A0A5K4FFQ4_SCHMA Loading...

DH domain-containing protein AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4FFQ4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 903 aa.

						>A0A5K4FFQ4_SCHMA|A0A5K4FFQ4
MELSPCPSESINEMYFDAIENIQQINTQNIHTTQLSHIDKCEVIKTSFNQKSTSSSSYYTAEEPIDENEKDQAPSTKLFESYSTLDGVQTPFSEDQQSLADFQMSPENQLKLTNFMQTNVFNPITKELDLPIGKLLEIQVKIDEETVWKLMNNSKENIQVNWYQNSTLIEPSSTCEMLKINDRFILRSTTNHLQPDKLYNYTCILRLPENSSMSPAPSITIPVSFHCPTVKELETEFKNCIDKNKVTVENNPVFEVELEEDDAFQLKIPIQNGSQNQDFVVWWTHEDELLTGNHLTSNEREYNCSFELNKQSNEMMTKLSKTSTGTTDSGIYKCWTVSQSLKDNAVQCTNVRVKVRQEEARQSEKLNDKEKEEGEKLQEDKISMIDGVETNHLSKKDVEINKEVPSMKKEEEEDLKKRGSDVMKRKEEIVRLKQDEEETPKKQVEEKGKDREEEEEAEMKRNEEEKAESTRGEKVESKRKEEETVKKEEEVERKRKEEEKAESTRGEKVETKRKEEETVKKEEEVERKRKEEEKAESIQGEKVESKRKEEETVKKEEEVERKRKEEEKAEGTRGEKVESKRKEEETVKKEEEVERKRKEEEKAESTRGEKVESKRKEEETVKKEEEEVERKRKEEEKAEGTRGEKVESKRKEEETVKKEEEVERKRKEEEKAESTRGEKVETKRKEEETVKKEEEEVERKRNEEEKAESTRGEKVESKRKEEETVKKEEEVERKRKEEEKAESTRGEKVETKRKEEETVKKEEEVERKRKEEEKAESTRGEKVESKRKEEETVKKEEEVERKRKEEEKAEGTRGEKVETKRKEEETVKKEEEEVERKRKEEEKAESTRGEKVESKRKEEETVKKEEEEVERKRKEEEKAEGTRGEKVESKRKRRRNCQEGRRS
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	39.6	Very low	44.4	Very low	238 Å²	238	150 Å²	150	100%	1.172	86%	0.858	S	S	*	*				0	171.2	0	-69.2	-177.9	-178.1	0	0	107.3
2	E	46.5	Very low	43.9	Very low	196 Å²	196	149.9 Å²	149.9	92%	0.916	85%	0.853	S	S	*	*			trans	72.1	113.8	-171.1	-55	-179.6	170.8	0	0	112.7
3	L	47.4	Very low	43.4	Very low	171 Å²	171	149.5 Å²	149.5	90%	0.895	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-103	139.2	167.8	-69.1	164.7	0	0	0	106.3
4	S	54.1	Low