	S	S	*	*			trans	121.5	105.1	157.7	0	0	0	0	0	113.5
680	S	27.7	Very low	32.2	Very low	89 Å²	89	115.3 Å²	115.3	62%	0.622	72%	0.716	S	S	*	*				45.5	124.3	83.8	72.1	0	0	0	0	113.1
681	V	28.6	Very low	31.3	Very low	82 Å²	82	115.7 Å²	115.7	50%	0.497	72%	0.719	S	S	.	*				-159	157.1	55.9	171.7	0	0	0	0	111.4	T224 A226	T224-V681 WeakPolarHBondContact O-CG1 3.49Å; T224-V681 WeakPolarHBondContact O-CG2 3.46Å; A226-V681 HydrophobicContact CB-CG1 4.05Å; A226-V681 VanDerWaalsContact N-CG1 3.34Å
682	S	29.4	Very low	30.7	Very low	86 Å²	86	116.6 Å²	116.6	60%	0.601	73%	0.728	S	S	*	*			trans	-108.5	163.2	175	-39.9	0	0	0	0	112.6
683	P	54.7	Low	31	Very low	101 Å²	101	122.6 Å²	122.6	66%	0.656	74%	0.735	S	S	*	*			trans	-101.8	-178.3	-130.3	41.8	-43	0	0	0	116.4
684	P	32.5	Very low	31.8	Very low	74 Å²	74	122.5 Å²	122.5	48%	0.481	74%	0.736	S	S	.	*			trans	-93.7	169.7	152.3	36.2	-30.8	0	0	0	113	D228	D228-P684 VanDerWaalsContact OD1-CB 3.25Å; D228-P684 WeakPolarHBondContact OD1-CB 3.4Å
685	S	29	Very low	31.8	Very low	99 Å²	99	125.3 Å²	125.3	69%	0.692	74%	0.735	S	S	*	*			trans	-135.1	159.6	-157	-58	0	0	0	0	115.5
686	S	28.7	Very low	31.7	Very low	107 Å²	107	126.2 Å²	126.2	75%	0.748	74%	0.739	S	S	*	*			trans	71.8	151.8	166.3	80.1	0	0	0	0	115.5
687	L	30.2	Very low	31	Very low	147 Å²	147	132.1 Å²	132.1	77%	0.77	75%	0.747	S	S	*	*				-144.7	136	52.3	-74.2	164.3	0	0	0	115.2
688	L	32	Very low	31	Very low	151 Å²	151	134.4 Å²	134.4	79%	0.791	76%	0.757	S	S	*	*			trans	24.8	117.7	141	-51.6	175.7	0	0	0	120.2
689	L	29.1	Very low	30.9	Very low	177 Å²	177	128.4 Å²	128.4	93%	0.927	75%	0.753	S	S	*	*				-178	159.3	110.6	-93.2	157.2	0	0	0	111.9
690	S	27.7	Very low	31	Very low	105 Å²	105	131.3 Å²	131.3	73%	0.734	76%	0.764	S	S	*	*			trans	-93.7	-170.5	-169.8	-29.9	0	0	0	0	112.9
691	P	39.1	Very low	31	Very low	119 Å²	119	130.2 Å²	130.2	77%	0.773	77%	0.767	S	S	*	*			cis	-141.8	138.8	-10.4	34.4	-13.3	0	0	0	117.1
692	S	30.2	Very low	31	Very low	129 Å²	129	132.2 Å²	132.2	90%	0.902	78%	0.784	S	S	*	*			trans	-161.2	164	156.9	49.5	0	0	0	0	114
693	R	32.3	Very low	31	Very low	227 Å²	227	139.3 Å²	139.3	86%	0.857	80%	0.798	S	S	*	*			trans	-109.3	160.3	-177.5	-84.7	179.6	-178	-97.1	2.7	109.2
694	P	41.5	Very low	29.8	Very low	116 Å²	116	140.4 Å²	140.4	75%	0.753	81%	0.808	S	S	*	*			cis	-146.1	177.9	48.6	38	-15.3	0	0	0	119.6
695	F	26.4	Very low	29.7	Very low	182 Å²	182	148 Å²	148	80%	0.798	83%	0.827	S	S	*	*			trans	0.2	133	164	-74.5	-96.3	0	0	0	122.2
696	C	25.4	Very low	29.6	Very low	132 Å²	132	149 Å²	149	89%	0.892	83%	0.833	S	S	*	*				-158.2	173.3	111.9	-121	0	0	0	0	111.5
697	W	25.6	Very low	29.6	Very low	239 Å²	239	155 Å²	155	91%	0.905	84%	0.84	S	S	*	*			trans	-78.4	157	-171.8	-72.4	-23.4	0	0	0	115.7
698	T	27	Very low	29.5	Very low	146 Å²	146	153.1 Å²	153.1	90%	0.896	84%	0.839	S	S	*	*				-165.2	147.3	127.1	8.9	0	0	0	0	111.5
699	S	25.5	Very low	29.3	Very low	124 Å²	124	155.1 Å²	155.1	87%	0.867	84%	0.844	S	S	*	*			trans	-87	133.3	176.3	-68.3	0	0	0	0	112.1
700	S	28.1	Very low	29.3	Very low	125 Å²	125	152.3 Å²	152.3	87%	0.874	84%	0.839	S	S	*	*			trans	173	134.8	130.6	-172.7	0	0	0	0	110
701	G	28.2	Very low	29.4	Very low	67 Å²	67	150.4 Å²	150.4	69%	0.691	84%	0.836	S	S	*	*			trans	-174.4	33.4	-168.2	0	0	0	0	0	117.9	R703	G701-R703 PolarHBondContact O-N 3.17Å
702	S	28.6	Very low	28.8	Very low	123 Å²	123	150.1 Å²	150.1	86%	0.86	84%	0.837	S	S	*	*			trans	-53.7	108	-177	-52.6	0	0	0	0	113.6
703	R	29.6	Very low	28.8	Very low	235 Å²	235	155.5 Å²	155.5	89%	0.887	84%	0.838	S	S	*	*			trans	-141.5	100.4	170.4	-74.2	-162.6	173.1	-151.8	-3.2	113.1	G701 R705	G701-R703 PolarHBondContact O-N 3.17Å; R703-R705 PolarHBondContact O-N 3.45Å
704	S	28.4	Very low	28.6	Very low	124 Å²	124	150.1 Å²	150.1	87%	0.867	84%	0.835	S	S	*	*			trans	-57.3	128.5	173.2	-35.5	0	0	0	0	112
705	R	30.4	Very low	28	Very low	235 Å²	235	149.9 Å²	149.9	89%	0.887	84%	0.836	S	S	*	*			trans	-141	95.7	165.9	-84.5	-167.9	163.1	175	-4.3	111.5	R703	R703-R705 PolarHBondContact O-N 3.45Å
706	S	27	Very low	28.2	Very low	118 Å²	118	146.6 Å²	146.6	83%	0.825	84%	0.835	S	S	*	*			trans	-56.6	134.3	170.9	-37.8	0	0	0	0	111.2
707	R	29	Very low	28.3	Very low	233 Å²	233	145.9 Å²	145.9	88%	0.879	83%	0.832	S	S	*	*			trans	-134.3	106.3	164	-78.1	-166.9	167.7	-162.6	-3.2	109.9
708	S	27.9	Very low	28.6	Very low	109 Å²	109	145.3 Å²	145.3	76%	0.762	83%	0.83	S	S	*	*			trans	-61.7	131.7	-176.4	-39.2	0	0	0	0	112
709	H	28.5	Very low	28.7	Very low	193 Å²	193	148.6 Å²	148.6	89%	0.894	83%	0.827	S	S	*	*			trans	-92.8	104.2	160.4	-97.7	55.2	0	0	0	109.3
710	S	29.5	Very low	28.8	Very low	117 Å²	117	153.3 Å²	153.3	82%	0.818	83%	0.826	S	S	*	*			trans	-105.8	84.7	173.3	-61.2	0	0	0	0	109.1
711	G	28.4	Very low	28.9	Very low	65 Å²	65	158 Å²	158	67%	0.67	82%	0.824	S	S	*	*			trans	-122.8	39.1	-170.8	0	0	0	0	0	114.4	R713	G711-R713 PolarHBondContact O-N 2.68Å
712	S	27.8	Very low	29.1	Very low	114 Å²	114	166.1 Å²	166.1	80%	0.797	83%	0.834	S	S	*	*			trans	-58.4	108.5	-174.8	-53.3	0	0	0	0	113
713	R	29.1	Very low	29.2	Very low	241 Å²	241	165.2 Å²	165.2	91%	0.909	83%	0.828	S	S	*	*			trans	-109.8	78.4	168.8	-72.9	-170.4	173.7	-164.9	-0	110.6	G711	G711-R713 PolarHBondContact O-N 2.68Å
714	S	28.7	Very low	29.3	Very low	114 Å²	114	162.3 Å²	162.3	80%	0.797	83%	0.829	S	S	*	*			trans	-85.2	110.5	174.9	-56.5	0	0	0	0	111.1
715	S	29.1	Very low	29.3	Very low	111 Å²	111	161.6 Å²	161.6	78%	0.776	83%	0.825	S	S	*	*			trans	-119.3	90.3	166.5	-66.8	0	0	0	0	108.1
716	S	29.3	Very low	29.2	Very low	113 Å²	113	155.3 Å²	155.3	79%	0.79	82%	0.817	S	S	*	*				85.9	90.1	73.1	70.2	0	0	0	0	113.5
717	S	27.5	Very low	29.5	Very low	118 Å²	118	154.8 Å²	154.8	83%	0.825	81%	0.813	S	S	*	*			trans	-120	139.2	154.8	63.2	0	0	0	0	109.4
718	R	32.9	Very low	30.1	Very low	227 Å²	227	148.8 Å²	148.8	86%	0.857	80%	0.804	S	S	*	*			trans	-165.3	162.3	171.1	-120.1	-161.8	-79.8	-123.5	6.6	110.3
719	Y	28.1	Very low	30.2	Very low	214 Å²	214	149.4 Å²	149.4	84%	0.839	80%	0.799	S	S	*	*			trans	78.6	133.1	-177	-55.6	-74.7	0	0	0	113.7
720	R	29.4	Very low	30.4	Very low	223 Å²	223	150 Å²	150	84%	0.842	79%	0.793	S	S	*	*			cis	-139.2	157	10.7	-66.8	-176.7	176.4	-164.4	1.6	114.2
721	R	28.8	Very low	30.7	Very low	223 Å²	223	153.2 Å²	153.2	84%	0.842	79%	0.787	S	S	*	*			trans	24.3	126	141.2	-60.3	177.9	-174.1	-112.9	2.3	119.2
722	R	32.4	Very low	31.4	Very low	238 Å²	238	155.2 Å²	155.2	90%	0.898	79%	0.789	S	S	*	*				61.8	122.6	71.7	-84.2	-168.1	174.1	-160.4	-1.6	115.5
723	S	30.8	Very low	31.6	Very low	104 Å²	104	155.2 Å²	155.2	73%	0.727	79%	0.788	S	S	*	*				174.5	130.6	104	-90.9	0	0	0	0	116.1
724	L	32	Very low	31.7	Very low	174 Å²	174	148.9 Å²	148.9	91%	0.911	78%	0.781	S	S	*	*			trans	65.8	153.4	152.1	-55.3	172.2	0	0	0	118.2
725	S	29.5	Very low	31.7	Very low	110 Å²	110	155.1 Å²	155.1	77%	0.769	79%	0.787	S	S	*	*			cis	-120.1	-156.8	2.5	57.3	0	0	0	0	110.4
726	S	28.4	Very low	31.8	Very low	103 Å²	103	154.6 Å²	154.6	72%	0.72	78%	0.784	S	S	*	*			cis	-152.8	-172.4	-5	-153.6	0	0	0	0	110.9
727	S	31.4	Very low	31.9	Very low	106 Å²	106	156.8 Å²	156.8	74%	0.741	78%	0.781	S	S	*	*			trans	-158.7	164.5	169.2	-59.6	0	0	0	0	110.3
728	P	41.7	Very low	32.2	Very low	108 Å²	108	159.9 Å²	159.9	70%	0.701	78%	0.782	S	S	*	*				-153.4	153	90.6	38.6	-19.9	0	0	0	118.3
729	D	31.9	Very low	32.1	Very low	122 Å²	122	152.1 Å²	152.1	65%	0.652	77%	0.773	S	S	*	*			trans	48.7	169.1	148.1	-45.2	-30.1	0	0	0	121.6
730	R	31.3	Very low	32.4	Very low	205 Å²	205	147.3 Å²	147.3	77%	0.774	77%	0.771	S	S	*	*			cis	-137.7	180	7.4	-69.1	178.3	179.2	-120.1	-8.8	112
731	R	36.4	Very low	32.6	Very low	185 Å²	185	143.8 Å²	143.8	70%	0.698	77%	0.768	S	S	*	*			trans	-117	-168.9	162.8	-72.3	-176.7	158.5	-138.3	-0.8	108.5	S171	S171-R731 PolarHBondContact O-NE 3.37Å; S171-R731 PolarHBondContact O-NH2 2.96Å
732	P	43.8	Very low	32.9	Very low	107 Å²	107	141.1 Å²	141.1	70%	0.695	77%	0.77	S	S	*	*			cis	-148.5	172.4	3.6	44.9	-24.1	0	0	0	120.6
733	S	30.3	Very low	33.2	Very low	113 Å²	113	137.3 Å²	137.3	79%	0.79	77%	0.767	S	S	*	*			trans	56.4	131.9	134.9	66.6	0	0	0	0	126.6
734	S	32.1	Very low	33.4	Very low	108 Å²	108	137.3 Å²	137.3	76%	0.755	77%	0.774	S	S	*	*			trans	-149.8	169.9	137.7	76.3	0	0	0	0	108.1
735	W	28.1	Very low	33.6	Very low	245 Å²	245	135.1 Å²	135.1	93%	0.928	77%	0.767	S	S	*	*			cis	79	133.7	5.6	-68	10.1	0	0	0	116.7
736	S	32.3	Very low	33.9	Very low	101 Å²	101	141.2 Å²	141.2	71%	0.706	77%	0.773	S	S	*	*			cis	-156.1	-171	-7.2	57.7	0	0	0	0	108.3
737	H	30.1	Very low	34.3	Very low	159 Å²	159	141.7 Å²	141.7	74%	0.736	78%	0.777	S	S	*	*			cis	-161.2	-153.3	9.2	-142.9	-32.5	0	0	0	111
738	H	34.8	Very low	34.7	Very low	182 Å²	182	147.5 Å²	147.5	84%	0.843	78%	0.782	S	S	*	*			trans	70.7	142.7	168.3	-45.5	-73.9	0	0	0	119.3
739	G	31	Very low	34.5	Very low	65 Å²	65	149.1 Å²	149.1	67%	0.67	79%	0.785	S	S	*	*			cis	169.1	148	-11.5	0	0	0	0	0	114.2
740	S	34.4	Very low	34.8	Very low	112 Å²	112	151 Å²	151	78%	0.783	79%	0.789	S	S	*	*			trans	63.3	115.3	170.1	-47.6	0	0	0	0	117.2
741	D	34	Very low	35	Very low	149 Å²	149	150.4 Å²	150.4	80%	0.797	79%	0.792	S	S	*	*			cis	89.5	110.6	48.6	-73	-48.9	0	0	0	115
742	L	35.1	Very low	34.8	Very low	168 Å²	168	146.9 Å²	146.9	88%	0.88	80%	0.796	S	S	*	*				169.8	164.3	116.4	-87.7	177.6	0	0	0	113.1
743	N	38.2	Very low	34.8	Very low	157 Å²	157	147.7 Å²	147.7	84%	0.84	80%	0.801	S	S	*	*			trans	-103.1	145.6	-165.4	-65.7	-80.4	0	0	0	114.9
744	A	34.6	Very low	35	Very low	104 Å²	104	149.1 Å²	149.1	86%	0.86	80%	0.795	S	S	*	*			trans	-151.6	159.3	157	0	0	0	0	0	111.2
745	V	37.4	Very low	35.4	Very low	128 Å²	128	149.5 Å²	149.5	78%	0.776	80%	0.795	S	S	*	*			trans	-128.5	144.7	-160.2	166.4	0	0	0	0	113.6
746	R	35.8	Very low	35.8	Very low	238 Å²	238	144.9 Å²	144.9	90%	0.898	78%	0.784	S	S	*	*			trans	69.4	136.4	177.9	-70.7	162.7	173.9	-168.5	-0.9	113.8
747	S	35.6	Very low	36.4	Very low	113 Å²	113	145.4 Å²	145.4	79%	0.79	79%	0.788	S	S	*	*				-162.4	175.5	52.2	61.2	0	0	0	0	116.5
748	R	39.1	Very low	36.9	Very low	228 Å²	228	148.5 Å²	148.5	86%	0.86	79%	0.793	S	S	*	*			trans	-33.6	146.7	179.6	-51	168.7	-164	-166	2.8	117.6
749	L	39.1	Very low	37.1	Very low	143 Å²	143	143.5 Å²	143.5	75%	0.749	78%	0.778	S	S	*	*			trans	29.8	121	147.1	-83.6	62.4	0	0	0	118.6
750	H	36.7	Very low	37.7	Very low	162 Å²	162	146.6 Å²	146.6	75%	0.75	79%	0.786	S	S	*	*				-179.3	148.2	97.8	-92.8	-63	0	0	0	112.7
751	K	36.5	Very low	38.4	Very low	192 Å²	192	148.9 Å²	148.9	84%	0.835	79%	0.789	S	S	*	*			trans	53.9	96.3	156.6	-61.4	165.4	-175.1	173.6	0	117
752	S	32.8	Very low	39	Very low	111 Å²	111	146.8 Å²	146.8	78%	0.776	79%	0.786	S	S	*	*			trans	-66.9	142	156.4	50.1	0	0	0	0	110.7	H754	S752-H754 PolarHBondContact O-N 2.8Å; S752-H754 VanDerWaalsContact O-N 3.09Å
753	P	43.1	Very low	39.5	Very low	124 Å²	124	150.1 Å²	150.1	81%	0.805	79%	0.787	S	S	*	*			trans	-72.6	101.1	169.9	29.2	-32.2	0	0	0	109.2	P755	P753-P755 WeakPolarHBondContact O-CD 3.44Å
754	H	34.7	Very low	40.3	Very low	142 Å²	142	152.4 Å²	152.4	66%	0.657	78%	0.784	S	S	*	*			trans	-62.9	121.4	171.7	175.3	82.5	0	0	0	109.5	S752 Q756	S752-H754 PolarHBondContact O-N 2.8Å; S752-H754 VanDerWaalsContact O-N 3.09Å; H754-Q756 VanDerWaalsContact C-N 3.26Å; H754-Q756 PolarHBondContact O-N 2.85Å
755	P	41.1	Very low	41.4	Very low	117 Å²	117	150.9 Å²	150.9	76%	0.76	77%	0.765	S	S	*	*			trans	-72.8	83.6	178	29.9	-34.1	0	0	0	109.5	P753 S757	P753-P755 WeakPolarHBondContact O-CD 3.44Å; P755-S757 PolarHBondContact O-N 3.04Å
756	Q	35.6	Very low	42.5	Very low	148 Å²	148	155.4 Å²	155.4	69%	0.692	77%	0.768	S	S	*	*			trans	-63.2	116.7	-172	-162.5	178.2	30.2	0	0	110.5	H754 R758	H754-Q756 VanDerWaalsContact C-N 3.26Å; H754-Q756 PolarHBondContact O-N 2.85Å; Q756-R758 PolarHBondContact O-N 2.78Å
757	S	44.9	Very low	43.8	Very low	112 Å²	112	146.5 Å²	146.5	78%	0.783	74%	0.735	S	S	*	*			trans	-68.7	86.6	-171.2	44.5	0	0	0	0	113	P755 S759	P755-S757 PolarHBondContact O-N 3.04Å; S757-S759 PolarHBondContact O-N 2.83Å; S757-S759 VanDerWaalsContact O-N 3.1Å
758	R	40.4	Very low	45.3	Very low	224 Å²	224	148.6 Å²	148.6	85%	0.845	74%	0.737	S	S	*	*			trans	-70.7	104.2	172.8	-71.1	-170.3	175.6	-163.8	-0.8	111.2	Q756	Q756-R758 PolarHBondContact O-N 2.78Å
759	S	39.4	Very low	47	Very low	76 Å²	76	139.7 Å²	139.7	53%	0.531	71%	0.71	S	S	.	*			trans	16.6	123.4	151.1	51.4	0	0	0	0	118.5	S757 L761	S757-S759 PolarHBondContact O-N 2.83Å; S757-S759 VanDerWaalsContact O-N 3.1Å; S759-L761 PolarHBondContact O-N 2.82Å
760	P	43.4	Very low	48.9	Very low	130 Å²	130	141.2 Å²	141.2	84%	0.844	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.3	13.9	173.7	33.2	-37.2	0	0	0	114.2
761	L	48.6	Very low	51	Low	160 Å²	160	140.5 Å²	140.5	84%	0.838	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.8	18.3	-169.3	-65.8	174.9	0	0	0	114.1	S759	S759-L761 PolarHBondContact O-N 2.82Å
762	S	46.7	Very low	53	Low	105 Å²	105	136.2 Å²	136.2	73%	0.734	69%	0.687	S	S	*	*			trans	-147.8	61.9	171.5	-160.3	0	0	0	0	112.6
763	R	46.8	Very low	55.2	Low	239 Å²	239	135.5 Å²	135.5	90%	0.902	67%	0.668	S	S	*	*			trans	-107.8	63.3	154.1	-71.6	-169.6	-173.4	-113.6	4.7	109.7
764	R	54	Low	56.9	Low	205 Å²	205	131.9 Å²	131.9	77%	0.774	64%	0.64	S	S	*	*			trans	-70.9	130.2	146.7	-165	-179.8	-162.2	-154.7	2.2	105.2	R766	R764-R766 PolarHBondContact O-N 2.92Å
765	P	58.5	Low	59.2	Low	72 Å²	72	131 Å²	131	47%	0.468	64%	0.636	S	S	.	*			trans	-52.9	127.1	171.3	-24	33.5	0	0	0	108.7	Y767	P765-Y767 HydrophobicContact CB-CD2 4.24Å; P765-Y767 HydrophobicContact CB-CE1 4.23Å; P765-Y767 HydrophobicContact CB-CE2 3.8Å; P765-Y767 HydrophobicContact CG-CE2 4.44Å
766	R	60.5	Low	61.2	Low	223 Å²	223	128.4 Å²	128.4	84%	0.842	61%	0.614	S	S	*	*			trans	-84.7	104.7	155.2	-76.6	-174.7	178.5	174.2	-3.1	104.1	R764 D768	R764-R766 PolarHBondContact O-N 2.92Å; R766-D768 PolarHBondContact O-N 3.2Å
767	Y	62.4	Low	63.5	Low	51 Å²	51	128 Å²	128	20%	0.2	61%	0.606	C	S	.	*			trans	-69.8	120	164.9	-55.6	-87.9	0	0	0	105.8	P765 S769 E772 Y773 E776	P765-Y767 HydrophobicContact CB-CD2 4.24Å; P765-Y767 HydrophobicContact CB-CE1 4.23Å; P765-Y767 HydrophobicContact CB-CE2 3.8Å; P765-Y767 HydrophobicContact CG-CE2 4.44Å; Y767-S769 VanDerWaalsContact C-N 3.28Å; Y767-S769 WeakPolarHBondContact CB-O 3.16Å; Y767-E772 VanDerWaalsContact CA-OE2 3.25Å; Y767-E772 WeakPolarHBondContact CA-OE2 3.46Å; Y767-E772 HydrophobicContact CD1-CB 4.13Å; Y767-E772 HydrophobicContact CD1-CG 3.87Å; Y767-Y773 AromaticContact CD2-CD2 3.68Å; Y767-Y773 HydrophobicContact CD2-CD2 3.68Å; Y767-Y773 HydrophobicContact CD2-CG 4.28Å; Y767-Y773 AromaticContact CE2-CD2 3.51Å; Y767-Y773 HydrophobicContact CE2-CD2 3.51Å; Y767-Y773 HydrophobicContact CE2-CE2 4.26Å; Y767-Y773 HydrophobicContact CE2-CG 4.47Å; Y767-Y773 HydrophobicContact CG-CD2 4.31Å; Y767-Y773 AromaticContact CZ-CD2 3.97Å; Y767-E776 HydrophobicContact CE1-CB 3.73Å; Y767-E776 HydrophobicContact CE1-CG 4.45Å; Y767-E776 PolarHBondContact OH-OE1 3.06Å; Y767-E776 PolarHBondContact OH-OE2 2.82Å; Y767-E776 VanDerWaalsContact OH-OE2 3.12Å
768	D	66.1	Low	65.7	Low	156 Å²	156	128 Å²	128	83%	0.834	60%	0.597	S	S	*	*	S	Bend	trans	-85.5	-8.4	-179.3	-73.7	-30.4	0	0	0	110.9	R766 E772	R766-D768 PolarHBondContact O-N 3.2Å; D768-E772 PolarHBondContact N-OE2 2.8Å
769	S	76.5	Confident	67.9	Low	42 Å²	42	121.4 Å²	121.4	29%	0.294	57%	0.574	S	S	.	*	S	Bend	trans	-121	150	160	176.5	0	0	0	0	112.1	Y767 E771 E772	Y767-S769 VanDerWaalsContact C-N 3.28Å; Y767-S769 WeakPolarHBondContact CB-O 3.16Å; S769-E771 VanDerWaalsContact C-N 3.27Å; S769-E771 PolarHBondContact OG-N 2.84Å; S769-E771 VanDerWaalsContact OG-N 3.07Å; S769-E771 PolarHBondContact OG-OE2 3.47Å; S769-E772 PolarHBondContact O-N 3.09Å
770	Y	77.6	Confident	70.1	Confident	174 Å²	174	125 Å²	125	68%	0.682	58%	0.576	S	S	*	*	H	α-helix	trans	-65.7	-30.1	169.3	175.8	-107.1	0	0	0	112.4	Y773 Q774	Y770-Y773 WeakPolarHBondContact O-CB 3.46Å; Y770-Y773 PolarHBondContact O-N 2.8Å; Y770-Q774 HydrophobicContact CE1-CG 4.15Å; Y770-Q774 VanDerWaalsContact CZ-NE2 3.34Å; Y770-Q774 PolarHBondContact O-N 3.19Å; Y770-Q774 VanDerWaalsContact O-N 3.14Å; Y770-Q774 PolarHBondContact OH-NE2 3.43Å
771	E	82.4	Confident	72.3	Confident	148 Å²	148	122 Å²	122	69%	0.692	55%	0.551	S	S	*	*	H	α-helix	trans	-67.9	-40.5	178.4	-59.6	148.9	150.4	0	0	110.6	S769 Y773 Q774 H775	S769-E771 VanDerWaalsContact C-N 3.27Å; S769-E771 PolarHBondContact OG-N 2.84Å; S769-E771 VanDerWaalsContact OG-N 3.07Å; S769-E771 PolarHBondContact OG-OE2 3.47Å; E771-Y773 VanDerWaalsContact C-N 3.28Å; E771-Y773 PolarHBondContact O-N 2.9Å; E771-Q774 PolarHBondContact O-N 2.8Å; E771-H775 WeakPolarHBondContact O-CB 3.48Å; E771-H775 PolarHBondContact O-N 3.4Å
772	E	77	Confident	74.3	Confident	102 Å²	102	119.2 Å²	119.2	48%	0.477	53%	0.533	S	S	.	.	H	α-helix	trans	-60.3	-38.2	175.6	-164.3	-165.9	-172.8	0	0	111.3	Y767 D768 S769 H775 E776	Y767-E772 VanDerWaalsContact CA-OE2 3.25Å; Y767-E772 WeakPolarHBondContact CA-OE2 3.46Å; Y767-E772 HydrophobicContact CD1-CB 4.13Å; Y767-E772 HydrophobicContact CD1-CG 3.87Å; D768-E772 PolarHBondContact N-OE2 2.8Å; S769-E772 PolarHBondContact O-N 3.09Å; E772-H775 PolarHBondContact O-N 2.95Å; E772-E776 PolarHBondContact O-N 3.09Å
773	Y	79.4	Confident	76.2	Confident	96 Å²	96	121.1 Å²	121.1	38%	0.376	53%	0.526	S	S	.	.	H	α-helix	trans	-66.4	-43.3	174.3	174.6	-108.1	0	0	0	112.7	Y767 Y770 E771 H775 R777	Y767-Y773 AromaticContact CD2-CD2 3.68Å; Y767-Y773 HydrophobicContact CD2-CD2 3.68Å; Y767-Y773 HydrophobicContact CD2-CG 4.28Å; Y767-Y773 AromaticContact CE2-CD2 3.51Å; Y767-Y773 HydrophobicContact CE2-CD2 3.51Å; Y767-Y773 HydrophobicContact CE2-CE2 4.26Å; Y767-Y773 HydrophobicContact CE2-CG 4.47Å; Y767-Y773 HydrophobicContact CG-CD2 4.31Å; Y767-Y773 AromaticContact CZ-CD2 3.97Å; Y770-Y773 WeakPolarHBondContact O-CB 3.46Å; Y770-Y773 PolarHBondContact O-N 2.8Å; E771-Y773 VanDerWaalsContact C-N 3.28Å; E771-Y773 PolarHBondContact O-N 2.9Å; Y773-H775 VanDerWaalsContact C-N 3.34Å; Y773-R777 VanDerWaalsContact O-CB 3.26Å; Y773-R777 WeakPolarHBondContact O-CB 3.21Å; Y773-R777 PolarHBondContact O-N 3.2Å
774	Q	79	Confident	78.4	Confident	47 Å²	47	116.5 Å²	116.5	22%	0.22	51%	0.508	C	S	.	.	H	α-helix	trans	-68.5	-35.4	176	-63.8	-64.5	-3.7	0	0	111.2	Y770 E771 R777 L778	Y770-Q774 HydrophobicContact CE1-CG 4.15Å; Y770-Q774 VanDerWaalsContact CZ-NE2 3.34Å; Y770-Q774 PolarHBondContact O-N 3.19Å; Y770-Q774 VanDerWaalsContact O-N 3.14Å; Y770-Q774 PolarHBondContact OH-NE2 3.43Å; E771-Q774 PolarHBondContact O-N 2.8Å; Q774-R777 WeakPolarHBondContact O-CB 3.34Å; Q774-R777 PolarHBondContact O-N 3.27Å; Q774-L778 WeakPolarHBondContact O-CB 3.3Å; Q774-L778 VanDerWaalsContact O-CG 3.3Å; Q774-L778 WeakPolarHBondContact O-CG 3.39Å; Q774-L778 PolarHBondContact O-N 3.08Å
775	H	82.8	Confident	80.3	Confident	123 Å²	123	111.4 Å²	111.4	57%	0.569	50%	0.496	S	S	*	.	H	α-helix	trans	-67.2	-45.4	175.6	-177	-102.9	0	0	0	112.6	E771 E772 Y773 R777 L778 K779	E771-H775 WeakPolarHBondContact O-CB 3.48Å; E771-H775 PolarHBondContact O-N 3.4Å; E772-H775 PolarHBondContact O-N 2.95Å; Y773-H775 VanDerWaalsContact C-N 3.34Å; H775-R777 VanDerWaalsContact C-N 3.28Å; H775-R777 PolarHBondContact O-N 3.48Å; H775-L778 PolarHBondContact O-N 3.44Å; H775-K779 VanDerWaalsContact O-CB 3.23Å; H775-K779 WeakPolarHBondContact O-CB 3Å; H775-K779 PolarHBondContact O-N 2.84Å
776	E	82.7	Confident	81.8	Confident	64 Å²	64	111.9 Å²	111.9	30%	0.299	49%	0.494	S	S	.	.	H	α-helix	trans	-69.6	-26.1	173.6	-153.4	-155.3	106.1	0	0	112.3	Y767 E772 R780	Y767-E776 HydrophobicContact CE1-CB 3.73Å; Y767-E776 HydrophobicContact CE1-CG 4.45Å; Y767-E776 PolarHBondContact OH-OE1 3.06Å; Y767-E776 PolarHBondContact OH-OE2 2.82Å; Y767-E776 VanDerWaalsContact OH-OE2 3.12Å; E772-E776 PolarHBondContact O-N 3.09Å; E776-R780 VanDerWaalsContact O-CB 3.25Å; E776-R780 WeakPolarHBondContact O-CB 3.43Å; E776-R780 PolarHBondContact O-N 2.84Å; E776-R780 IonicContact OE1-CZ 3.92Å; E776-R780 IonicContact OE1-NH1 3.9Å; E776-R780 PolarHBondContact OE1-NH1 2.66Å; E776-R780 IonicContact OE1-NH2 3.64Å; E776-R780 PolarHBondContact OE1-NH2 2.84Å
777	R	84.8	Confident	83.2	Confident	139 Å²	139	108.2 Å²	108.2	53%	0.525	48%	0.482	S	S	.	.	H	α-helix	trans	-67.3	-51.8	170.9	180	-174.5	170.3	-140.9	-4.6	111.2	Y773 Q774 H775 R780 E781	Y773-R777 VanDerWaalsContact O-CB 3.26Å; Y773-R777 WeakPolarHBondContact O-CB 3.21Å; Y773-R777 PolarHBondContact O-N 3.2Å; Q774-R777 WeakPolarHBondContact O-CB 3.34Å; Q774-R777 PolarHBondContact O-N 3.27Å; H775-R777 VanDerWaalsContact C-N 3.28Å; H775-R777 PolarHBondContact O-N 3.48Å; R777-R780 PolarHBondContact O-N 3.32Å; R777-E781 PolarHBondContact O-N 3.09Å
778	L	90.6	Very high	84.6	Confident	113 Å²	113	110.9 Å²	110.9	59%	0.592	50%	0.496	S	S	*	.	H	α-helix	trans	-61.2	-44.1	177.8	-74	168.9	0	0	0	110.9	Q774 H775 R780 E781 E782	Q774-L778 WeakPolarHBondContact O-CB 3.3Å; Q774-L778 VanDerWaalsContact O-CG 3.3Å; Q774-L778 WeakPolarHBondContact O-CG 3.39Å; Q774-L778 PolarHBondContact O-N 3.08Å; H775-L778 PolarHBondContact O-N 3.44Å; L778-R780 VanDerWaalsContact C-N 3.3Å; L778-R780 PolarHBondContact O-N 3.22Å; L778-E781 CarbonylContact O-C 3.05Å; L778-E781 WeakPolarHBondContact O-CA 3.47Å; L778-E781 VanDerWaalsContact O-CB 3.29Å; L778-E781 WeakPolarHBondContact O-CB 3.49Å; L778-E781 PolarHBondContact O-N 3.26Å; L778-E782 WeakPolarHBondContact O-CB 3.25Å; L778-E782 PolarHBondContact O-N 3.35Å
779	K	86.7	Confident	85.9	Confident	85 Å²	85	110 Å²	110	37%	0.37	48%	0.484	S	S	.	.	H	α-helix	trans	-63.3	-32.2	175.6	-172	156.7	-166.6	138.9	0	113.8	H775 E781 Y783	H775-K779 VanDerWaalsContact O-CB 3.23Å; H775-K779 WeakPolarHBondContact O-CB 3Å; H775-K779 PolarHBondContact O-N 2.84Å; K779-E781 VanDerWaalsContact C-N 3.34Å; K779-Y783 HydrophobicContact CD-CE2 4.37Å; K779-Y783 HydrophobicContact CG-CD2 4.07Å; K779-Y783 HydrophobicContact CG-CE2 3.79Å; K779-Y783 WeakPolarHBondContact O-CD2 3.41Å; K779-Y783 PolarHBondContact O-N 3.19Å; K779-Y783 VanDerWaalsContact O-N 3.07Å
780	R	85.6	Confident	86.6	Confident	152 Å²	152	115.4 Å²	115.4	57%	0.574	50%	0.498	S	S	*	.	H	α-helix	trans	-72.1	-29.4	171.6	176.6	172.9	-74.2	100.8	1.8	112.3	E776 R777 L778 R784	E776-R780 VanDerWaalsContact O-CB 3.25Å; E776-R780 WeakPolarHBondContact O-CB 3.43Å; E776-R780 PolarHBondContact O-N 2.84Å; E776-R780 IonicContact OE1-CZ 3.92Å; E776-R780 IonicContact OE1-NH1 3.9Å; E776-R780 PolarHBondContact OE1-NH1 2.66Å; E776-R780 IonicContact OE1-NH2 3.64Å; E776-R780 PolarHBondContact OE1-NH2 2.84Å; R777-R780 PolarHBondContact O-N 3.32Å; L778-R780 VanDerWaalsContact C-N 3.3Å; L778-R780 PolarHBondContact O-N 3.22Å; R780-R784 PolarHBondContact O-N 2.9Å
781	E	89.2	Confident	87.3	Confident	65 Å²	65	110.2 Å²	110.2	30%	0.304	48%	0.481	S	S	.	.	H	α-helix	trans	-75.4	-46.7	175.6	-162	59.7	-103.9	0	0	111	R777 L778 K779 Y783 R784 L785	R777-E781 PolarHBondContact O-N 3.09Å; L778-E781 CarbonylContact O-C 3.05Å; L778-E781 WeakPolarHBondContact O-CA 3.47Å; L778-E781 VanDerWaalsContact O-CB 3.29Å; L778-E781 WeakPolarHBondContact O-CB 3.49Å; L778-E781 PolarHBondContact O-N 3.26Å; K779-E781 VanDerWaalsContact C-N 3.34Å; E781-Y783 PolarHBondContact O-N 2.9Å; E781-R784 WeakPolarHBondContact O-CA 3.05Å; E781-R784 VanDerWaalsContact O-CB 3.31Å; E781-R784 WeakPolarHBondContact O-CB 3.3Å; E781-R784 PolarHBondContact O-N 2.75Å; E781-R784 IonicContact OE1-CZ 2.78Å; E781-R784 IonicContact OE1-NE 2.8Å; E781-R784 PolarHBondContact OE1-NE 3.43Å; E781-R784 IonicContact OE1-NH2 3.14Å; E781-R784 PolarHBondContact OE1-NH2 3.32Å; E781-R784 IonicContact OE2-NH2 2.68Å; E781-L785 HydrophobicContact CG-CD1 4.47Å; E781-L785 WeakPolarHBondContact O-CG 3.45Å; E781-L785 PolarHBondContact O-N 3.46Å
782	E	90.6	Very high	87.6	Confident	102 Å²	102	110 Å²	110	48%	0.477	48%	0.478	S	S	.	.	H	α-helix	trans	-49.7	-54.2	168.8	179.1	-174.5	-140.3	0	0	111	L778 R784 L785 D786	L778-E782 WeakPolarHBondContact O-CB 3.25Å; L778-E782 PolarHBondContact O-N 3.35Å; E782-R784 PolarHBondContact O-N 3.06Å; E782-R784 VanDerWaalsContact O-N 3.15Å; E782-L785 PolarHBondContact O-N 2.87Å; E782-L785 VanDerWaalsContact O-N 3.15Å; E782-D786 WeakPolarHBondContact O-CB 3.43Å; E782-D786 PolarHBondContact O-N 3.33Å
783	Y	87.9	Confident	88.3	Confident	146 Å²	146	109.2 Å²	109.2	57%	0.573	47%	0.474	S	S	*	.	H	α-helix	trans	-62.4	-21.2	175.5	-78.7	-50.6	0	0	0	114.8	K779 E781 Y787	K779-Y783 HydrophobicContact CD-CE2 4.37Å; K779-Y783 HydrophobicContact CG-CD2 4.07Å; K779-Y783 HydrophobicContact CG-CE2 3.79Å; K779-Y783 WeakPolarHBondContact O-CD2 3.41Å; K779-Y783 PolarHBondContact O-N 3.19Å; K779-Y783 VanDerWaalsContact O-N 3.07Å; E781-Y783 PolarHBondContact O-N 2.9Å; Y783-Y787 WeakPolarHBondContact O-CB 3.47Å; Y783-Y787 PolarHBondContact O-N 3.38Å
784	R	91.7	Very high	88.8	Confident	142 Å²	142	108.3 Å²	108.3	54%	0.536	47%	0.47	S	S	.	.	H	α-helix	trans	-78.4	-47.1	172.8	-176.1	171	73	114.3	-3.3	110.4	R780 E781 E782 Y787 E788	R780-R784 PolarHBondContact O-N 2.9Å; E781-R784 WeakPolarHBondContact O-CA 3.05Å; E781-R784 VanDerWaalsContact O-CB 3.31Å; E781-R784 WeakPolarHBondContact O-CB 3.3Å; E781-R784 PolarHBondContact O-N 2.75Å; E781-R784 IonicContact OE1-CZ 2.78Å; E781-R784 IonicContact OE1-NE 2.8Å; E781-R784 PolarHBondContact OE1-NE 3.43Å; E781-R784 IonicContact OE1-NH2 3.14Å; E781-R784 PolarHBondContact OE1-NH2 3.32Å; E781-R784 IonicContact OE2-NH2 2.68Å; E782-R784 PolarHBondContact O-N 3.06Å; E782-R784 VanDerWaalsContact O-N 3.15Å; R784-Y787 WeakPolarHBondContact O-CB 3.22Å; R784-Y787 PolarHBondContact O-N 3.17Å; R784-E788 WeakPolarHBondContact O-CB 3.27Å; R784-E788 PolarHBondContact O-N 2.99Å
785	L	93.5	Very high	89.1	Confident	97 Å²	97	108.3 Å²	108.3	51%	0.508	48%	0.478	S	S	.	.	H	α-helix	trans	-65	-38.1	178	-65.6	171.3	0	0	0	112	E781 E782 E788 K789	E781-L785 HydrophobicContact CG-CD1 4.47Å; E781-L785 WeakPolarHBondContact O-CG 3.45Å; E781-L785 PolarHBondContact O-N 3.46Å; E782-L785 PolarHBondContact O-N 2.87Å; E782-L785 VanDerWaalsContact O-N 3.15Å; L785-E788 PolarHBondContact O-N 2.99Å; L785-K789 WeakPolarHBondContact O-CB 3.42Å; L785-K789 PolarHBondContact O-N 3.35Å
786	D	91.3	Very high	89.4	Confident	82 Å²	82	106.1 Å²	106.1	44%	0.439	47%	0.468	S	S	.	.	H	α-helix	trans	-62.8	-40.6	172.9	-106.6	6	0	0	0	112.2	E782 R790	E782-D786 WeakPolarHBondContact O-CB 3.43Å; E782-D786 PolarHBondContact O-N 3.33Å; D786-R790 VanDerWaalsContact O-CB 3.31Å; D786-R790 WeakPolarHBondContact O-CB 3.21Å; D786-R790 PolarHBondContact O-N 3.46Å
787	Y	88.8	Confident	89.7	Confident	147 Å²	147	108.1 Å²	108.1	58%	0.576	48%	0.477	S	S	*	.	H	α-helix	trans	-66	-46.5	175.7	-173.7	-81.7	0	0	0	110.6	Y783 R784 R790 E791	Y783-Y787 WeakPolarHBondContact O-CB 3.47Å; Y783-Y787 PolarHBondContact O-N 3.38Å; R784-Y787 WeakPolarHBondContact O-CB 3.22Å; R784-Y787 PolarHBondContact O-N 3.17Å; Y787-R790 PolarHBondContact O-N 3.25Å; Y787-E791 HydrophobicContact CD1-CG 3.94Å; Y787-E791 HydrophobicContact CE1-CG 3.4Å; Y787-E791 WeakPolarHBondContact CE1-OE1 3.42Å; Y787-E791 PolarHBondContact O-N 3.5Å; Y787-E791 PolarHBondContact OH-OE1 2.91Å
788	E	93.3	Very high	89.7	Confident	107 Å²	107	108.4 Å²	108.4	50%	0.5	48%	0.478	S	S	.	.	H	α-helix	trans	-64.7	-44.4	179.8	-170	153.7	-140.8	0	0	111.8	R784 L785 R790 E791 F792	R784-E788 WeakPolarHBondContact O-CB 3.27Å; R784-E788 PolarHBondContact O-N 2.99Å; L785-E788 PolarHBondContact O-N 2.99Å; E788-R790 VanDerWaalsContact C-N 3.33Å; E788-R790 PolarHBondContact O-N 2.9Å; E788-E791 PolarHBondContact O-N 3.09Å; E788-F792 WeakPolarHBondContact O-CB 3.29Å; E788-F792 PolarHBondContact O-N 3.33Å
789	K	93.4	Very high	89.4	Confident	136 Å²	136	107.2 Å²	107.2	59%	0.591	47%	0.47	S	S	*	.	H	α-helix	trans	-57.3	-43.2	171.7	-175.4	179.6	-175.1	-64.1	0	111.7	L785 F792 E793	L785-K789 WeakPolarHBondContact O-CB 3.42Å; L785-K789 PolarHBondContact O-N 3.35Å; K789-F792 PolarHBondContact O-N 3.41Å; K789-E793 WeakPolarHBondContact O-CB 3.38Å; K789-E793 PolarHBondContact O-N 2.78Å
790	R	90.6	Very high	89.4	Confident	156 Å²	156	109.3 Å²	109.3	59%	0.589	48%	0.479	S	S	*	.	H	α-helix	trans	-74.5	-25.8	178	-168.9	175.8	-67.3	157.9	5.5	113.2	D786 Y787 E788 R794	D786-R790 VanDerWaalsContact O-CB 3.31Å; D786-R790 WeakPolarHBondContact O-CB 3.21Å; D786-R790 PolarHBondContact O-N 3.46Å; Y787-R790 PolarHBondContact O-N 3.25Å; E788-R790 VanDerWaalsContact C-N 3.33Å; E788-R790 PolarHBondContact O-N 2.9Å; R790-R794 PolarHBondContact O-NE 2.71Å; R790-R794 PolarHBondContact O-NH2 2.78Å; R790-R794 VanDerWaalsContact O-NH2 3.15Å
791	E	91	Very high	89.3	Confident	66 Å²	66	108.4 Å²	108.4	31%	0.308	48%	0.481	S	S	.	.	H	α-helix	trans	-71.1	-45.1	166.7	-73.1	-60	152.3	0	0	110.8	Y787 E788 R794 A795	Y787-E791 HydrophobicContact CD1-CG 3.94Å; Y787-E791 HydrophobicContact CE1-CG 3.4Å; Y787-E791 WeakPolarHBondContact CE1-OE1 3.42Å; Y787-E791 PolarHBondContact O-N 3.5Å; Y787-E791 PolarHBondContact OH-OE1 2.91Å; E788-E791 PolarHBondContact O-N 3.09Å; E791-R794 VanDerWaalsContact CD-NH1 3.31Å; E791-R794 CarbonylContact O-C 3.26Å; E791-R794 PolarHBondContact O-N 3.2Å; E791-R794 IonicContact OE1-CZ 3.7Å; E791-R794 IonicContact OE1-NH1 2.72Å; E791-R794 PolarHBondContact OE1-NH1 3.38Å; E791-R794 IonicContact OE1-NH2 2.67Å; E791-R794 PolarHBondContact OE1-NH2 3.46Å; E791-R794 IonicContact OE2-CZ 3.21Å; E791-R794 IonicContact OE2-NH1 2.77Å; E791-R794 PolarHBondContact OE2-NH1 3.45Å; E791-R794 IonicContact OE2-NH2 2.74Å; E791-R794 PolarHBondContact OE2-NH2 3.08Å; E791-A795 PolarHBondContact O-N 3.16Å
792	F	89.8	Confident	89	Confident	143 Å²	143	110.3 Å²	110.3	63%	0.627	49%	0.485	S	S	*	.	H	α-helix	trans	-59.2	-50.5	179.8	-177.8	-87.9	0	0	0	111.7	E788 K789 R794 A795 E796	E788-F792 WeakPolarHBondContact O-CB 3.29Å; E788-F792 PolarHBondContact O-N 3.33Å; K789-F792 PolarHBondContact O-N 3.41Å; F792-R794 PolarHBondContact O-N 2.66Å; F792-A795 CarbonylContact O-C 3.47Å; F792-A795 WeakPolarHBondContact O-CA 3.44Å; F792-A795 WeakPolarHBondContact O-CB 3.39Å; F792-A795 PolarHBondContact O-N 3.27Å; F792-E796 HydrophobicContact CE1-CB 4.49Å; F792-E796 WeakPolarHBondContact O-CB 3.46Å; F792-E796 PolarHBondContact O-N 2.68Å
793	E	91.3	Very high	88.6	Confident	85 Å²	85	110.7 Å²	110.7	40%	0.397	49%	0.487	S	S	.	.	H	α-helix	trans	-54.4	-40.2	175.6	-174.9	-171.3	156.1	0	0	112.2	K789 Q797	K789-E793 WeakPolarHBondContact O-CB 3.38Å; K789-E793 PolarHBondContact O-N 2.78Å; E793-Q797 VanDerWaalsContact O-CG 3.29Å; E793-Q797 WeakPolarHBondContact O-CG 3.5Å; E793-Q797 PolarHBondContact O-N 3.33Å
794	R	90.7	Very high	88.5	Confident	78 Å²	78	109.1 Å²	109.1	29%	0.294	48%	0.483	S	S	.	.	H	α-helix	trans	-76.8	-22.3	175.2	-74.6	178.9	-72.4	113.4	-8.7	113.4	R790 E791 F792 R798	R790-R794 PolarHBondContact O-NE 2.71Å; R790-R794 PolarHBondContact O-NH2 2.78Å; R790-R794 VanDerWaalsContact O-NH2 3.15Å; E791-R794 VanDerWaalsContact CD-NH1 3.31Å; E791-R794 CarbonylContact O-C 3.26Å; E791-R794 PolarHBondContact O-N 3.2Å; E791-R794 IonicContact OE1-CZ 3.7Å; E791-R794 IonicContact OE1-NH1 2.72Å; E791-R794 PolarHBondContact OE1-NH1 3.38Å; E791-R794 IonicContact OE1-NH2 2.67Å; E791-R794 PolarHBondContact OE1-NH2 3.46Å; E791-R794 IonicContact OE2-CZ 3.21Å; E791-R794 IonicContact OE2-NH1 2.77Å; E791-R794 PolarHBondContact OE2-NH1 3.45Å; E791-R794 IonicContact OE2-NH2 2.74Å; E791-R794 PolarHBondContact OE2-NH2 3.08Å; F792-R794 PolarHBondContact O-N 2.66Å; R794-R798 WeakPolarHBondContact O-CG 3.43Å; R794-R798 PolarHBondContact O-NH1 2.73Å
795	A	85.2	Confident	88.1	Confident	47 Å²	47	102.6 Å²	102.6	39%	0.388	46%	0.46	S	S	.	.	H	α-helix	trans	-74.9	-47.7	170.4	0	0	0	0	0	110	E791 F792 Q797 R798 E799	E791-A795 PolarHBondContact O-N 3.16Å; F792-A795 CarbonylContact O-C 3.47Å; F792-A795 WeakPolarHBondContact O-CA 3.44Å; F792-A795 WeakPolarHBondContact O-CB 3.39Å; F792-A795 PolarHBondContact O-N 3.27Å; A795-Q797 VanDerWaalsContact C-N 3.32Å; A795-Q797 PolarHBondContact O-N 2.69Å; A795-R798 WeakPolarHBondContact O-CA 3.47Å; A795-R798 WeakPolarHBondContact O-CB 3.48Å; A795-R798 PolarHBondContact O-N 2.79Å; A795-E799 PolarHBondContact O-N 3.14Å
796	E	89.3	Confident	87.5	Confident	77 Å²	77	99.9 Å²	99.9	36%	0.36	45%	0.445	S	S	.	.	H	α-helix	trans	-55.9	-42.2	175.2	-168.9	-166.9	166.8	0	0	112	F792 R798 E799 K800	F792-E796 HydrophobicContact CE1-CB 4.49Å; F792-E796 WeakPolarHBondContact O-CB 3.46Å; F792-E796 PolarHBondContact O-N 2.68Å; E796-R798 VanDerWaalsContact C-N 3.29Å; E796-R798 PolarHBondContact O-N 3.34Å; E796-E799 PolarHBondContact O-N 3.24Å; E796-K800 HydrophobicContact CG-CD 4.34Å; E796-K800 WeakPolarHBondContact O-CB 3.44Å; E796-K800 WeakPolarHBondContact O-CG 3.48Å; E796-K800 PolarHBondContact O-N 2.97Å; E796-K800 WeakPolarHBondContact OE1-CE 3.31Å; E796-K800 IonicContact OE1-NZ 3.18Å; E796-K800 PolarHBondContact OE1-NZ 3.35Å
797	Q	88.6	Confident	86.9	Confident	106 Å²	106	103.2 Å²	103.2	50%	0.495	46%	0.458	S	S	.	.	H	α-helix	trans	-58.8	-36.9	173.1	-77	171.1	6.3	0	0	113.3	E793 A795 Q801	E793-Q797 VanDerWaalsContact O-CG 3.29Å; E793-Q797 WeakPolarHBondContact O-CG 3.5Å; E793-Q797 PolarHBondContact O-N 3.33Å; A795-Q797 VanDerWaalsContact C-N 3.32Å; A795-Q797 PolarHBondContact O-N 2.69Å; Q797-Q801 VanDerWaalsContact O-CG 3.31Å; Q797-Q801 WeakPolarHBondContact O-CG 3.41Å; Q797-Q801 PolarHBondContact O-N 2.78Å
798	R	84.2	Confident	86.8	Confident	144 Å²	144	99 Å²	99	54%	0.543	44%	0.444	S	S	.	.	H	α-helix	trans	-77.3	-38.5	176.1	-64.1	-176.1	-160.3	97.7	-12.6	111.8	R794 A795 E796 K800 Q801 R802	R794-R798 WeakPolarHBondContact O-CG 3.43Å; R794-R798 PolarHBondContact O-NH1 2.73Å; A795-R798 WeakPolarHBondContact O-CA 3.47Å; A795-R798 WeakPolarHBondContact O-CB 3.48Å; A795-R798 PolarHBondContact O-N 2.79Å; E796-R798 VanDerWaalsContact C-N 3.29Å; E796-R798 PolarHBondContact O-N 3.34Å; R798-K800 VanDerWaalsContact C-N 3.32Å; R798-K800 PolarHBondContact O-N 2.81Å; R798-Q801 WeakPolarHBondContact O-CB 3.27Å; R798-Q801 PolarHBondContact O-N 3.36Å; R798-Q801 VanDerWaalsContact O-N 3.17Å; R798-R802 PolarHBondContact O-N 2.87Å
799	E	85.4	Confident	86.5	Confident	89 Å²	89	100.2 Å²	100.2	42%	0.416	44%	0.444	S	S	.	.	H	α-helix	trans	-68.5	-34.5	177.8	-154.6	61.4	-152.7	0	0	111	A795 E796 R802 Q803	A795-E799 PolarHBondContact O-N 3.14Å; E796-E799 PolarHBondContact O-N 3.24Å; E799-R802 PolarHBondContact O-N 2.9Å; E799-R802 WeakPolarHBondContact OE1-CD 3.48Å; E799-R802 IonicContact OE1-CZ 2.8Å; E799-R802 IonicContact OE1-NE 2.76Å; E799-R802 IonicContact OE1-NH1 3.57Å; E799-R802 PolarHBondContact OE1-NH1 3.28Å; E799-R802 IonicContact OE2-NH1 3.15Å; E799-Q803 WeakPolarHBondContact O-CB 3.29Å; E799-Q803 PolarHBondContact O-N 3.15Å
800	K	85.1	Confident	86.3	Confident	128 Å²	128	96.3 Å²	96.3	56%	0.557	43%	0.425	S	S	*	.	H	α-helix	trans	-62.8	-39.5	168.8	-75.4	176	-178.8	171.9	0	112.5	E796 R798 K804	E796-K800 HydrophobicContact CG-CD 4.34Å; E796-K800 WeakPolarHBondContact O-CB 3.44Å; E796-K800 WeakPolarHBondContact O-CG 3.48Å; E796-K800 PolarHBondContact O-N 2.97Å; E796-K800 WeakPolarHBondContact OE1-CE 3.31Å; E796-K800 IonicContact OE1-NZ 3.18Å; E796-K800 PolarHBondContact OE1-NZ 3.35Å; R798-K800 VanDerWaalsContact C-N 3.32Å; R798-K800 PolarHBondContact O-N 2.81Å; K800-K804 VanDerWaalsContact O-CB 3.29Å; K800-K804 WeakPolarHBondContact O-CB 3.47Å; K800-K804 PolarHBondContact O-N 3.01Å
801	Q	84.4	Confident	86.3	Confident	133 Å²	133	89.2 Å²	89.2	62%	0.621	40%	0.399	S	S	*	.	H	α-helix	trans	-64.7	-44.1	173.5	-73.9	168.4	-5.8	0	0	111.7	Q797 R798 A805	Q797-Q801 VanDerWaalsContact O-CG 3.31Å; Q797-Q801 WeakPolarHBondContact O-CG 3.41Å; Q797-Q801 PolarHBondContact O-N 2.78Å; R798-Q801 WeakPolarHBondContact O-CB 3.27Å; R798-Q801 PolarHBondContact O-N 3.36Å; R798-Q801 VanDerWaalsContact O-N 3.17Å; Q801-A805 PolarHBondContact O-N 2.82Å
802	R	83.5	Confident	86.3	Confident	105 Å²	105	86 Å²	86	40%	0.396	39%	0.385	S	S	.	.	H	α-helix	trans	-64.4	-47.4	176.1	178.9	178.6	169.9	-137.1	-3.7	112.2	R798 E799 K804 A805 I806	R798-R802 PolarHBondContact O-N 2.87Å; E799-R802 PolarHBondContact O-N 2.9Å; E799-R802 WeakPolarHBondContact OE1-CD 3.48Å; E799-R802 IonicContact OE1-CZ 2.8Å; E799-R802 IonicContact OE1-NE 2.76Å; E799-R802 IonicContact OE1-NH1 3.57Å; E799-R802 PolarHBondContact OE1-NH1 3.28Å; E799-R802 IonicContact OE2-NH1 3.15Å; R802-K804 VanDerWaalsContact C-N 3.31Å; R802-K804 PolarHBondContact O-N 2.86Å; R802-A805 CarbonylContact O-C 3.54Å; R802-A805 WeakPolarHBondContact O-CA 3.46Å; R802-A805 WeakPolarHBondContact O-CB 3.35Å; R802-A805 PolarHBondContact O-N 2.82Å; R802-I806 HydrophobicContact CG-CD1 4.12Å; R802-I806 WeakPolarHBondContact O-CG1 3.37Å; R802-I806 PolarHBondContact O-N 2.88Å
803	Q	82.4	Confident	86.4	Confident	110 Å²	110	82.1 Å²	82.1	51%	0.514	37%	0.366	S	S	.	.	H	α-helix	trans	-61.5	-41	178.6	-173.7	63.3	15	0	0	111.1	E799 I806 E807	E799-Q803 WeakPolarHBondContact O-CB 3.29Å; E799-Q803 PolarHBondContact O-N 3.15Å; Q803-I806 WeakPolarHBondContact O-CB 3.22Å; Q803-I806 PolarHBondContact O-N 2.91Å; Q803-E807 WeakPolarHBondContact O-CB 3.39Å; Q803-E807 PolarHBondContact O-N 2.77Å
804	K	85.6	Confident	86.4	Confident	113 Å²	113	78 Å²	78	49%	0.491	35%	0.347	S	S	.	.	H	α-helix	trans	-62.1	-41.8	171.7	-171.1	-176.3	168.5	171.3	0	111.8	K800 R802 I806 E807 E808	K800-K804 VanDerWaalsContact O-CB 3.29Å; K800-K804 WeakPolarHBondContact O-CB 3.47Å; K800-K804 PolarHBondContact O-N 3.01Å; R802-K804 VanDerWaalsContact C-N 3.31Å; R802-K804 PolarHBondContact O-N 2.86Å; K804-I806 VanDerWaalsContact C-N 3.27Å; K804-I806 PolarHBondContact O-N 3.21Å; K804-E807 PolarHBondContact O-N 3.33Å; K804-E808 VanDerWaalsContact CE-OE1 3.22Å; K804-E808 WeakPolarHBondContact CE-OE1 3.28Å; K804-E808 VanDerWaalsContact CE-OE2 3.3Å; K804-E808 WeakPolarHBondContact CE-OE2 3.5Å; K804-E808 HydrophobicContact CG-CG 4.22Å; K804-E808 WeakPolarHBondContact CG-OE2 3.29Å; K804-E808 IonicContact NZ-OE1 3.53Å; K804-E808 VanDerWaalsContact O-CB 3.29Å; K804-E808 WeakPolarHBondContact O-CB 3.34Å; K804-E808 VanDerWaalsContact O-CG 3.27Å; K804-E808 WeakPolarHBondContact O-CG 3.09Å; K804-E808 PolarHBondContact O-N 2.98Å
805	A	81.9	Confident	86.2	Confident	6 Å²	6	74.3 Å²	74.3	5%	0.05	33%	0.333	C	S	.	.	H	α-helix	trans	-65.6	-28.3	175	0	0	0	0	0	113.3	Q801 R802 R809 R810 V811 M854	Q801-A805 PolarHBondContact O-N 2.82Å; R802-A805 CarbonylContact O-C 3.54Å; R802-A805 WeakPolarHBondContact O-CA 3.46Å; R802-A805 WeakPolarHBondContact O-CB 3.35Å; R802-A805 PolarHBondContact O-N 2.82Å; A805-R809 PolarHBondContact O-N 3.06Å; A805-R810 HydrophobicContact CB-CB 4.36Å; A805-R810 WeakPolarHBondContact O-CA 3.39Å; A805-R810 WeakPolarHBondContact O-CB 3.5Å; A805-R810 PolarHBondContact O-N 3.43Å; A805-V811 HydrophobicContact CB-CG2 4.27Å; A805-M854 HydrophobicContact CB-CG 3.97Å; A805-M854 HydrophobicContact CB-SD 3.54Å; A805-M854 VanDerWaalsContact CB-SD 3.54Å
806	I	82.4	Confident	86.3	Confident	39 Å²	39	77.2 Å²	77.2	20%	0.2	33%	0.334	C	S	.	.	H	α-helix	trans	-70.8	-50	171.6	-68.6	165.6	0	0	0	110.3	R802 Q803 K804 E808 R809 V811 D884	R802-I806 HydrophobicContact CG-CD1 4.12Å; R802-I806 WeakPolarHBondContact O-CG1 3.37Å; R802-I806 PolarHBondContact O-N 2.88Å; Q803-I806 WeakPolarHBondContact O-CB 3.22Å; Q803-I806 PolarHBondContact O-N 2.91Å; K804-I806 VanDerWaalsContact C-N 3.27Å; K804-I806 PolarHBondContact O-N 3.21Å; I806-E808 PolarHBondContact O-N 3.04Å; I806-R809 WeakPolarHBondContact O-CA 3.43Å; I806-R809 PolarHBondContact O-N 3.49Å; I806-V811 HydrophobicContact CG1-CB 4.12Å; I806-V811 HydrophobicContact CG1-CG2 3.74Å; I806-D884 WeakPolarHBondContact CD1-OD2 3.26Å; I806-D884 HydrophobicContact CG1-CB 4.37Å; I806-D884 HydrophobicContact CG2-CB 4.25Å
807	E	77.8	Confident	86.2	Confident	152 Å²	152	73.8 Å²	73.8	71%	0.71	32%	0.318	S	S	*	.	H	α-helix	trans	-56.9	-46.9	176.4	-176	-172.6	-179.6	0	0	112	Q803 K804 R809	Q803-E807 WeakPolarHBondContact O-CB 3.39Å; Q803-E807 PolarHBondContact O-N 2.77Å; K804-E807 PolarHBondContact O-N 3.33Å; E807-R809 PolarHBondContact O-N 3.5Å; E807-R809 VanDerWaalsContact O-N 3.09Å
808	E	87	Confident	86	Confident	58 Å²	58	72 Å²	72	27%	0.271	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	2.3	175.3	-66.9	177	119.7	0	0	113.2	K804 I806 R810 T858	K804-E808 VanDerWaalsContact CE-OE1 3.22Å; K804-E808 WeakPolarHBondContact CE-OE1 3.28Å; K804-E808 VanDerWaalsContact CE-OE2 3.3Å; K804-E808 WeakPolarHBondContact CE-OE2 3.5Å; K804-E808 HydrophobicContact CG-CG 4.22Å; K804-E808 WeakPolarHBondContact CG-OE2 3.29Å; K804-E808 IonicContact NZ-OE1 3.53Å; K804-E808 VanDerWaalsContact O-CB 3.29Å; K804-E808 WeakPolarHBondContact O-CB 3.34Å; K804-E808 VanDerWaalsContact O-CG 3.27Å; K804-E808 WeakPolarHBondContact O-CG 3.09Å; K804-E808 PolarHBondContact O-N 2.98Å; I806-E808 PolarHBondContact O-N 3.04Å; E808-R810 HydrophobicContact CB-CG 4.26Å; E808-R810 VanDerWaalsContact CD-CZ 3.44Å; E808-R810 PolarHBondContact O-N 3.42Å; E808-R810 IonicContact OE1-CZ 2.71Å; E808-R810 IonicContact OE1-NH1 3.66Å; E808-R810 IonicContact OE1-NH2 2.87Å; E808-R810 PolarHBondContact OE1-NH2 3.22Å; E808-R810 IonicContact OE2-CZ 3.12Å; E808-R810 IonicContact OE2-NH1 3.69Å; E808-R810 PolarHBondContact OE2-NH1 3.01Å; E808-R810 IonicContact OE2-NH2 3.81Å; E808-R810 PolarHBondContact OE2-NH2 3.45Å; E808-T858 HydrophobicContact CB-CG2 4.39Å; E808-T858 WeakPolarHBondContact O-CG2 3.29Å
809	R	86.1	Confident	85.9	Confident	133 Å²	133	69.5 Å²	69.5	50%	0.502	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.1	45.4	-178.2	-57.7	-172.3	-175.6	-175	3.6	113.7	A805 I806 E807 A861 F883	A805-R809 PolarHBondContact O-N 3.06Å; I806-R809 WeakPolarHBondContact O-CA 3.43Å; I806-R809 PolarHBondContact O-N 3.49Å; E807-R809 PolarHBondContact O-N 3.5Å; E807-R809 VanDerWaalsContact O-N 3.09Å; R809-A861 WeakPolarHBondContact O-CB 3.26Å; R809-F883 HydrophobicContact CB-CD1 3.9Å; R809-F883 HydrophobicContact CB-CE1 3.94Å; R809-F883 HydrophobicContact CB-CG 4.32Å; R809-F883 HydrophobicContact CB-CZ 4.36Å; R809-F883 WeakPolarHBondContact O-CE1 3.44Å
810	R	90.1	Very high	85.8	Confident	54 Å²	54	69.8 Å²	69.8	20%	0.204	32%	0.315	C	S	.	.			trans	-95.6	-11.5	172.4	-61.4	-166.2	-171.8	117.8	20.9	113.9	A805 E808 M854 F855 R856 T858	A805-R810 HydrophobicContact CB-CB 4.36Å; A805-R810 WeakPolarHBondContact O-CA 3.39Å; A805-R810 WeakPolarHBondContact O-CB 3.5Å; A805-R810 PolarHBondContact O-N 3.43Å; E808-R810 HydrophobicContact CB-CG 4.26Å; E808-R810 VanDerWaalsContact CD-CZ 3.44Å; E808-R810 PolarHBondContact O-N 3.42Å; E808-R810 IonicContact OE1-CZ 2.71Å; E808-R810 IonicContact OE1-NH1 3.66Å; E808-R810 IonicContact OE1-NH2 2.87Å; E808-R810 PolarHBondContact OE1-NH2 3.22Å; E808-R810 IonicContact OE2-CZ 3.12Å; E808-R810 IonicContact OE2-NH1 3.69Å; E808-R810 PolarHBondContact OE2-NH1 3.01Å; E808-R810 IonicContact OE2-NH2 3.81Å; E808-R810 PolarHBondContact OE2-NH2 3.45Å; R810-M854 WeakPolarHBondContact O-CA 3.48Å; R810-F855 WeakPolarHBondContact CB-O 3.29Å; R810-F855 VanDerWaalsContact CD-O 3.32Å; R810-F855 WeakPolarHBondContact CD-O 3.39Å; R810-F855 PolarHBondContact O-N 3.13Å; R810-R856 WeakPolarHBondContact CD-O 3.23Å; R810-R856 PolarHBondContact NE-O 3.36Å; R810-T858 HydrophobicContact CG-CG2 3.83Å
811	V	90.3	Very high	85.8	Confident	7 Å²	7	63.8 Å²	63.8	4%	0.042	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	117.9	179.1	-175.5	0	0	0	0	111	A805 I806 F852 I853 M854 D884	A805-V811 HydrophobicContact CB-CG2 4.27Å; I806-V811 HydrophobicContact CG1-CB 4.12Å; I806-V811 HydrophobicContact CG1-CG2 3.74Å; V811-F852 HydrophobicContact CG1-CB 4.32Å; V811-F852 HydrophobicContact CG1-CD1 4.25Å; V811-I853 CarbonylContact C-O 3.58Å; V811-I853 WeakPolarHBondContact CA-O 3.26Å; V811-M854 HydrophobicContact CG2-CB 4.16Å; V811-M854 HydrophobicContact CG2-CG 3.9Å; V811-M854 HydrophobicContact CG2-SD 4.25Å; V811-D884 HydrophobicContact CB-CB 4.05Å; V811-D884 HydrophobicContact CG1-CB 3.9Å; V811-D884 PolarHBondContact O-N 2.97Å
812	V	91.3	Very high	86.1	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	122.4	174.9	-176.4	0	0	0	0	109.4	V814 F852 I853 F855 A861 L881 C882 F883	V812-V814 HydrophobicContact CG1-CG2 4.36Å; V812-F852 CarbonylContact O-C 3.55Å; V812-F852 WeakPolarHBondContact O-CA 3.1Å; V812-I853 PolarHBondContact N-O 3.09Å; V812-I853 PolarHBondContact O-N 2.83Å; V812-F855 HydrophobicContact CB-CE2 4.41Å; V812-F855 HydrophobicContact CG2-CD2 4.19Å; V812-F855 HydrophobicContact CG2-CE2 3.92Å; V812-A861 HydrophobicContact CG2-CB 3.78Å; V812-L881 HydrophobicContact CG1-CD2 4.38Å; V812-C882 CarbonylContact C-O 3.54Å; V812-C882 WeakPolarHBondContact CA-O 3.08Å; V812-F883 HydrophobicContact CG2-CD1 4.5Å; V812-F883 HydrophobicContact CG2-CE1 4.28Å
813	Y	91.5	Very high	86.5	Confident	60 Å²	60	60.9 Å²	60.9	24%	0.235	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	137.3	165.6	170.8	-94.5	0	0	0	109.9	G815 F850 F852 E880 L881 C882	Y813-G815 VanDerWaalsContact CE1-N 3.34Å; Y813-F850 HydrophobicContact CD2-CD2 4.26Å; Y813-F850 HydrophobicContact CE2-CB 3.7Å; Y813-F850 AromaticContact CE2-CD2 3.59Å; Y813-F850 HydrophobicContact CE2-CD2 3.59Å; Y813-F850 HydrophobicContact CE2-CE2 4.46Å; Y813-F850 AromaticContact CE2-CG 3.92Å; Y813-F850 HydrophobicContact CE2-CG 3.92Å; Y813-F852 HydrophobicContact CD2-CD1 4.29Å; Y813-F852 AromaticContact CD2-CE1 3.81Å; Y813-F852 HydrophobicContact CD2-CE1 3.81Å; Y813-F852 HydrophobicContact CD2-CZ 4.18Å; Y813-E880 HydrophobicContact CE1-CG 4.45Å; Y813-L881 WeakPolarHBondContact O-CA 3.04Å; Y813-C882 HydrophobicContact CD1-CB 4.32Å; Y813-C882 PolarHBondContact N-O 2.74Å; Y813-C882 PolarHBondContact O-N 2.93Å
814	V	90.6	Very high	86.9	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	94.3	176.5	-170.1	0	0	0	0	109.2	V812 L817 L826 F830 F850 G851 I853 F879 E880 L881	V812-V814 HydrophobicContact CG1-CG2 4.36Å; V814-L817 HydrophobicContact CB-CD2 4.42Å; V814-L817 HydrophobicContact CG1-CD2 3.62Å; V814-L817 HydrophobicContact CG1-CG 4.41Å; V814-L826 HydrophobicContact CB-CD1 4.43Å; V814-L826 HydrophobicContact CG1-CD1 4.17Å; V814-F830 HydrophobicContact CG1-CE2 4.25Å; V814-F830 HydrophobicContact CG1-CZ 3.97Å; V814-F830 HydrophobicContact CG2-CE1 4.3Å; V814-F830 HydrophobicContact CG2-CZ 4.1Å; V814-F850 CarbonylContact O-C 3.57Å; V814-F850 VanDerWaalsContact O-CA 3.3Å; V814-F850 WeakPolarHBondContact O-CA 3.25Å; V814-G851 PolarHBondContact N-O 2.89Å; V814-G851 PolarHBondContact O-N 3.15Å; V814-I853 HydrophobicContact CG2-CD1 3.76Å; V814-I853 HydrophobicContact CG2-CG1 4.05Å; V814-F879 HydrophobicContact CG1-CB 4.2Å; V814-F879 HydrophobicContact CG1-CD1 3.97Å; V814-F879 HydrophobicContact CG1-CG 4.19Å; V814-E880 WeakPolarHBondContact CA-O 3.28Å; V814-L881 HydrophobicContact CB-CD2 4.07Å; V814-L881 HydrophobicContact CG1-CD2 3.76Å; V814-L881 HydrophobicContact CG2-CD2 3.69Å
815	G	88.6	Confident	87.2	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	169.6	174.4	0	0	0	0	0	113.5	Y813 L817 E880	Y813-G815 VanDerWaalsContact CE1-N 3.34Å; G815-L817 VanDerWaalsContact C-N 3.32Å; G815-L817 PolarHBondContact O-N 2.77Å; G815-E880 PolarHBondContact N-O 3.24Å; G815-E880 PolarHBondContact O-N 3.06Å; G815-E880 VanDerWaalsContact O-N 3.07Å
816	R	86.7	Confident	87.6	Confident	108 Å²	108	56.1 Å²	56.1	41%	0.408	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	59	38.7	179.9	-45.7	-175.8	-151.9	158.1	1.8	113.3	N849 P877 Q878 E880	R816-N849 PolarHBondContact N-O 3.07Å; R816-N849 VanDerWaalsContact N-O 3.17Å; R816-P877 HydrophobicContact CB-CB 4.44Å; R816-P877 VanDerWaalsContact O-CG 3.28Å; R816-P877 WeakPolarHBondContact O-CG 3.08Å; R816-Q878 WeakPolarHBondContact CD-O 3.46Å; R816-E880 HydrophobicContact CG-CB 4.18Å; R816-E880 IonicContact CZ-OE2 2.71Å; R816-E880 IonicContact NE-OE2 3.83Å; R816-E880 PolarHBondContact NE-OE2 3.41Å; R816-E880 IonicContact NH2-OE2 2.78Å; R816-E880 PolarHBondContact NH2-OE2 2.91Å
817	L	86.9	Confident	88.1	Confident	5 Å²	5	57.2 Å²	57.2	3%	0.026	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	156.6	170.8	-62.7	-179	0	0	0	110.9	V814 G815 C821 L826 V841 N849 F879	V814-L817 HydrophobicContact CB-CD2 4.42Å; V814-L817 HydrophobicContact CG1-CD2 3.62Å; V814-L817 HydrophobicContact CG1-CG 4.41Å; G815-L817 VanDerWaalsContact C-N 3.32Å; G815-L817 PolarHBondContact O-N 2.77Å; L817-C821 HydrophobicContact CB-CB 4.14Å; L817-L826 HydrophobicContact CD1-CD1 4.36Å; L817-L826 HydrophobicContact CD1-CD2 4.04Å; L817-L826 HydrophobicContact CD2-CD1 3.82Å; L817-V841 HydrophobicContact CD1-CG1 4.11Å; L817-V841 HydrophobicContact CD1-CG2 4.4Å; L817-N849 HydrophobicContact CB-CB 3.91Å; L817-N849 PolarHBondContact N-O 3.45Å; L817-N849 WeakPolarHBondContact O-CB 3.18Å; L817-N849 PolarHBondContact O-ND2 3Å; L817-F879 HydrophobicContact CD2-CD1 3.99Å; L817-F879 HydrophobicContact CD2-CE1 3.84Å
818	R	83.3	Confident	88.8	Confident	69 Å²	69	56.5 Å²	56.5	26%	0.26	27%	0.269	S	S	.	.			trans	-69.8	150.9	169.1	-62.8	164.3	53.8	153.7	-0.7	110.3	D820 C821 E876	R818-D820 WeakPolarHBondContact CB-OD1 3.45Å; R818-D820 IonicContact CZ-OD1 3.6Å; R818-D820 IonicContact CZ-OD2 2.9Å; R818-D820 IonicContact NE-OD1 3.8Å; R818-D820 PolarHBondContact NE-OD1 2.79Å; R818-D820 IonicContact NE-OD2 2.74Å; R818-D820 VanDerWaalsContact NH2-CG 3.3Å; R818-D820 IonicContact NH2-OD1 2.69Å; R818-D820 PolarHBondContact NH2-OD1 3.03Å; R818-D820 VanDerWaalsContact NH2-OD1 3.11Å; R818-D820 IonicContact NH2-OD2 3.64Å; R818-D820 PolarHBondContact NH2-OD2 3.45Å; R818-D820 PolarHBondContact O-N 3.33Å; R818-C821 HydrophobicContact CB-CB 4.25Å; R818-C821 WeakPolarHBondContact O-CB 3.34Å; R818-C821 PolarHBondContact O-N 2.81Å; R818-E876 WeakPolarHBondContact CD-OE1 3.34Å; R818-E876 IonicContact CZ-OE1 3.33Å; R818-E876 IonicContact NE-OE1 2.75Å; R818-E876 IonicContact NH1-OE1 3.11Å; R818-E876 PolarHBondContact NH1-OE1 3.44Å
819	S	83.2	Confident	88.9	Confident	90 Å²	90	55 Å²	55	63%	0.629	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-18.6	174.4	48.7	0	0	0	0	114.2	N849	S819-N849 WeakPolarHBondContact CA-ND2 3.47Å; S819-N849 PolarHBondContact N-ND2 3.28Å
820	D	82.3	Confident	89.1	Confident	95 Å²	95	48.7 Å²	48.7	51%	0.508	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.9	5.6	171.1	67	-31.6	0	0	0	114	R818 S822	R818-D820 WeakPolarHBondContact CB-OD1 3.45Å; R818-D820 IonicContact CZ-OD1 3.6Å; R818-D820 IonicContact CZ-OD2 2.9Å; R818-D820 IonicContact NE-OD1 3.8Å; R818-D820 PolarHBondContact NE-OD1 2.79Å; R818-D820 IonicContact NE-OD2 2.74Å; R818-D820 VanDerWaalsContact NH2-CG 3.3Å; R818-D820 IonicContact NH2-OD1 2.69Å; R818-D820 PolarHBondContact NH2-OD1 3.03Å; R818-D820 VanDerWaalsContact NH2-OD1 3.11Å; R818-D820 IonicContact NH2-OD2 3.64Å; R818-D820 PolarHBondContact NH2-OD2 3.45Å; R818-D820 PolarHBondContact O-N 3.33Å; D820-S822 PolarHBondContact O-N 2.6Å
821	C	86	Confident	89.2	Confident	3 Å²	3	50.4 Å²	50.4	2%	0.02	25%	0.247	C	C	.	.			trans	-70.7	111.5	178.7	-166.7	0	0	0	0	111.1	L817 R818	L817-C821 HydrophobicContact CB-CB 4.14Å; R818-C821 HydrophobicContact CB-CB 4.25Å; R818-C821 WeakPolarHBondContact O-CB 3.34Å; R818-C821 PolarHBondContact O-N 2.81Å
822	S	90.3	Very high	89.3	Confident	49 Å²	49	55 Å²	55	34%	0.343	28%	0.275	S	S	.	.			trans	-84.3	152.1	177.9	66.4	0	0	0	0	112.5	D820 S824 E825 L826	D820-S822 PolarHBondContact O-N 2.6Å; S822-S824 PolarHBondContact O-N 3.36Å; S822-S824 VanDerWaalsContact O-N 3.11Å; S822-S824 PolarHBondContact OG-OG 3.18Å; S822-E825 PolarHBondContact O-N 3.2Å; S822-E825 WeakPolarHBondContact OG-CB 3.36Å; S822-E825 PolarHBondContact OG-N 3.4Å; S822-L826 PolarHBondContact O-N 2.61Å
823	R	92.6	Very high	89.3	Confident	127 Å²	127	56.7 Å²	56.7	48%	0.479	28%	0.282	S	S	.	.	H	α-helix	trans	-47.3	-39.5	169.5	178.7	179.4	174.6	147.1	9.9	112.1	K827 E838 C839 V841	R823-K827 WeakPolarHBondContact O-CB 3.35Å; R823-K827 PolarHBondContact O-N 3.41Å; R823-E838 IonicContact CZ-OE1 2.69Å; R823-E838 IonicContact NH1-OE1 3.86Å; R823-E838 IonicContact NH2-OE1 2.79Å; R823-E838 PolarHBondContact NH2-OE1 3.02Å; R823-C839 WeakPolarHBondContact CD-O 3.24Å; R823-C839 HydrophobicContact CG-CB 4.35Å; R823-C839 VanDerWaalsContact CG-SG 3.6Å; R823-C839 PolarHBondContact NE-O 3.22Å; R823-C839 PolarHBondContact NH1-O 3.24Å; R823-C839 PolarHBondContact NH2-O 2.63Å; R823-C839 VanDerWaalsContact NH2-O 3.09Å; R823-V841 HydrophobicContact CB-CG2 4.23Å
824	S	91.2	Very high	89.3	Confident	87 Å²	87	54.8 Å²	54.8	61%	0.608	28%	0.281	S	S	*	.	H	α-helix	trans	-68.2	-39.6	175.8	32.7	0	0	0	0	114.2	S822 H828	S822-S824 PolarHBondContact O-N 3.36Å; S822-S824 VanDerWaalsContact O-N 3.11Å; S822-S824 PolarHBondContact OG-OG 3.18Å; S824-H828 WeakPolarHBondContact O-CB 3.47Å; S824-H828 PolarHBondContact O-N 3.01Å
825	E	90.9	Very high	89.4	Confident	43 Å²	43	59.7 Å²	59.7	20%	0.201	30%	0.304	C	S	.	.	H	α-helix	trans	-72.4	-41.3	176.3	-173.3	-177.8	-178.9	0	0	111.1	S822 H828 R829 R873	S822-E825 PolarHBondContact O-N 3.2Å; S822-E825 WeakPolarHBondContact OG-CB 3.36Å; S822-E825 PolarHBondContact OG-N 3.4Å; E825-H828 PolarHBondContact O-N 2.88Å; E825-R829 HydrophobicContact CG-CG 4.36Å; E825-R829 WeakPolarHBondContact O-CB 3.44Å; E825-R829 VanDerWaalsContact O-CG 3.29Å; E825-R829 WeakPolarHBondContact O-CG 3.31Å; E825-R829 PolarHBondContact O-N 3.28Å; E825-R829 IonicContact OE1-CZ 3.9Å; E825-R829 IonicContact OE1-NE 3.61Å; E825-R829 PolarHBondContact OE1-NE 3.05Å; E825-R829 VanDerWaalsContact OE1-NE 3.08Å; E825-R829 IonicContact OE1-NH2 3.54Å; E825-R829 PolarHBondContact OE1-NH2 2.91Å; E825-R873 IonicContact OE1-CZ 3.24Å; E825-R873 VanDerWaalsContact OE1-CZ 3.24Å; E825-R873 IonicContact OE1-NH1 3.79Å; E825-R873 PolarHBondContact OE1-NH1 2.81Å; E825-R873 IonicContact OE1-NH2 2.75Å; E825-R873 PolarHBondContact OE1-NH2 3.34Å
826	L	91.1	Very high	89.7	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-59.2	-48.9	175.1	-174.8	65.6	0	0	0	110.7	V814 L817 S822 R829 F830 V841 I853	V814-L826 HydrophobicContact CB-CD1 4.43Å; V814-L826 HydrophobicContact CG1-CD1 4.17Å; L817-L826 HydrophobicContact CD1-CD1 4.36Å; L817-L826 HydrophobicContact CD1-CD2 4.04Å; L817-L826 HydrophobicContact CD2-CD1 3.82Å; S822-L826 PolarHBondContact O-N 2.61Å; L826-R829 PolarHBondContact O-N 2.96Å; L826-F830 HydrophobicContact CD1-CD2 3.76Å; L826-F830 HydrophobicContact CD1-CE2 3.65Å; L826-F830 WeakPolarHBondContact O-CD2 3.37Å; L826-F830 PolarHBondContact O-N 3.44Å; L826-V841 HydrophobicContact CB-CG2 4.09Å; L826-V841 HydrophobicContact CD2-CG2 3.57Å; L826-V841 HydrophobicContact CG-CG2 4.47Å; L826-I853 HydrophobicContact CD1-CD1 4.01Å; L826-I853 HydrophobicContact CD2-CD1 4.13Å; L826-I853 HydrophobicContact CD2-CG1 4.02Å; L826-I853 HydrophobicContact CG-CD1 3.8Å; L826-I853 HydrophobicContact CG-CG1 4.21Å
827	K	93.2	Very high	89.9	Confident	61 Å²	61	60.6 Å²	60.6	27%	0.265	31%	0.313	S	S	.	.	H	α-helix	trans	-55.8	-57.3	174.1	175.8	160.5	176.6	155.6	0	111	R823 R829 F830 E831 I836 C839	R823-K827 WeakPolarHBondContact O-CB 3.35Å; R823-K827 PolarHBondContact O-N 3.41Å; K827-R829 VanDerWaalsContact C-N 3.25Å; K827-R829 PolarHBondContact O-N 3.08Å; K827-F830 PolarHBondContact O-N 2.92Å; K827-F830 VanDerWaalsContact O-N 3.1Å; K827-E831 WeakPolarHBondContact CE-OE1 3.48Å; K827-E831 WeakPolarHBondContact O-CB 3.43Å; K827-E831 PolarHBondContact O-N 3.33Å; K827-I836 HydrophobicContact CD-CB 4.19Å; K827-I836 HydrophobicContact CD-CG2 4.08Å; K827-I836 HydrophobicContact CG-CB 4.26Å; K827-I836 HydrophobicContact CG-CD1 4Å; K827-I836 HydrophobicContact CG-CG2 4.25Å; K827-I836 PolarHBondContact NZ-O 2.99Å; K827-I836 WeakPolarHBondContact O-CD1 3.45Å; K827-C839 HydrophobicContact CB-CB 4.4Å
828	H	91.3	Very high	90.1	Very high	138 Å²	138	65 Å²	65	64%	0.639	33%	0.333	S	S	*	.	H	α-helix	trans	-64.2	-28.2	-172.2	-173	49.1	0	0	0	113.9	S824 E825 E831	S824-H828 WeakPolarHBondContact O-CB 3.47Å; S824-H828 PolarHBondContact O-N 3.01Å; E825-H828 PolarHBondContact O-N 2.88Å; H828-E831 IonicContact CE1-OE2 3.99Å; H828-E831 IonicContact CG-OE2 3.97Å; H828-E831 IonicContact ND1-OE2 3.02Å; H828-E831 PolarHBondContact ND1-OE2 3.44Å
829	R	88.8	Confident	90.5	Very high	26 Å²	26	62 Å²	62	10%	0.098	32%	0.323	C	S	.	.	H	α-helix	trans	-64.7	-52.8	170.7	-75.6	174.5	-177.2	-131.9	28	111.5	E825 L826 K827 V832 L871 R873 E876	E825-R829 HydrophobicContact CG-CG 4.36Å; E825-R829 WeakPolarHBondContact O-CB 3.44Å; E825-R829 VanDerWaalsContact O-CG 3.29Å; E825-R829 WeakPolarHBondContact O-CG 3.31Å; E825-R829 PolarHBondContact O-N 3.28Å; E825-R829 IonicContact OE1-CZ 3.9Å; E825-R829 IonicContact OE1-NE 3.61Å; E825-R829 PolarHBondContact OE1-NE 3.05Å; E825-R829 VanDerWaalsContact OE1-NE 3.08Å; E825-R829 IonicContact OE1-NH2 3.54Å; E825-R829 PolarHBondContact OE1-NH2 2.91Å; L826-R829 PolarHBondContact O-N 2.96Å; K827-R829 VanDerWaalsContact C-N 3.25Å; K827-R829 PolarHBondContact O-N 3.08Å; R829-V832 VanDerWaalsContact O-CG1 3.3Å; R829-V832 WeakPolarHBondContact O-CG1 3.33Å; R829-L871 HydrophobicContact CB-CD1 4.18Å; R829-L871 PolarHBondContact NH1-O 3.45Å; R829-L871 WeakPolarHBondContact O-CD1 3.47Å; R829-R873 VanDerWaalsContact NH2-CZ 3.3Å; R829-E876 IonicContact CZ-OE1 2.66Å; R829-E876 IonicContact CZ-OE2 3.83Å; R829-E876 IonicContact NH1-OE1 3.14Å; R829-E876 IonicContact NH1-OE2 3.59Å; R829-E876 PolarHBondContact NH1-OE2 3.28Å; R829-E876 IonicContact NH2-OE1 3.33Å; R829-E876 PolarHBondContact NH2-OE1 3.27Å; R829-E876 IonicContact NH2-OE2 3.75Å; R829-E876 PolarHBondContact NH2-OE2 3.09Å; R829-E876 VanDerWaalsContact NH2-OE2 3.12Å
830	F	90.8	Very high	90.8	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-83.8	-13.2	-172.2	-77.3	-99.8	0	0	0	114.1	V814 L826 K827 V832 F833 I836 I853 F855 A864 L871 F879 L881	V814-F830 HydrophobicContact CG1-CE2 4.25Å; V814-F830 HydrophobicContact CG1-CZ 3.97Å; V814-F830 HydrophobicContact CG2-CE1 4.3Å; V814-F830 HydrophobicContact CG2-CZ 4.1Å; L826-F830 HydrophobicContact CD1-CD2 3.76Å; L826-F830 HydrophobicContact CD1-CE2 3.65Å; L826-F830 WeakPolarHBondContact O-CD2 3.37Å; L826-F830 PolarHBondContact O-N 3.44Å; K827-F830 PolarHBondContact O-N 2.92Å; K827-F830 VanDerWaalsContact O-N 3.1Å; F830-V832 PolarHBondContact O-N 3.25Å; F830-F833 HydrophobicContact CB-CD2 4.44Å; F830-F833 AromaticContact CD1-CD2 3.93Å; F830-F833 HydrophobicContact CD1-CD2 3.93Å; F830-F833 AromaticContact CD1-CE2 3.88Å; F830-F833 HydrophobicContact CD1-CE2 3.88Å; F830-F833 HydrophobicContact CE1-CE2 4.28Å; F830-F833 PolarHBondContact O-N 2.81Å; F830-I836 HydrophobicContact CB-CD1 3.88Å; F830-I853 HydrophobicContact CB-CD1 3.57Å; F830-I853 HydrophobicContact CD1-CD1 3.8Å; F830-I853 HydrophobicContact CD2-CD1 3.62Å; F830-I853 HydrophobicContact CE1-CD1 4.41Å; F830-I853 HydrophobicContact CE2-CD1 4.25Å; F830-I853 HydrophobicContact CG-CD1 3.37Å; F830-F855 HydrophobicContact CB-CZ 4.28Å; F830-A864 HydrophobicContact CD1-CB 4.23Å; F830-L871 HydrophobicContact CD1-CD1 4.22Å; F830-L871 HydrophobicContact CD2-CD1 4.08Å; F830-L871 HydrophobicContact CE1-CD1 4.38Å; F830-L871 HydrophobicContact CE2-CD1 4.24Å; F830-L871 HydrophobicContact CG-CD1 4.07Å; F830-L871 HydrophobicContact CZ-CD1 4.38Å; F830-F879 HydrophobicContact CZ-CD2 4.29Å; F830-L881 HydrophobicContact CE1-CD1 4.44Å; F830-L881 HydrophobicContact CE1-CD2 3.91Å; F830-L881 HydrophobicContact CZ-CD2 3.93Å
831	E	93.6	Very high	91.2	Very high	90 Å²	90	56.3 Å²	56.3	42%	0.421	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-15.2	172.5	-176.4	166.9	-111.7	0	0	113.2	K827 H828 F833 I836	K827-E831 WeakPolarHBondContact CE-OE1 3.48Å; K827-E831 WeakPolarHBondContact O-CB 3.43Å; K827-E831 PolarHBondContact O-N 3.33Å; H828-E831 IonicContact CE1-OE2 3.99Å; H828-E831 IonicContact CG-OE2 3.97Å; H828-E831 IonicContact ND1-OE2 3.02Å; H828-E831 PolarHBondContact ND1-OE2 3.44Å; E831-F833 VanDerWaalsContact C-N 3.29Å; E831-F833 PolarHBondContact O-N 3.36Å; E831-I836 HydrophobicContact CB-CD1 4.29Å
832	V	92.4	Very high	91.3	Very high	104 Å²	104	59.5 Å²	59.5	63%	0.63	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-23	170.8	73.2	0	0	0	0	113.9	R829 F830 L871	R829-V832 VanDerWaalsContact O-CG1 3.3Å; R829-V832 WeakPolarHBondContact O-CG1 3.33Å; F830-V832 PolarHBondContact O-N 3.25Å; V832-L871 HydrophobicContact CG1-CD1 4.17Å; V832-L871 HydrophobicContact CG1-CD2 3.92Å
833	F	90.5	Very high	91	Very high	35 Å²	35	61.9 Å²	61.9	15%	0.154	32%	0.316	C	S	.	.	S	Bend	trans	-92.7	-16	179.5	-56.1	-57.3	0	0	0	113.6	F830 E831 F855 A863 A864 N867 L871	F830-F833 HydrophobicContact CB-CD2 4.44Å; F830-F833 AromaticContact CD1-CD2 3.93Å; F830-F833 HydrophobicContact CD1-CD2 3.93Å; F830-F833 AromaticContact CD1-CE2 3.88Å; F830-F833 HydrophobicContact CD1-CE2 3.88Å; F830-F833 HydrophobicContact CE1-CE2 4.28Å; F830-F833 PolarHBondContact O-N 2.81Å; E831-F833 VanDerWaalsContact C-N 3.29Å; E831-F833 PolarHBondContact O-N 3.36Å; F833-F855 HydrophobicContact CB-CE1 4.34Å; F833-A863 HydrophobicContact CB-CB 4.45Å; F833-A864 HydrophobicContact CB-CB 3.93Å; F833-A864 VanDerWaalsContact CD2-CA 3.45Å; F833-A864 HydrophobicContact CD2-CB 3.53Å; F833-A864 HydrophobicContact CE2-CB 4.26Å; F833-A864 HydrophobicContact CG-CB 3.91Å; F833-N867 HydrophobicContact CD1-CB 4.44Å; F833-N867 HydrophobicContact CE1-CB 3.6Å; F833-N867 HydrophobicContact CZ-CB 4Å; F833-L871 HydrophobicContact CD2-CD1 4.28Å; F833-L871 HydrophobicContact CE2-CD1 3.35Å; F833-L871 HydrophobicContact CE2-CD2 4.35Å; F833-L871 HydrophobicContact CE2-CG 3.84Å; F833-L871 HydrophobicContact CZ-CD1 3.8Å; F833-L871 HydrophobicContact CZ-CD2 3.95Å; F833-L871 HydrophobicContact CZ-CG 3.76Å
834	G	91.9	Very high	90.6	Very high	20 Å²	20	61.5 Å²	61.5	21%	0.206	32%	0.315	C	S	.	.	S	Bend	trans	157.5	-174.9	-179.2	0	0	0	0	0	114.9	I836 D860	G834-I836 PolarHBondContact O-N 3.15Å; G834-D860 VanDerWaalsContact CA-OD2 3.24Å; G834-D860 WeakPolarHBondContact CA-OD2 3.35Å
835	E	92.9	Very high	89.8	Confident	103 Å²	103	66 Å²	66	48%	0.481	33%	0.332	S	S	.	.			trans	-84.3	109.6	-170.5	-160	-173.6	139.6	0	0	111.5	E837 R856 D860	E835-E837 PolarHBondContact O-N 3.32Å; E835-R856 HydrophobicContact CB-CB 4.5Å; E835-R856 HydrophobicContact CB-CG 4.45Å; E835-R856 PolarHBondContact O-N 2.76Å; E835-R856 WeakPolarHBondContact OE1-CD 3.47Å; E835-R856 IonicContact OE1-CZ 3.08Å; E835-R856 IonicContact OE1-NE 3.38Å; E835-R856 IonicContact OE1-NH1 2.81Å; E835-R856 PolarHBondContact OE1-NH1 3.4Å; E835-R856 IonicContact OE2-CZ 3.01Å; E835-R856 IonicContact OE2-NH1 3.33Å; E835-R856 PolarHBondContact OE2-NH1 3.43Å; E835-D860 PolarHBondContact N-OD2 2.94Å
836	I	94.1	Very high	88.9	Confident	5 Å²	5	69.2 Å²	69.2	3%	0.026	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	113.5	-178.1	-64.5	169.7	0	0	0	110.6	K827 F830 E831 G834 E838 C839 I853 F855	K827-I836 HydrophobicContact CD-CB 4.19Å; K827-I836 HydrophobicContact CD-CG2 4.08Å; K827-I836 HydrophobicContact CG-CB 4.26Å; K827-I836 HydrophobicContact CG-CD1 4Å; K827-I836 HydrophobicContact CG-CG2 4.25Å; K827-I836 PolarHBondContact NZ-O 2.99Å; K827-I836 WeakPolarHBondContact O-CD1 3.45Å; F830-I836 HydrophobicContact CB-CD1 3.88Å; E831-I836 HydrophobicContact CB-CD1 4.29Å; G834-I836 PolarHBondContact O-N 3.15Å; I836-E838 VanDerWaalsContact CG2-O 3.24Å; I836-E838 WeakPolarHBondContact CG2-O 3.49Å; I836-C839 HydrophobicContact CG2-CB 4.14Å; I836-I853 HydrophobicContact CB-CG2 4.35Å; I836-I853 HydrophobicContact CD1-CG2 3.63Å; I836-I853 HydrophobicContact CG1-CG2 3.65Å; I836-I853 HydrophobicContact CG2-CG2 3.79Å; I836-F855 HydrophobicContact CD1-CE1 4.1Å; I836-F855 HydrophobicContact CD1-CZ 4.37Å; I836-F855 HydrophobicContact CG1-CD1 3.8Å; I836-F855 HydrophobicContact CG1-CE1 3.55Å; I836-F855 HydrophobicContact CG1-CZ 4.14Å
837	E	91.5	Very high	88	Confident	123 Å²	123	71.2 Å²	71.2	58%	0.575	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.3	-54.5	176	-171.8	166	-177	0	0	111.1	E835 M854 R856	E835-E837 PolarHBondContact O-N 3.32Å; E837-M854 HydrophobicContact CB-CE 4.06Å; E837-M854 HydrophobicContact CG-CE 3.77Å; E837-M854 PolarHBondContact N-O 2.97Å; E837-R856 HydrophobicContact CB-CG 3.87Å; E837-R856 HydrophobicContact CG-CG 4.5Å
838	E	90.1	Very high	87.4	Confident	96 Å²	96	73.3 Å²	73.3	45%	0.449	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	152.4	172.8	-177.2	141.7	-133.5	0	0	112.1	R823 I836 M854	R823-E838 IonicContact CZ-OE1 2.69Å; R823-E838 IonicContact NH1-OE1 3.86Å; R823-E838 IonicContact NH2-OE1 2.79Å; R823-E838 PolarHBondContact NH2-OE1 3.02Å; I836-E838 VanDerWaalsContact CG2-O 3.24Å; I836-E838 WeakPolarHBondContact CG2-O 3.49Å; E838-M854 HydrophobicContact CB-CB 4.21Å; E838-M854 HydrophobicContact CB-CE 4.03Å; E838-M854 PolarHBondContact N-O 2.98Å; E838-M854 PolarHBondContact O-N 2.81Å
839	C	91.1	Very high	87.3	Confident	8 Å²	8	67 Å²	67	5%	0.054	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	132.5	172.3	44.2	0	0	0	0	108.6	R823 K827 I836 F852	R823-C839 WeakPolarHBondContact CD-O 3.24Å; R823-C839 HydrophobicContact CG-CB 4.35Å; R823-C839 VanDerWaalsContact CG-SG 3.6Å; R823-C839 PolarHBondContact NE-O 3.22Å; R823-C839 PolarHBondContact NH1-O 3.24Å; R823-C839 PolarHBondContact NH2-O 2.63Å; R823-C839 VanDerWaalsContact NH2-O 3.09Å; K827-C839 HydrophobicContact CB-CB 4.4Å; I836-C839 HydrophobicContact CG2-CB 4.14Å; C839-F852 CarbonylContact C-O 3.59Å; C839-F852 VanDerWaalsContact CA-O 3.25Å; C839-F852 WeakPolarHBondContact CA-O 3.4Å
840	A	91.1	Very high	87.4	Confident	32 Å²	32	67.9 Å²	67.9	26%	0.264	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	147.9	173.5	0	0	0	0	0	109.5	G851 F852	A840-G851 CarbonylContact O-C 3.53Å; A840-G851 WeakPolarHBondContact O-CA 3.43Å; A840-F852 HydrophobicContact CB-CB 4.45Å; A840-F852 HydrophobicContact CB-CD2 4.42Å; A840-F852 PolarHBondContact N-O 2.91Å; A840-F852 PolarHBondContact O-N 2.78Å
841	V	90.9	Very high	87.4	Confident	33 Å²	33	67.9 Å²	67.9	20%	0.2	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	121.4	174.4	178.3	0	0	0	0	108.5	L817 R823 L826 L843	L817-V841 HydrophobicContact CD1-CG1 4.11Å; L817-V841 HydrophobicContact CD1-CG2 4.4Å; R823-V841 HydrophobicContact CB-CG2 4.23Å; L826-V841 HydrophobicContact CB-CG2 4.09Å; L826-V841 HydrophobicContact CD2-CG2 3.57Å; L826-V841 HydrophobicContact CG-CG2 4.47Å; V841-L843 HydrophobicContact CG1-CD2 3.72Å; V841-L843 HydrophobicContact CG1-CG 4.19Å
842	N	86.8	Confident	87.4	Confident	70 Å²	70	65.7 Å²	65.7	37%	0.374	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	103.6	176.1	-64.5	-29.3	0	0	0	107.7	F850	N842-F850 HydrophobicContact CB-CD1 4.09Å; N842-F850 HydrophobicContact CB-CD2 4.3Å; N842-F850 HydrophobicContact CB-CE1 3.71Å; N842-F850 HydrophobicContact CB-CE2 3.99Å; N842-F850 HydrophobicContact CB-CG 4.38Å; N842-F850 HydrophobicContact CB-CZ 3.67Å; N842-F850 PolarHBondContact N-O 3.04Å; N842-F850 WeakPolarHBondContact ND2-CE2 3.42Å; N842-F850 WeakPolarHBondContact ND2-CZ 3.44Å; N842-F850 PolarHBondContact O-N 3.21Å
843	L	84.6	Confident	87.4	Confident	98 Å²	98	60.8 Å²	60.8	51%	0.513	32%	0.32	S	S	.	.			trans	-81.6	138.8	171.7	-56.5	179.8	0	0	0	109.1	V841 N849	V841-L843 HydrophobicContact CG1-CD2 3.72Å; V841-L843 HydrophobicContact CG1-CG 4.19Å; L843-N849 WeakPolarHBondContact CA-OD1 3.25Å; L843-N849 WeakPolarHBondContact CB-OD1 3.24Å; L843-N849 HydrophobicContact CD2-CB 3.94Å; L843-N849 WeakPolarHBondContact CD2-OD1 3.31Å
844	R	83.2	Confident	87.6	Confident	120 Å²	120	60.4 Å²	60.4	45%	0.453	32%	0.319	S	S	.	.			trans	-123.1	138.3	177.5	-73.4	-174.9	64.3	172.5	0	110	D846 G847 D848 N849 F850	R844-D846 HydrophobicContact CB-CB 4.45Å; R844-D846 IonicContact CZ-OD2 3.24Å; R844-D846 IonicContact NE-OD2 3.1Å; R844-D846 PolarHBondContact NE-OD2 3.18Å; R844-D846 IonicContact NH2-OD2 2.61Å; R844-D846 PolarHBondContact NH2-OD2 2.85Å; R844-D846 PolarHBondContact O-N 2.72Å; R844-G847 PolarHBondContact O-N 3.1Å; R844-G847 VanDerWaalsContact O-N 3.08Å; R844-D848 WeakPolarHBondContact CD-O 3.41Å; R844-N849 PolarHBondContact N-OD1 3.01Å; R844-N849 PolarHBondContact O-OD1 3.34Å; R844-F850 HydrophobicContact CG-CE1 4.43Å
845	D	74.4	Confident	87.7	Confident	180 Å²	180	59.5 Å²	59.5	96%	0.963	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-23.7	174.4	-64.5	-44.8	0	0	0	112	G847	D845-G847 PolarHBondContact O-N 2.67Å
846	D	72.5	Confident	87.7	Confident	111 Å²	111	59.2 Å²	59.2	59%	0.594	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-11.2	175.6	-44.4	-73.1	0	0	0	114.1	R844 D848	R844-D846 HydrophobicContact CB-CB 4.45Å; R844-D846 IonicContact CZ-OD2 3.24Å; R844-D846 IonicContact NE-OD2 3.1Å; R844-D846 PolarHBondContact NE-OD2 3.18Å; R844-D846 IonicContact NH2-OD2 2.61Å; R844-D846 PolarHBondContact NH2-OD2 2.85Å; R844-D846 PolarHBondContact O-N 2.72Å; D846-D848 VanDerWaalsContact C-N 3.33Å; D846-D848 PolarHBondContact O-N 2.74Å
847	G	71.6	Confident	87.5	Confident	42 Å²	42	64.7 Å²	64.7	43%	0.433	33%	0.325	S	S	.	.	S	Bend	trans	90	-19.6	-176.4	0	0	0	0	0	115.1	R844 D845 N849	R844-G847 PolarHBondContact O-N 3.1Å; R844-G847 VanDerWaalsContact O-N 3.08Å; D845-G847 PolarHBondContact O-N 2.67Å; G847-N849 PolarHBondContact O-N 3.21Å; G847-N849 PolarHBondContact O-ND2 2.77Å
848	D	81.8	Confident	87.5	Confident	105 Å²	105	61.4 Å²	61.4	56%	0.561	31%	0.314	S	S	*	.			trans	-76.2	67.5	174.2	-75.1	-29.7	0	0	0	112.1	R844 D846	R844-D848 WeakPolarHBondContact CD-O 3.41Å; D846-D848 VanDerWaalsContact C-N 3.33Å; D846-D848 PolarHBondContact O-N 2.74Å
849	N	89.1	Confident	87.6	Confident	5 Å²	5	60.5 Å²	60.5	3%	0.027	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	140	175.7	-50.2	-81.2	0	0	0	110.2	R816 L817 S819 L843 R844 G847	R816-N849 PolarHBondContact N-O 3.07Å; R816-N849 VanDerWaalsContact N-O 3.17Å; L817-N849 HydrophobicContact CB-CB 3.91Å; L817-N849 PolarHBondContact N-O 3.45Å; L817-N849 WeakPolarHBondContact O-CB 3.18Å; L817-N849 PolarHBondContact O-ND2 3Å; S819-N849 WeakPolarHBondContact CA-ND2 3.47Å; S819-N849 PolarHBondContact N-ND2 3.28Å; L843-N849 WeakPolarHBondContact CA-OD1 3.25Å; L843-N849 WeakPolarHBondContact CB-OD1 3.24Å; L843-N849 HydrophobicContact CD2-CB 3.94Å; L843-N849 WeakPolarHBondContact CD2-OD1 3.31Å; R844-N849 PolarHBondContact N-OD1 3.01Å; R844-N849 PolarHBondContact O-OD1 3.34Å; G847-N849 PolarHBondContact O-N 3.21Å; G847-N849 PolarHBondContact O-ND2 2.77Å
850	F	90.3	Very high	87.7	Confident	45 Å²	45	61.3 Å²	61.3	20%	0.197	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	164.1	-179.4	65.6	-80	0	0	0	112	Y813 V814 N842 R844 F852	Y813-F850 HydrophobicContact CD2-CD2 4.26Å; Y813-F850 HydrophobicContact CE2-CB 3.7Å; Y813-F850 AromaticContact CE2-CD2 3.59Å; Y813-F850 HydrophobicContact CE2-CD2 3.59Å; Y813-F850 HydrophobicContact CE2-CE2 4.46Å; Y813-F850 AromaticContact CE2-CG 3.92Å; Y813-F850 HydrophobicContact CE2-CG 3.92Å; V814-F850 CarbonylContact O-C 3.57Å; V814-F850 VanDerWaalsContact O-CA 3.3Å; V814-F850 WeakPolarHBondContact O-CA 3.25Å; N842-F850 HydrophobicContact CB-CD1 4.09Å; N842-F850 HydrophobicContact CB-CD2 4.3Å; N842-F850 HydrophobicContact CB-CE1 3.71Å; N842-F850 HydrophobicContact CB-CE2 3.99Å; N842-F850 HydrophobicContact CB-CG 4.38Å; N842-F850 HydrophobicContact CB-CZ 3.67Å; N842-F850 PolarHBondContact N-O 3.04Å; N842-F850 WeakPolarHBondContact ND2-CE2 3.42Å; N842-F850 WeakPolarHBondContact ND2-CZ 3.44Å; N842-F850 PolarHBondContact O-N 3.21Å; R844-F850 HydrophobicContact CG-CE1 4.43Å; F850-F852 AromaticContact CD2-CE2 3.98Å; F850-F852 HydrophobicContact CD2-CE2 3.98Å; F850-F852 HydrophobicContact CD2-CZ 4.24Å; F850-F852 AromaticContact CE2-CE2 3.68Å; F850-F852 HydrophobicContact CE2-CE2 3.68Å; F850-F852 AromaticContact CE2-CZ 3.99Å; F850-F852 HydrophobicContact CE2-CZ 3.99Å
851	G	91.5	Very high	87.8	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	170.3	176	0	0	0	0	0	112.6	V814 A840	V814-G851 PolarHBondContact N-O 2.89Å; V814-G851 PolarHBondContact O-N 3.15Å; A840-G851 CarbonylContact O-C 3.53Å; A840-G851 WeakPolarHBondContact O-CA 3.43Å
852	F	93.1	Very high	87.8	Confident	45 Å²	45	62 Å²	62	20%	0.197	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	143.3	172.7	-59.8	-86.3	0	0	0	108.6	V811 V812 Y813 C839 A840 F850 D884	V811-F852 HydrophobicContact CG1-CB 4.32Å; V811-F852 HydrophobicContact CG1-CD1 4.25Å; V812-F852 CarbonylContact O-C 3.55Å; V812-F852 WeakPolarHBondContact O-CA 3.1Å; Y813-F852 HydrophobicContact CD2-CD1 4.29Å; Y813-F852 AromaticContact CD2-CE1 3.81Å; Y813-F852 HydrophobicContact CD2-CE1 3.81Å; Y813-F852 HydrophobicContact CD2-CZ 4.18Å; C839-F852 CarbonylContact C-O 3.59Å; C839-F852 VanDerWaalsContact CA-O 3.25Å; C839-F852 WeakPolarHBondContact CA-O 3.4Å; A840-F852 HydrophobicContact CB-CB 4.45Å; A840-F852 HydrophobicContact CB-CD2 4.42Å; A840-F852 PolarHBondContact N-O 2.91Å; A840-F852 PolarHBondContact O-N 2.78Å; F850-F852 AromaticContact CD2-CE2 3.98Å; F850-F852 HydrophobicContact CD2-CE2 3.98Å; F850-F852 HydrophobicContact CD2-CZ 4.24Å; F850-F852 AromaticContact CE2-CE2 3.68Å; F850-F852 HydrophobicContact CE2-CE2 3.68Å; F850-F852 AromaticContact CE2-CZ 3.99Å; F850-F852 HydrophobicContact CE2-CZ 3.99Å; F852-D884 WeakPolarHBondContact CE1-OD1 3.27Å
853	I	93.4	Very high	88	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	117.8	178.3	-51.5	-176.7	0	0	0	107.9	V811 V812 V814 L826 F830 I836 F855	V811-I853 CarbonylContact C-O 3.58Å; V811-I853 WeakPolarHBondContact CA-O 3.26Å; V812-I853 PolarHBondContact N-O 3.09Å; V812-I853 PolarHBondContact O-N 2.83Å; V814-I853 HydrophobicContact CG2-CD1 3.76Å; V814-I853 HydrophobicContact CG2-CG1 4.05Å; L826-I853 HydrophobicContact CD1-CD1 4.01Å; L826-I853 HydrophobicContact CD2-CD1 4.13Å; L826-I853 HydrophobicContact CD2-CG1 4.02Å; L826-I853 HydrophobicContact CG-CD1 3.8Å; L826-I853 HydrophobicContact CG-CG1 4.21Å; F830-I853 HydrophobicContact CB-CD1 3.57Å; F830-I853 HydrophobicContact CD1-CD1 3.8Å; F830-I853 HydrophobicContact CD2-CD1 3.62Å; F830-I853 HydrophobicContact CE1-CD1 4.41Å; F830-I853 HydrophobicContact CE2-CD1 4.25Å; F830-I853 HydrophobicContact CG-CD1 3.37Å; I836-I853 HydrophobicContact CB-CG2 4.35Å; I836-I853 HydrophobicContact CD1-CG2 3.63Å; I836-I853 HydrophobicContact CG1-CG2 3.65Å; I836-I853 HydrophobicContact CG2-CG2 3.79Å; I853-F855 HydrophobicContact CB-CE2 4.08Å; I853-F855 HydrophobicContact CG2-CD2 4.05Å; I853-F855 HydrophobicContact CG2-CE1 4.35Å; I853-F855 HydrophobicContact CG2-CE2 3.53Å; I853-F855 HydrophobicContact CG2-CZ 3.71Å
854	M	93.8	Very high	88.3	Confident	28 Å²	28	55.5 Å²	55.5	14%	0.138	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	111	177	-171	169.5	84.7	0	0	108.7	A805 R810 V811 E837 E838	A805-M854 HydrophobicContact CB-CG 3.97Å; A805-M854 HydrophobicContact CB-SD 3.54Å; A805-M854 VanDerWaalsContact CB-SD 3.54Å; R810-M854 WeakPolarHBondContact O-CA 3.48Å; V811-M854 HydrophobicContact CG2-CB 4.16Å; V811-M854 HydrophobicContact CG2-CG 3.9Å; V811-M854 HydrophobicContact CG2-SD 4.25Å; E837-M854 HydrophobicContact CB-CE 4.06Å; E837-M854 HydrophobicContact CG-CE 3.77Å; E837-M854 PolarHBondContact N-O 2.97Å; E838-M854 HydrophobicContact CB-CB 4.21Å; E838-M854 HydrophobicContact CB-CE 4.03Å; E838-M854 PolarHBondContact N-O 2.98Å; E838-M854 PolarHBondContact O-N 2.81Å
855	F	93.8	Very high	88.7	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	155.1	176	-67.1	-90.7	0	0	0	111.1	R810 V812 F830 F833 I836 I853 Y857 D860 A861 A864	R810-F855 WeakPolarHBondContact CB-O 3.29Å; R810-F855 VanDerWaalsContact CD-O 3.32Å; R810-F855 WeakPolarHBondContact CD-O 3.39Å; R810-F855 PolarHBondContact O-N 3.13Å; V812-F855 HydrophobicContact CB-CE2 4.41Å; V812-F855 HydrophobicContact CG2-CD2 4.19Å; V812-F855 HydrophobicContact CG2-CE2 3.92Å; F830-F855 HydrophobicContact CB-CZ 4.28Å; F833-F855 HydrophobicContact CB-CE1 4.34Å; I836-F855 HydrophobicContact CD1-CE1 4.1Å; I836-F855 HydrophobicContact CD1-CZ 4.37Å; I836-F855 HydrophobicContact CG1-CD1 3.8Å; I836-F855 HydrophobicContact CG1-CE1 3.55Å; I836-F855 HydrophobicContact CG1-CZ 4.14Å; I853-F855 HydrophobicContact CB-CE2 4.08Å; I853-F855 HydrophobicContact CG2-CD2 4.05Å; I853-F855 HydrophobicContact CG2-CE1 4.35Å; I853-F855 HydrophobicContact CG2-CE2 3.53Å; I853-F855 HydrophobicContact CG2-CZ 3.71Å; F855-Y857 VanDerWaalsContact C-N 3.3Å; F855-D860 HydrophobicContact CB-CB 3.91Å; F855-D860 HydrophobicContact CD1-CB 3.67Å; F855-D860 HydrophobicContact CE1-CB 4.43Å; F855-D860 HydrophobicContact CG-CB 3.94Å; F855-A861 HydrophobicContact CB-CB 4.3Å; F855-A861 HydrophobicContact CD2-CB 3.73Å; F855-A861 HydrophobicContact CE2-CB 4.45Å; F855-A861 HydrophobicContact CG-CB 4.28Å; F855-A864 HydrophobicContact CE1-CB 4.41Å; F855-A864 HydrophobicContact CE2-CB 3.66Å; F855-A864 HydrophobicContact CZ-CB 3.48Å; F855-A864 VanDerWaalsContact CZ-CB 3.48Å
856	R	92.4	Very high	89.3	Confident	97 Å²	97	49.5 Å²	49.5	37%	0.366	26%	0.258	S	S	.	.	S	Bend	trans	-71.9	-24.7	174.9	-72.4	-176	61.5	-155.2	-18.9	113.4	R810 E835 E837	R810-R856 WeakPolarHBondContact CD-O 3.23Å; R810-R856 PolarHBondContact NE-O 3.36Å; E835-R856 HydrophobicContact CB-CB 4.5Å; E835-R856 HydrophobicContact CB-CG 4.45Å; E835-R856 PolarHBondContact O-N 2.76Å; E835-R856 WeakPolarHBondContact OE1-CD 3.47Å; E835-R856 IonicContact OE1-CZ 3.08Å; E835-R856 IonicContact OE1-NE 3.38Å; E835-R856 IonicContact OE1-NH1 2.81Å; E835-R856 PolarHBondContact OE1-NH1 3.4Å; E835-R856 IonicContact OE2-CZ 3.01Å; E835-R856 IonicContact OE2-NH1 3.33Å; E835-R856 PolarHBondContact OE2-NH1 3.43Å; E837-R856 HydrophobicContact CB-CG 3.87Å; E837-R856 HydrophobicContact CG-CG 4.5Å
857	Y	91.2	Very high	90	Very high	120 Å²	120	47.7 Å²	47.7	47%	0.471	25%	0.248	S	C	.	.	S	Bend	trans	-126.3	155.1	-179.6	-57.1	-75.2	0	0	0	111.5	F855	F855-Y857 VanDerWaalsContact C-N 3.3Å
858	T	91.5	Very high	90.6	Very high	54 Å²	54	45.7 Å²	45.7	33%	0.331	23%	0.228	S	C	.	.	H	α-helix	trans	-73.5	-42.4	-177	62.8	0	0	0	0	111.2	E808 R810 D860 A861 F862	E808-T858 HydrophobicContact CB-CG2 4.39Å; E808-T858 WeakPolarHBondContact O-CG2 3.29Å; R810-T858 HydrophobicContact CG-CG2 3.83Å; T858-D860 VanDerWaalsContact C-N 3.28Å; T858-D860 PolarHBondContact O-N 2.92Å; T858-A861 WeakPolarHBondContact O-CB 3.49Å; T858-A861 PolarHBondContact O-N 3.17Å; T858-F862 VanDerWaalsContact O-CD2 3.26Å; T858-F862 WeakPolarHBondContact O-CD2 3.35Å; T858-F862 PolarHBondContact O-N 3.48Å
859	C	90.6	Very high	90.6	Very high	78 Å²	78	44 Å²	44	53%	0.527	22%	0.216	S	C	.	.	H	α-helix	trans	-55.4	-40.9	177.3	49.1	0	0	0	0	113	A861 F862 A863	C859-A861 VanDerWaalsContact C-N 3.29Å; C859-A861 PolarHBondContact O-N 3.22Å; C859-F862 PolarHBondContact O-N 3.18Å; C859-A863 WeakPolarHBondContact O-CB 3.3Å; C859-A863 PolarHBondContact O-N 3.12Å
860	D	94.5	Very high	90.2	Very high	24 Å²	24	48.8 Å²	48.8	13%	0.128	25%	0.246	C	C	.	.	H	α-helix	trans	-60.3	-41.2	177.5	-57.3	17	0	0	0	110.8	G834 E835 F855 T858 A864	G834-D860 VanDerWaalsContact CA-OD2 3.24Å; G834-D860 WeakPolarHBondContact CA-OD2 3.35Å; E835-D860 PolarHBondContact N-OD2 2.94Å; F855-D860 HydrophobicContact CB-CB 3.91Å; F855-D860 HydrophobicContact CD1-CB 3.67Å; F855-D860 HydrophobicContact CE1-CB 4.43Å; F855-D860 HydrophobicContact CG-CB 3.94Å; T858-D860 VanDerWaalsContact C-N 3.28Å; T858-D860 PolarHBondContact O-N 2.92Å; D860-A864 VanDerWaalsContact O-CB 3.26Å; D860-A864 WeakPolarHBondContact O-CB 3.39Å; D860-A864 PolarHBondContact O-N 2.99Å
861	A	92.6	Very high	89.8	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-71.7	-37.5	178.1	0	0	0	0	0	112.7	R809 V812 F855 T858 C859 A864 L865 F883	R809-A861 WeakPolarHBondContact O-CB 3.26Å; V812-A861 HydrophobicContact CG2-CB 3.78Å; F855-A861 HydrophobicContact CB-CB 4.3Å; F855-A861 HydrophobicContact CD2-CB 3.73Å; F855-A861 HydrophobicContact CE2-CB 4.45Å; F855-A861 HydrophobicContact CG-CB 4.28Å; T858-A861 WeakPolarHBondContact O-CB 3.49Å; T858-A861 PolarHBondContact O-N 3.17Å; C859-A861 VanDerWaalsContact C-N 3.29Å; C859-A861 PolarHBondContact O-N 3.22Å; A861-A864 PolarHBondContact O-N 3.34Å; A861-L865 WeakPolarHBondContact O-CB 3.25Å; A861-L865 PolarHBondContact O-N 2.81Å; A861-F883 HydrophobicContact CB-CE1 3.91Å
862	F	90.4	Very high	89.3	Confident	80 Å²	80	53.9 Å²	53.9	35%	0.351	27%	0.266	S	S	.	.	H	α-helix	trans	-64.6	-46.8	170.1	-79.9	-81.6	0	0	0	111.7	T858 C859 A864 L865 E866 F883	T858-F862 VanDerWaalsContact O-CD2 3.26Å; T858-F862 WeakPolarHBondContact O-CD2 3.35Å; T858-F862 PolarHBondContact O-N 3.48Å; C859-F862 PolarHBondContact O-N 3.18Å; F862-A864 VanDerWaalsContact C-N 3.26Å; F862-A864 PolarHBondContact O-N 3.41Å; F862-L865 PolarHBondContact O-N 3.4Å; F862-L865 VanDerWaalsContact O-N 3.11Å; F862-E866 PolarHBondContact O-N 2.92Å; F862-F883 HydrophobicContact CB-CZ 4.42Å; F862-F883 AromaticContact CD1-CE2 3.59Å; F862-F883 HydrophobicContact CD1-CE2 3.59Å; F862-F883 AromaticContact CD1-CZ 3.55Å; F862-F883 HydrophobicContact CD1-CZ 3.55Å; F862-F883 AromaticContact CD2-CZ 3.93Å; F862-F883 HydrophobicContact CD2-CZ 3.93Å; F862-F883 AromaticContact CE1-CE2 3.38Å; F862-F883 HydrophobicContact CE1-CE2 3.38Å; F862-F883 AromaticContact CE1-CZ 3.64Å; F862-F883 HydrophobicContact CE1-CZ 3.64Å; F862-F883 HydrophobicContact CE2-CE2 4.44Å; F862-F883 AromaticContact CE2-CZ 3.99Å; F862-F883 HydrophobicContact CE2-CZ 3.99Å; F862-F883 HydrophobicContact CG-CE2 4.23Å; F862-F883 AromaticContact CG-CZ 3.7Å; F862-F883 HydrophobicContact CG-CZ 3.7Å; F862-F883 AromaticContact CZ-CE2 3.83Å; F862-F883 HydrophobicContact CZ-CE2 3.83Å; F862-F883 AromaticContact CZ-CZ 3.85Å; F862-F883 HydrophobicContact CZ-CZ 3.85Å
863	A	91.2	Very high	88.5	Confident	31 Å²	31	56.9 Å²	56.9	26%	0.256	28%	0.277	S	S	.	.	H	α-helix	trans	-58.9	-39.6	176.4	0	0	0	0	0	111.5	F833 C859 N867	F833-A863 HydrophobicContact CB-CB 4.45Å; C859-A863 WeakPolarHBondContact O-CB 3.3Å; C859-A863 PolarHBondContact O-N 3.12Å; A863-N867 VanDerWaalsContact O-CB 3.26Å; A863-N867 WeakPolarHBondContact O-CB 3.4Å; A863-N867 PolarHBondContact O-N 2.85Å; A863-N867 PolarHBondContact O-ND2 2.79Å
864	A	92.3	Very high	87.1	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-67.7	-36.4	174.2	0	0	0	0	0	114	F830 F833 F855 D860 A861 F862 G868	F830-A864 HydrophobicContact CD1-CB 4.23Å; F833-A864 HydrophobicContact CB-CB 3.93Å; F833-A864 VanDerWaalsContact CD2-CA 3.45Å; F833-A864 HydrophobicContact CD2-CB 3.53Å; F833-A864 HydrophobicContact CE2-CB 4.26Å; F833-A864 HydrophobicContact CG-CB 3.91Å; F855-A864 HydrophobicContact CE1-CB 4.41Å; F855-A864 HydrophobicContact CE2-CB 3.66Å; F855-A864 HydrophobicContact CZ-CB 3.48Å; F855-A864 VanDerWaalsContact CZ-CB 3.48Å; D860-A864 VanDerWaalsContact O-CB 3.26Å; D860-A864 WeakPolarHBondContact O-CB 3.39Å; D860-A864 PolarHBondContact O-N 2.99Å; A861-A864 PolarHBondContact O-N 3.34Å; F862-A864 VanDerWaalsContact C-N 3.26Å; F862-A864 PolarHBondContact O-N 3.41Å; A864-G868 WeakPolarHBondContact O-CA 3.37Å; A864-G868 PolarHBondContact O-N 3.13Å
865	L	89.8	Confident	86	Confident	40 Å²	40	67.1 Å²	67.1	21%	0.209	34%	0.341	C	S	.	.	H	α-helix	trans	-67.2	-49.2	176.3	175.4	60.3	0	0	0	111.7	A861 F862 H869 L881 F883	A861-L865 WeakPolarHBondContact O-CB 3.25Å; A861-L865 PolarHBondContact O-N 2.81Å; F862-L865 PolarHBondContact O-N 3.4Å; F862-L865 VanDerWaalsContact O-N 3.11Å; L865-H869 PolarHBondContact O-CE1 3.14Å; L865-H869 PolarHBondContact O-ND1 3.43Å; L865-L881 HydrophobicContact CD1-CB 3.65Å; L865-L881 WeakPolarHBondContact CD1-O 3.03Å; L865-F883 HydrophobicContact CB-CZ 4.5Å; L865-F883 HydrophobicContact CD2-CD2 3.51Å; L865-F883 HydrophobicContact CD2-CE2 3.28Å; L865-F883 HydrophobicContact CD2-CG 4.35Å; L865-F883 HydrophobicContact CD2-CZ 3.96Å
866	E	87.7	Confident	85.1	Confident	135 Å²	135	67.3 Å²	67.3	63%	0.631	34%	0.342	S	S	*	.	H	α-helix	trans	-66.3	-55.3	-179.8	-68.3	173.6	-179.5	0	0	110.7	F862 H869	F862-E866 PolarHBondContact O-N 2.92Å; E866-H869 PolarHBondContact O-ND1 3.24Å
867	N	86.6	Confident	84.3	Confident	73 Å²	73	65.7 Å²	65.7	39%	0.39	34%	0.344	S	S	.	.	H	α-helix	trans	-95.8	-10.9	-166.8	-56.6	-85	0	0	0	113.7	F833 A863 H869 T870	F833-N867 HydrophobicContact CD1-CB 4.44Å; F833-N867 HydrophobicContact CE1-CB 3.6Å; F833-N867 HydrophobicContact CZ-CB 4Å; A863-N867 VanDerWaalsContact O-CB 3.26Å; A863-N867 WeakPolarHBondContact O-CB 3.4Å; A863-N867 PolarHBondContact O-N 2.85Å; A863-N867 PolarHBondContact O-ND2 2.79Å; N867-H869 PolarHBondContact O-N 3.03Å; N867-H869 VanDerWaalsContact O-N 3.11Å; N867-T870 VanDerWaalsContact O-CB 3.31Å; N867-T870 WeakPolarHBondContact O-CB 3.41Å; N867-T870 WeakPolarHBondContact O-CG2 3.33Å; N867-T870 PolarHBondContact O-N 3.17Å; N867-T870 PolarHBondContact O-OG1 3.11Å
868	G	84.3	Confident	83.6	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-59.5	-25.3	-178.5	0	0	0	0	0	114.3	A864 T870 L871	A864-G868 WeakPolarHBondContact O-CA 3.37Å; A864-G868 PolarHBondContact O-N 3.13Å; G868-T870 PolarHBondContact O-N 3.04Å; G868-L871 WeakPolarHBondContact O-CB 3.17Å; G868-L871 PolarHBondContact O-N 3.31Å
869	H	82.4	Confident	83.2	Confident	69 Å²	69	62.3 Å²	62.3	32%	0.319	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-57.7	-26.8	170.8	-57.3	104.5	0	0	0	113.2	L865 E866 N867 L871 R872	L865-H869 PolarHBondContact O-CE1 3.14Å; L865-H869 PolarHBondContact O-ND1 3.43Å; E866-H869 PolarHBondContact O-ND1 3.24Å; N867-H869 PolarHBondContact O-N 3.03Å; N867-H869 VanDerWaalsContact O-N 3.11Å; H869-L871 VanDerWaalsContact C-N 3.31Å; H869-L871 PolarHBondContact O-N 2.72Å; H869-R872 VanDerWaalsContact O-CB 3.24Å; H869-R872 WeakPolarHBondContact O-CB 3.48Å; H869-R872 PolarHBondContact O-N 3.06Å
870	T	81.4	Confident	83	Confident	106 Å²	106	61.2 Å²	61.2	65%	0.65	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-73.6	-18.1	176.7	69.3	0	0	0	0	113.7	N867 G868 R872	N867-T870 VanDerWaalsContact O-CB 3.31Å; N867-T870 WeakPolarHBondContact O-CB 3.41Å; N867-T870 WeakPolarHBondContact O-CG2 3.33Å; N867-T870 PolarHBondContact O-N 3.17Å; N867-T870 PolarHBondContact O-OG1 3.11Å; G868-T870 PolarHBondContact O-N 3.04Å; T870-R872 PolarHBondContact O-N 3.46Å
871	L	81.4	Confident	82.7	Confident	39 Å²	39	60.8 Å²	60.8	20%	0.204	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-79	-1	177.1	-52.7	-172.1	0	0	0	113.7	R829 F830 V832 F833 G868 H869 R873 F879	R829-L871 HydrophobicContact CB-CD1 4.18Å; R829-L871 PolarHBondContact NH1-O 3.45Å; R829-L871 WeakPolarHBondContact O-CD1 3.47Å; F830-L871 HydrophobicContact CD1-CD1 4.22Å; F830-L871 HydrophobicContact CD2-CD1 4.08Å; F830-L871 HydrophobicContact CE1-CD1 4.38Å; F830-L871 HydrophobicContact CE2-CD1 4.24Å; F830-L871 HydrophobicContact CG-CD1 4.07Å; F830-L871 HydrophobicContact CZ-CD1 4.38Å; V832-L871 HydrophobicContact CG1-CD1 4.17Å; V832-L871 HydrophobicContact CG1-CD2 3.92Å; F833-L871 HydrophobicContact CD2-CD1 4.28Å; F833-L871 HydrophobicContact CE2-CD1 3.35Å; F833-L871 HydrophobicContact CE2-CD2 4.35Å; F833-L871 HydrophobicContact CE2-CG 3.84Å; F833-L871 HydrophobicContact CZ-CD1 3.8Å; F833-L871 HydrophobicContact CZ-CD2 3.95Å; F833-L871 HydrophobicContact CZ-CG 3.76Å; G868-L871 WeakPolarHBondContact O-CB 3.17Å; G868-L871 PolarHBondContact O-N 3.31Å; H869-L871 VanDerWaalsContact C-N 3.31Å; H869-L871 PolarHBondContact O-N 2.72Å; L871-R873 PolarHBondContact O-N 3.19Å; L871-F879 HydrophobicContact CB-CE2 4.2Å
872	R	80.8	Confident	82.3	Confident	112 Å²	112	62 Å²	62	42%	0.423	32%	0.322	S	S	.	.			trans	-65.9	120.8	175	-179	-170.8	179.9	-163.3	-7.7	109.7	H869 T870 E876 F879	H869-R872 VanDerWaalsContact O-CB 3.24Å; H869-R872 WeakPolarHBondContact O-CB 3.48Å; H869-R872 PolarHBondContact O-N 3.06Å; T870-R872 PolarHBondContact O-N 3.46Å; R872-E876 VanDerWaalsContact CZ-O 3.32Å; R872-E876 PolarHBondContact NE-O 3.01Å; R872-E876 PolarHBondContact NH2-O 2.9Å; R872-F879 HydrophobicContact CB-CE2 4.48Å
873	R	76.1	Confident	82.1	Confident	109 Å²	109	59.5 Å²	59.5	41%	0.411	31%	0.311	S	S	.	.			trans	-75.5	149.4	166.6	-50.8	-179.4	-173.9	127.5	-0.8	109.2	E825 R829 L871 N875 E876	E825-R873 IonicContact OE1-CZ 3.24Å; E825-R873 VanDerWaalsContact OE1-CZ 3.24Å; E825-R873 IonicContact OE1-NH1 3.79Å; E825-R873 PolarHBondContact OE1-NH1 2.81Å; E825-R873 IonicContact OE1-NH2 2.75Å; E825-R873 PolarHBondContact OE1-NH2 3.34Å; R829-R873 VanDerWaalsContact NH2-CZ 3.3Å; L871-R873 PolarHBondContact O-N 3.19Å; R873-N875 WeakPolarHBondContact CB-OD1 2.96Å; R873-N875 PolarHBondContact O-N 3.49Å; R873-E876 HydrophobicContact CB-CG 3.89Å; R873-E876 WeakPolarHBondContact CD-OE1 3.45Å; R873-E876 WeakPolarHBondContact CG-OE2 3.31Å; R873-E876 IonicContact CZ-OE1 3.82Å; R873-E876 PolarHBondContact N-OE2 3.44Å; R873-E876 IonicContact NE-OE1 4Å; R873-E876 IonicContact NH1-OE1 2.87Å; R873-E876 PolarHBondContact NH1-OE1 3.37Å; R873-E876 WeakPolarHBondContact O-CB 3.5Å; R873-E876 PolarHBondContact O-N 3.22Å
874	S	64.1	Low	80.9	Confident	125 Å²	125	60 Å²	60	87%	0.874	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-19.9	-173.7	51.4	0	0	0	0	115
875	N	70.8	Confident	79	Confident	117 Å²	117	63.4 Å²	63.4	63%	0.626	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	9.4	177.7	71.7	-69.6	0	0	0	114.2	R873	R873-N875 WeakPolarHBondContact CB-OD1 2.96Å; R873-N875 PolarHBondContact O-N 3.49Å
876	E	75.9	Confident	77.1	Confident	5 Å²	5	65.6 Å²	65.6	2%	0.023	35%	0.353	C	S	.	.	S	Bend	trans	-115.9	152	-173	-56.8	-177.1	156.6	0	0	110.9	R818 R829 R872 R873	R818-E876 WeakPolarHBondContact CD-OE1 3.34Å; R818-E876 IonicContact CZ-OE1 3.33Å; R818-E876 IonicContact NE-OE1 2.75Å; R818-E876 IonicContact NH1-OE1 3.11Å; R818-E876 PolarHBondContact NH1-OE1 3.44Å; R829-E876 IonicContact CZ-OE1 2.66Å; R829-E876 IonicContact CZ-OE2 3.83Å; R829-E876 IonicContact NH1-OE1 3.14Å; R829-E876 IonicContact NH1-OE2 3.59Å; R829-E876 PolarHBondContact NH1-OE2 3.28Å; R829-E876 IonicContact NH2-OE1 3.33Å; R829-E876 PolarHBondContact NH2-OE1 3.27Å; R829-E876 IonicContact NH2-OE2 3.75Å; R829-E876 PolarHBondContact NH2-OE2 3.09Å; R829-E876 VanDerWaalsContact NH2-OE2 3.12Å; R872-E876 VanDerWaalsContact CZ-O 3.32Å; R872-E876 PolarHBondContact NE-O 3.01Å; R872-E876 PolarHBondContact NH2-O 2.9Å; R873-E876 HydrophobicContact CB-CG 3.89Å; R873-E876 WeakPolarHBondContact CD-OE1 3.45Å; R873-E876 WeakPolarHBondContact CG-OE2 3.31Å; R873-E876 IonicContact CZ-OE1 3.82Å; R873-E876 PolarHBondContact N-OE2 3.44Å; R873-E876 IonicContact NE-OE1 4Å; R873-E876 IonicContact NH1-OE1 2.87Å; R873-E876 PolarHBondContact NH1-OE1 3.37Å; R873-E876 WeakPolarHBondContact O-CB 3.5Å; R873-E876 PolarHBondContact O-N 3.22Å
877	P	74.3	Confident	75.1	Confident	62 Å²	62	67.8 Å²	67.8	40%	0.403	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-59.6	156.3	168.3	28.1	-36.4	0	0	0	110.8	R816 F879	R816-P877 HydrophobicContact CB-CB 4.44Å; R816-P877 VanDerWaalsContact O-CG 3.28Å; R816-P877 WeakPolarHBondContact O-CG 3.08Å; P877-F879 PolarHBondContact O-N 2.84Å
878	Q	76.1	Confident	73.2	Confident	95 Å²	95	70.6 Å²	70.6	44%	0.444	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-73.9	126.4	172.4	179.6	167.2	-21.4	0	0	109.5	R816	R816-Q878 WeakPolarHBondContact CD-O 3.46Å
879	F	83.3	Confident	71.1	Confident	9 Å²	9	77.5 Å²	77.5	4%	0.039	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-55.5	142.7	174.8	-59.1	-54.5	0	0	0	111.1	V814 L817 F830 L871 R872 P877 L881	V814-F879 HydrophobicContact CG1-CB 4.2Å; V814-F879 HydrophobicContact CG1-CD1 3.97Å; V814-F879 HydrophobicContact CG1-CG 4.19Å; L817-F879 HydrophobicContact CD2-CD1 3.99Å; L817-F879 HydrophobicContact CD2-CE1 3.84Å; F830-F879 HydrophobicContact CZ-CD2 4.29Å; L871-F879 HydrophobicContact CB-CE2 4.2Å; R872-F879 HydrophobicContact CB-CE2 4.48Å; P877-F879 PolarHBondContact O-N 2.84Å; F879-L881 HydrophobicContact CB-CD2 4.08Å; F879-L881 HydrophobicContact CB-CG 4.04Å
880	E	86.9	Confident	69	Low	55 Å²	55	78.7 Å²	78.7	26%	0.257	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	101.2	170.9	-172.3	169.4	140	0	0	108.3	Y813 V814 G815 R816	Y813-E880 HydrophobicContact CE1-CG 4.45Å; V814-E880 WeakPolarHBondContact CA-O 3.28Å; G815-E880 PolarHBondContact N-O 3.24Å; G815-E880 PolarHBondContact O-N 3.06Å; G815-E880 VanDerWaalsContact O-N 3.07Å; R816-E880 HydrophobicContact CG-CB 4.18Å; R816-E880 IonicContact CZ-OE2 2.71Å; R816-E880 IonicContact NE-OE2 3.83Å; R816-E880 PolarHBondContact NE-OE2 3.41Å; R816-E880 IonicContact NH2-OE2 2.78Å; R816-E880 PolarHBondContact NH2-OE2 2.91Å
881	L	89.3	Confident	67.1	Low	15 Å²	15	81.4 Å²	81.4	8%	0.079	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	125.3	-174	-59.8	176.1	0	0	0	110.2	V812 Y813 V814 F830 L865 F879	V812-L881 HydrophobicContact CG1-CD2 4.38Å; Y813-L881 WeakPolarHBondContact O-CA 3.04Å; V814-L881 HydrophobicContact CB-CD2 4.07Å; V814-L881 HydrophobicContact CG1-CD2 3.76Å; V814-L881 HydrophobicContact CG2-CD2 3.69Å; F830-L881 HydrophobicContact CE1-CD1 4.44Å; F830-L881 HydrophobicContact CE1-CD2 3.91Å; F830-L881 HydrophobicContact CZ-CD2 3.93Å; L865-L881 HydrophobicContact CD1-CB 3.65Å; L865-L881 WeakPolarHBondContact CD1-O 3.03Å; F879-L881 HydrophobicContact CB-CD2 4.08Å; F879-L881 HydrophobicContact CB-CG 4.04Å
882	C	84.2	Confident	65.2	Low	24 Å²	24	84.2 Å²	84.2	16%	0.162	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	154.4	177.2	-60.1	0	0	0	0	110.1	V812 Y813	V812-C882 CarbonylContact C-O 3.54Å; V812-C882 WeakPolarHBondContact CA-O 3.08Å; Y813-C882 HydrophobicContact CD1-CB 4.32Å; Y813-C882 PolarHBondContact N-O 2.74Å; Y813-C882 PolarHBondContact O-N 2.93Å
883	F	84.6	Confident	63.1	Low	28 Å²	28	90.3 Å²	90.3	12%	0.123	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	148.1	156.5	-74.7	-62.1	0	0	0	109.7	R809 V812 A861 F862 L865 Q886	R809-F883 HydrophobicContact CB-CD1 3.9Å; R809-F883 HydrophobicContact CB-CE1 3.94Å; R809-F883 HydrophobicContact CB-CG 4.32Å; R809-F883 HydrophobicContact CB-CZ 4.36Å; R809-F883 WeakPolarHBondContact O-CE1 3.44Å; V812-F883 HydrophobicContact CG2-CD1 4.5Å; V812-F883 HydrophobicContact CG2-CE1 4.28Å; A861-F883 HydrophobicContact CB-CE1 3.91Å; F862-F883 HydrophobicContact CB-CZ 4.42Å; F862-F883 AromaticContact CD1-CE2 3.59Å; F862-F883 HydrophobicContact CD1-CE2 3.59Å; F862-F883 AromaticContact CD1-CZ 3.55Å; F862-F883 HydrophobicContact CD1-CZ 3.55Å; F862-F883 AromaticContact CD2-CZ 3.93Å; F862-F883 HydrophobicContact CD2-CZ 3.93Å; F862-F883 AromaticContact CE1-CE2 3.38Å; F862-F883 HydrophobicContact CE1-CE2 3.38Å; F862-F883 AromaticContact CE1-CZ 3.64Å; F862-F883 HydrophobicContact CE1-CZ 3.64Å; F862-F883 HydrophobicContact CE2-CE2 4.44Å; F862-F883 AromaticContact CE2-CZ 3.99Å; F862-F883 HydrophobicContact CE2-CZ 3.99Å; F862-F883 HydrophobicContact CG-CE2 4.23Å; F862-F883 AromaticContact CG-CZ 3.7Å; F862-F883 HydrophobicContact CG-CZ 3.7Å; F862-F883 AromaticContact CZ-CE2 3.83Å; F862-F883 HydrophobicContact CZ-CE2 3.83Å; F862-F883 AromaticContact CZ-CZ 3.85Å; F862-F883 HydrophobicContact CZ-CZ 3.85Å; L865-F883 HydrophobicContact CB-CZ 4.5Å; L865-F883 HydrophobicContact CD2-CD2 3.51Å; L865-F883 HydrophobicContact CD2-CE2 3.28Å; L865-F883 HydrophobicContact CD2-CG 4.35Å; L865-F883 HydrophobicContact CD2-CZ 3.96Å; F883-Q886 PolarHBondContact O-N 2.76Å
884	D	66.4	Low	61.2	Low	43 Å²	43	93.4 Å²	93.4	23%	0.23	48%	0.484	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	140.8	-172.7	-154.7	3	0	0	0	112.6	I806 V811 F852 Q886	I806-D884 WeakPolarHBondContact CD1-OD2 3.26Å; I806-D884 HydrophobicContact CG1-CB 4.37Å; I806-D884 HydrophobicContact CG2-CB 4.25Å; V811-D884 HydrophobicContact CB-CB 4.05Å; V811-D884 HydrophobicContact CG1-CB 3.9Å; V811-D884 PolarHBondContact O-N 2.97Å; F852-D884 WeakPolarHBondContact CE1-OD1 3.27Å; D884-Q886 VanDerWaalsContact C-N 3.35Å; D884-Q886 PolarHBondContact O-N 3.07Å
885	G	53.5	Low	60.2	Low	71 Å²	71	93.1 Å²	93.1	73%	0.732	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.4	-37.1	-176	0	0	0	0	0	117.4	K887	G885-K887 PolarHBondContact O-N 2.61Å; G885-K887 VanDerWaalsContact O-N 3.09Å
886	Q	48.2	Very low	59.1	Low	86 Å²	86	93.7 Å²	93.7	40%	0.402	48%	0.481	S	S	.	.			trans	-84.3	92.1	-174.9	-76.6	-159.6	20.7	0	0	114.3	F883 D884 Q888	F883-Q886 PolarHBondContact O-N 2.76Å; D884-Q886 VanDerWaalsContact C-N 3.35Å; D884-Q886 PolarHBondContact O-N 3.07Å; Q886-Q888 PolarHBondContact O-N 3.49Å
887	K	47	Very low	57.6	Low	181 Å²	181	98.9 Å²	98.9	79%	0.787	51%	0.508	S	S	*	.			trans	-63.6	77	154.1	-74.5	-175.3	176.4	178.7	0	110.6	G885 L889 C890	G885-K887 PolarHBondContact O-N 2.61Å; G885-K887 VanDerWaalsContact O-N 3.09Å; K887-L889 PolarHBondContact O-N 2.89Å; K887-C890 PolarHBondContact O-N 2.72Å
888	Q	46.4	Very low	56.1	Low	131 Å²	131	103.3 Å²	103.3	61%	0.612	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	30.6	-172.7	-147.6	177.7	92.1	0	0	114.3	Q886	Q886-Q888 PolarHBondContact O-N 3.49Å
889	L	41	Very low	54.6	Low	145 Å²	145	103.4 Å²	103.4	76%	0.759	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121	0.2	175.5	-73.3	173.3	0	0	0	114	K887	K887-L889 PolarHBondContact O-N 2.89Å
890	C	38.2	Very low	52.7	Low	94 Å²	94	109 Å²	109	64%	0.635	57%	0.565	S	S	*	*			trans	-130.4	50.9	171.1	-68.3	0	0	0	0	112.7	K887 S892	K887-C890 PolarHBondContact O-N 2.72Å; C890-S892 PolarHBondContact O-N 3.02Å; C890-S892 VanDerWaalsContact O-N 3.16Å
891	K	41.7	Very low	50.6	Low	164 Å²	164	111.3 Å²	111.3	71%	0.713	59%	0.587	S	S	*	*			trans	-83.7	42.7	167.9	-88.8	-173.2	170.7	178.4	0	112.9
892	S	41.5	Very low	48.7	Very low	98 Å²	98	117.9 Å²	117.9	69%	0.685	62%	0.622	S	S	*	*	S	Bend	trans	-145.6	117.9	168.8	48.2	0	0	0	0	109.2	C890	C890-S892 PolarHBondContact O-N 3.02Å; C890-S892 VanDerWaalsContact O-N 3.16Å
893	R	35.1	Very low	46.8	Very low	240 Å²	240	122.2 Å²	122.2	91%	0.906	64%	0.644	S	S	*	*	S	Bend	trans	62	52.3	-179.5	-56.6	-176.8	170.1	-155.8	-3.5	116.7
894	Y	36.5	Very low	44.8	Very low	174 Å²	174	129.5 Å²	129.5	68%	0.682	68%	0.676	S	S	*	*			trans	-149.9	39.3	161.3	-128.3	-87.2	0	0	0	112.8	L897	Y894-L897 HydrophobicContact CD1-CB 3.92Å; Y894-L897 HydrophobicContact CD1-CD1 4.22Å; Y894-L897 HydrophobicContact CD2-CD1 4.41Å; Y894-L897 HydrophobicContact CE1-CB 3.53Å; Y894-L897 HydrophobicContact CE1-CD1 3.6Å; Y894-L897 HydrophobicContact CE1-CG 4.2Å; Y894-L897 HydrophobicContact CE2-CD1 3.81Å
895	T	43.8	Very low	43.9	Very low	118 Å²	118	131.4 Å²	131.4	72%	0.724	69%	0.686	S	S	*	*	S	Bend	trans	-81.9	-17.4	171.5	34.4	0	0	0	0	113.2
896	D	47.5	Very low	43.6	Very low	130 Å²	130	133 Å²	133	70%	0.695	68%	0.684	S	S	*	*	S	Bend	trans	-106	10.2	-158.6	-46.9	-6.1	0	0	0	112.6
897	L	44.4	Very low	43.5	Very low	113 Å²	113	133 Å²	133	59%	0.592	69%	0.69	S	S	*	*	S	Bend	trans	-134.5	22.7	-166.7	-72.1	171.1	0	0	0	113.7	Y894	Y894-L897 HydrophobicContact CD1-CB 3.92Å; Y894-L897 HydrophobicContact CD1-CD1 4.22Å; Y894-L897 HydrophobicContact CD2-CD1 4.41Å; Y894-L897 HydrophobicContact CE1-CB 3.53Å; Y894-L897 HydrophobicContact CE1-CD1 3.6Å; Y894-L897 HydrophobicContact CE1-CG 4.2Å; Y894-L897 HydrophobicContact CE2-CD1 3.81Å
898	D	42.2	Very low	43.4	Very low	156 Å²	156	129.7 Å²	129.7	83%	0.834	69%	0.689	S	S	*	*	S	Bend	trans	-121.4	33.2	169.6	-146	18.7	0	0	0	109.8
899	S	44.4	Very low	43.4	Very low	96 Å²	96	129.5 Å²	129.5	67%	0.671	70%	0.697	S	S	*	*	S	Bend	trans	-144.4	25.5	-170.7	-52.5	0	0	0	0	113.6
900	H	43.3	Very low	44	Very low	128 Å²	128	128.2 Å²	128.2	59%	0.593	69%	0.685	S	S	*	*			trans	-147.7	46.7	179.5	-163	-65.3	0	0	0	112	D903	H900-D903 IonicContact CD2-OD2 3.78Å; H900-D903 IonicContact NE2-OD2 3.76Å
901	S	44.6	Very low	45.1	Very low	102 Å²	102	127 Å²	127	71%	0.713	68%	0.678	S	S	*	*	S	Bend	trans	-96.7	-21.5	168.9	51.6	0	0	0	0	113.8
902	D	47.5	Very low	46.2	Very low	153 Å²	153	124.7 Å²	124.7	82%	0.818	67%	0.668	S	S	*	*	S	Bend	trans	-94.3	-20.6	-178.1	-72.3	-52.2	0	0	0	114.1	F904	D902-F904 PolarHBondContact O-N 3.27Å
903	D	44.3	Very low	47.5	Very low	116 Å²	116	125 Å²	125	62%	0.62	66%	0.655	S	S	*	*			trans	-71.6	10.1	178.8	-79.6	-42.5	0	0	0	114.5	H900 D905	H900-D903 IonicContact CD2-OD2 3.78Å; H900-D903 IonicContact NE2-OD2 3.76Å; D903-D905 PolarHBondContact O-N 3.22Å; D903-D905 VanDerWaalsContact O-N 3.13Å
904	F	43.4	Very low	49.2	Very low	180 Å²	180	118.3 Å²	118.3	79%	0.789	64%	0.637	S	S	*	*			trans	-86.3	52.9	172.1	-119.3	-73.4	0	0	0	112	D902 P906	D902-F904 PolarHBondContact O-N 3.27Å; F904-P906 VanDerWaalsContact O-CD 3.27Å; F904-P906 WeakPolarHBondContact O-CD 3.3Å
905	D	46.7	Very low	51.1	Low	84 Å²	84	115 Å²	115	45%	0.449	64%	0.639	S	S	.	*			trans	-62.4	113.3	175.1	-174.7	-17.3	0	0	0	110.3	D903 T907 S908	D903-D905 PolarHBondContact O-N 3.22Å; D903-D905 VanDerWaalsContact O-N 3.13Å; D905-T907 PolarHBondContact O-N 3.05Å; D905-T907 VanDerWaalsContact O-N 3.13Å; D905-T907 WeakPolarHBondContact OD1-CA 3.09Å; D905-T907 VanDerWaalsContact OD1-CB 3.26Å; D905-T907 WeakPolarHBondContact OD1-CB 3.12Å; D905-T907 WeakPolarHBondContact OD1-CG2 3.29Å; D905-T907 PolarHBondContact OD1-N 3.02Å; D905-T907 PolarHBondContact OD1-OG1 2.74Å; D905-T907 PolarHBondContact OD2-OG1 3.43Å; D905-S908 WeakPolarHBondContact O-CB 3.26Å; D905-S908 PolarHBondContact O-N 2.88Å
906	P	48.4	Very low	53	Low	105 Å²	105	113 Å²	113	68%	0.682	62%	0.622	S	S	*	*	G	3₁₀ helix	trans	-65.2	-17.6	-179.1	28.9	-35.8	0	0	0	112.6	F904 S908 T909	F904-P906 VanDerWaalsContact O-CD 3.27Å; F904-P906 WeakPolarHBondContact O-CD 3.3Å; P906-S908 PolarHBondContact O-N 2.78Å; P906-T909 PolarHBondContact O-OG1 3.42Å; P906-T909 VanDerWaalsContact O-OG1 3.09Å
907	T	45.1	Very low	54.7	Low	86 Å²	86	111.2 Å²	111.2	53%	0.528	61%	0.613	S	S	.	*	G	3₁₀ helix	trans	-74	-10.9	174.8	77.6	0	0	0	0	113.2	D905 T909 K910	D905-T907 PolarHBondContact O-N 3.05Å; D905-T907 VanDerWaalsContact O-N 3.13Å; D905-T907 WeakPolarHBondContact OD1-CA 3.09Å; D905-T907 VanDerWaalsContact OD1-CB 3.26Å; D905-T907 WeakPolarHBondContact OD1-CB 3.12Å; D905-T907 WeakPolarHBondContact OD1-CG2 3.29Å; D905-T907 PolarHBondContact OD1-N 3.02Å; D905-T907 PolarHBondContact OD1-OG1 2.74Å; D905-T907 PolarHBondContact OD2-OG1 3.43Å; T907-T909 PolarHBondContact O-N 3.07Å; T907-K910 WeakPolarHBondContact O-CA 3.13Å; T907-K910 WeakPolarHBondContact O-CB 3.37Å; T907-K910 PolarHBondContact O-N 2.68Å
908	S	46.4	Very low	56.7	Low	110 Å²	110	113.5 Å²	113.5	77%	0.769	62%	0.619	S	S	*	*	G	3₁₀ helix	trans	-65.3	-11.1	174.6	-163.4	0	0	0	0	113.8	D905 P906 K910	D905-S908 WeakPolarHBondContact O-CB 3.26Å; D905-S908 PolarHBondContact O-N 2.88Å; P906-S908 PolarHBondContact O-N 2.78Å; S908-K910 VanDerWaalsContact C-N 3.31Å
909	T	45.3	Very low	58.9	Low	127 Å²	127	111.3 Å²	111.3	78%	0.779	61%	0.607	S	S	*	*	G	3₁₀ helix	trans	-86.6	5.5	167.7	61.9	0	0	0	0	114.4	P906 T907 S911	P906-T909 PolarHBondContact O-OG1 3.42Å; P906-T909 VanDerWaalsContact O-OG1 3.09Å; T907-T909 PolarHBondContact O-N 3.07Å; T909-S911 PolarHBondContact O-N 2.92Å
910	K	53.8	Low	61	Low	118 Å²	118	108.7 Å²	108.7	51%	0.513	59%	0.588	S	S	.	*			trans	-62.4	95.4	173.7	-172.4	172.5	-155.3	-152.6	0	109.9	T907 S908 D914	T907-K910 WeakPolarHBondContact O-CA 3.13Å; T907-K910 WeakPolarHBondContact O-CB 3.37Å; T907-K910 PolarHBondContact O-N 2.68Å; S908-K910 VanDerWaalsContact C-N 3.31Å; K910-D914 HydrophobicContact CD-CB 4.36Å; K910-D914 WeakPolarHBondContact CE-O 3.41Å; K910-D914 WeakPolarHBondContact CE-OD1 3.46Å; K910-D914 WeakPolarHBondContact CE-OD2 3.17Å; K910-D914 HydrophobicContact CG-CB 3.8Å; K910-D914 PolarHBondContact NZ-O 2.7Å; K910-D914 IonicContact NZ-OD1 2.9Å; K910-D914 PolarHBondContact NZ-OD1 2.78Å; K910-D914 IonicContact NZ-OD2 3.02Å
911	S	60.6	Low	63.2	Low	70 Å²	70	105.5 Å²	105.5	49%	0.49	58%	0.576	S	S	.	*			trans	-58.1	154.7	-172.2	79.8	0	0	0	0	112.4	T909 Y913 D914	T909-S911 PolarHBondContact O-N 2.92Å; S911-Y913 PolarHBondContact O-N 3.17Å; S911-D914 PolarHBondContact O-N 2.93Å
912	K	65.1	Low	65.3	Low	114 Å²	114	104.3 Å²	104.3	50%	0.496	56%	0.561	S	S	.	*	T	Hydrogen-bonded Turn	trans	-48.2	-14.1	-177	72.9	178.1	-164.4	67.6	0	117.3	M916 E924	K912-M916 VanDerWaalsContact O-CG 3.26Å; K912-M916 WeakPolarHBondContact O-CG 3.26Å; K912-E924 IonicContact NZ-OE1 2.78Å; K912-E924 PolarHBondContact NZ-OE1 3.47Å; K912-E924 IonicContact NZ-OE2 2.7Å; K912-E924 PolarHBondContact NZ-OE2 2.91Å
913	Y	68.8	Low	67.1	Low	106 Å²	106	103.8 Å²	103.8	42%	0.416	55%	0.551	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.8	-31.2	177.5	-65	-74	0	0	0	112.7	S911 S915 M916 L921 E924	S911-Y913 PolarHBondContact O-N 3.17Å; Y913-S915 PolarHBondContact O-N 2.8Å; Y913-M916 PolarHBondContact O-N 2.65Å; Y913-L921 HydrophobicContact CD1-CD2 3.77Å; Y913-L921 HydrophobicContact CG-CD2 4.35Å; Y913-L921 WeakPolarHBondContact O-CD2 3.18Å; Y913-E924 VanDerWaalsContact CE1-CD 3.47Å; Y913-E924 WeakPolarHBondContact CE1-OE1 3.5Å; Y913-E924 PolarHBondContact OH-OE1 3.23Å
914	D	71.6	Confident	69	Low	99 Å²	99	101.3 Å²	101.3	53%	0.529	54%	0.536	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92	19.6	-172.6	-162.9	-7	0	0	0	111.6	K910 S911	K910-D914 HydrophobicContact CD-CB 4.36Å; K910-D914 WeakPolarHBondContact CE-O 3.41Å; K910-D914 WeakPolarHBondContact CE-OD1 3.46Å; K910-D914 WeakPolarHBondContact CE-OD2 3.17Å; K910-D914 HydrophobicContact CG-CB 3.8Å; K910-D914 PolarHBondContact NZ-O 2.7Å; K910-D914 IonicContact NZ-OD1 2.9Å; K910-D914 PolarHBondContact NZ-OD1 2.78Å; K910-D914 IonicContact NZ-OD2 3.02Å; S911-D914 PolarHBondContact O-N 2.93Å
915	S	77	Confident	71	Confident	103 Å²	103	95.2 Å²	95.2	72%	0.72	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.7	5.9	163.8	67.9	0	0	0	0	112.3	Y913	Y913-S915 PolarHBondContact O-N 2.8Å
916	M	83.4	Confident	72.6	Confident	76 Å²	76	96.9 Å²	96.9	37%	0.374	52%	0.524	S	S	.	.	S	Bend	trans	-90.9	144.4	173.9	-67.8	-109.6	70.1	0	0	109.3	K912 Y913 S920 L921	K912-M916 VanDerWaalsContact O-CG 3.26Å; K912-M916 WeakPolarHBondContact O-CG 3.26Å; Y913-M916 PolarHBondContact O-N 2.65Å; M916-S920 VanDerWaalsContact CE-CB 3.41Å; M916-L921 HydrophobicContact CB-CD2 3.9Å; M916-L921 HydrophobicContact CB-CG 3.77Å; M916-L921 HydrophobicContact CG-CD2 4.49Å
917	D	82.1	Confident	73.9	Confident	94 Å²	94	95.9 Å²	95.9	50%	0.503	52%	0.518	S	S	.	.			trans	-71.5	163.7	169.6	65.7	-8.5	0	0	0	111.4	D919 S920 L921	D917-D919 PolarHBondContact O-N 2.67Å; D917-S920 PolarHBondContact O-N 2.94Å; D917-S920 VanDerWaalsContact O-N 3.17Å; D917-S920 WeakPolarHBondContact OD1-CA 3.32Å; D917-S920 WeakPolarHBondContact OD1-CB 3.43Å; D917-S920 PolarHBondContact OD1-N 2.92Å; D917-S920 PolarHBondContact OD1-OG 2.81Å; D917-L921 WeakPolarHBondContact O-CG 3.36Å; D917-L921 PolarHBondContact O-N 3.33Å
918	F	86.4	Confident	75.2	Confident	160 Å²	160	95.1 Å²	95.1	70%	0.702	52%	0.517	S	S	*	.	H	α-helix	trans	-56.3	-38.8	-176.6	-179.4	-94.5	0	0	0	112.4	L921 L922	F918-L921 PolarHBondContact O-N 2.96Å; F918-L922 HydrophobicContact CE1-CD2 4.37Å; F918-L922 VanDerWaalsContact O-CB 3.3Å; F918-L922 WeakPolarHBondContact O-CB 3.3Å; F918-L922 PolarHBondContact O-N 2.81Å
919	D	88.9	Confident	76.4	Confident	111 Å²	111	97.2 Å²	97.2	59%	0.594	52%	0.519	S	S	*	.	H	α-helix	trans	-71.3	-38.9	179.6	-75.7	-7.8	0	0	0	112.1	D917 K923	D917-D919 PolarHBondContact O-N 2.67Å; D919-K923 WeakPolarHBondContact O-CB 3.16Å; D919-K923 PolarHBondContact O-N 3.39Å
920	S	88.8	Confident	77.2	Confident	40 Å²	40	102.2 Å²	102.2	28%	0.28	52%	0.523	S	S	.	.	H	α-helix	trans	-69.6	-35.9	173.1	-59.4	0	0	0	0	112.6	M916 D917 K923 E924	M916-S920 VanDerWaalsContact CE-CB 3.41Å; D917-S920 PolarHBondContact O-N 2.94Å; D917-S920 VanDerWaalsContact O-N 3.17Å; D917-S920 WeakPolarHBondContact OD1-CA 3.32Å; D917-S920 WeakPolarHBondContact OD1-CB 3.43Å; D917-S920 PolarHBondContact OD1-N 2.92Å; D917-S920 PolarHBondContact OD1-OG 2.81Å; S920-K923 PolarHBondContact O-N 3.38Å; S920-E924 PolarHBondContact O-N 3.31Å
921	L	89.9	Confident	76.9	Confident	62 Å²	62	109.9 Å²	109.9	33%	0.325	55%	0.549	S	S	.	.	H	α-helix	trans	-61	-49	172.1	-77.8	176.3	0	0	0	111.7	Y913 M916 D917 F918 K923 E924 A925	Y913-L921 HydrophobicContact CD1-CD2 3.77Å; Y913-L921 HydrophobicContact CG-CD2 4.35Å; Y913-L921 WeakPolarHBondContact O-CD2 3.18Å; M916-L921 HydrophobicContact CB-CD2 3.9Å; M916-L921 HydrophobicContact CB-CG 3.77Å; M916-L921 HydrophobicContact CG-CD2 4.49Å; D917-L921 WeakPolarHBondContact O-CG 3.36Å; D917-L921 PolarHBondContact O-N 3.33Å; F918-L921 PolarHBondContact O-N 2.96Å; L921-K923 VanDerWaalsContact C-N 3.26Å; L921-K923 PolarHBondContact O-N 3.25Å; L921-E924 PolarHBondContact O-N 2.91Å; L921-A925 WeakPolarHBondContact O-CB 3.5Å; L921-A925 PolarHBondContact O-N 2.59Å
922	L	88.5	Confident	77.7	Confident	76 Å²	76	111.9 Å²	111.9	40%	0.398	55%	0.552	S	S	.	*	H	α-helix	trans	-61	-37.7	176.4	-178.9	59.3	0	0	0	111.2	F918 Q926	F918-L922 HydrophobicContact CE1-CD2 4.37Å; F918-L922 VanDerWaalsContact O-CB 3.3Å; F918-L922 WeakPolarHBondContact O-CB 3.3Å; F918-L922 PolarHBondContact O-N 2.81Å; L922-Q926 WeakPolarHBondContact O-CB 2.97Å; L922-Q926 VanDerWaalsContact O-CG 3.24Å; L922-Q926 WeakPolarHBondContact O-CG 3.39Å; L922-Q926 PolarHBondContact O-N 2.63Å
923	K	84.1	Confident	78.4	Confident	143 Å²	143	111.7 Å²	111.7	62%	0.622	56%	0.555	S	S	*	*	H	α-helix	trans	-71.1	-42.7	177.8	-166.7	174.4	-174.3	177.5	0	112.8	D919 S920 L921 A925 Q926 C927	D919-K923 WeakPolarHBondContact O-CB 3.16Å; D919-K923 PolarHBondContact O-N 3.39Å; S920-K923 PolarHBondContact O-N 3.38Å; L921-K923 VanDerWaalsContact C-N 3.26Å; L921-K923 PolarHBondContact O-N 3.25Å; K923-A925 VanDerWaalsContact C-N 3.34Å; K923-Q926 PolarHBondContact O-N 3.18Å; K923-C927 WeakPolarHBondContact O-CB 3.44Å; K923-C927 PolarHBondContact O-N 3.48Å; K923-C927 PolarHBondContact O-SG 3.14Å; K923-C927 VanDerWaalsContact O-SG 3.34Å
924	E	85.7	Confident	78.9	Confident	63 Å²	63	112.1 Å²	112.1	29%	0.294	56%	0.562	S	S	.	*	H	α-helix	trans	-64.6	-40.2	173.4	-167.5	-179.2	146.2	0	0	110.8	K912 Y913 S920 L921 C927 S928	K912-E924 IonicContact NZ-OE1 2.78Å; K912-E924 PolarHBondContact NZ-OE1 3.47Å; K912-E924 IonicContact NZ-OE2 2.7Å; K912-E924 PolarHBondContact NZ-OE2 2.91Å; Y913-E924 VanDerWaalsContact CE1-CD 3.47Å; Y913-E924 WeakPolarHBondContact CE1-OE1 3.5Å; Y913-E924 PolarHBondContact OH-OE1 3.23Å; S920-E924 PolarHBondContact O-N 3.31Å; L921-E924 PolarHBondContact O-N 2.91Å; E924-C927 CarbonylContact O-C 3.59Å; E924-C927 PolarHBondContact O-N 2.92Å; E924-S928 WeakPolarHBondContact O-CB 3.24Å; E924-S928 PolarHBondContact O-N 2.93Å
925	A	85.2	Confident	79.3	Confident	53 Å²	53	112.8 Å²	112.8	44%	0.438	56%	0.564	S	S	.	*	H	α-helix	trans	-61.4	-43.6	174.2	0	0	0	0	0	112.6	L921 K923 C927 S928 L929	L921-A925 WeakPolarHBondContact O-CB 3.5Å; L921-A925 PolarHBondContact O-N 2.59Å; K923-A925 VanDerWaalsContact C-N 3.34Å; A925-C927 VanDerWaalsContact C-N 3.35Å; A925-C927 PolarHBondContact O-N 2.89Å; A925-S928 PolarHBondContact O-N 3.36Å; A925-S928 PolarHBondContact O-OG 3.5Å; A925-L929 PolarHBondContact O-N 3.34Å; A925-L929 VanDerWaalsContact O-N 3.14Å
926	Q	79.9	Confident	79.5	Confident	119 Å²	119	113.4 Å²	113.4	56%	0.556	56%	0.555	S	S	*	*	H	α-helix	trans	-67	-34.1	175	-73.3	174.8	16.8	0	0	112.7	L922 K923	L922-Q926 WeakPolarHBondContact O-CB 2.97Å; L922-Q926 VanDerWaalsContact O-CG 3.24Å; L922-Q926 WeakPolarHBondContact O-CG 3.39Å; L922-Q926 PolarHBondContact O-N 2.63Å; K923-Q926 PolarHBondContact O-N 3.18Å
927	C	74.6	Confident	79.2	Confident	83 Å²	83	115.9 Å²	115.9	56%	0.561	57%	0.567	S	S	*	*	H	α-helix	trans	-72.1	-32.5	173.4	-74.1	0	0	0	0	113	K923 E924 A925 R930	K923-C927 WeakPolarHBondContact O-CB 3.44Å; K923-C927 PolarHBondContact O-N 3.48Å; K923-C927 PolarHBondContact O-SG 3.14Å; K923-C927 VanDerWaalsContact O-SG 3.34Å; E924-C927 CarbonylContact O-C 3.59Å; E924-C927 PolarHBondContact O-N 2.92Å; A925-C927 VanDerWaalsContact C-N 3.35Å; A925-C927 PolarHBondContact O-N 2.89Å; C927-R930 PolarHBondContact O-N 2.9Å
928	S	73.7	Confident	79	Confident	71 Å²	71	117.5 Å²	117.5	50%	0.497	57%	0.571	S	S	.	*	H	α-helix	trans	-72.4	-33.3	177.7	75.5	0	0	0	0	112.2	E924 A925 R930	E924-S928 WeakPolarHBondContact O-CB 3.24Å; E924-S928 PolarHBondContact O-N 2.93Å; A925-S928 PolarHBondContact O-N 3.36Å; A925-S928 PolarHBondContact O-OG 3.5Å; S928-R930 PolarHBondContact O-N 3.19Å
929	L	72	Confident	78.4	Confident	154 Å²	154	114.2 Å²	114.2	81%	0.806	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.4	-2.4	176.5	-168.2	58.3	0	0	0	114.2	A925	A925-L929 PolarHBondContact O-N 3.34Å; A925-L929 VanDerWaalsContact O-N 3.14Å
930	R	60.9	Low	77.6	Confident	232 Å²	232	114.5 Å²	114.5	88%	0.875	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.5	21.2	-177.8	-104.2	-176.3	177.4	-107.9	2.4	114.1	C927 S928	C927-R930 PolarHBondContact O-N 2.9Å; S928-R930 PolarHBondContact O-N 3.19Å
931	R	47.5	Very low	76.5	Confident	278 Å²	278	121.3 Å²	121.3	100%	1.049	58%	0.584	S	S	*	*			trans	-118.6	0	-178.9	-163	-172.9	-57.8	172	3.8	112.1

Retrieved 931 of 931 residues in 911.2 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).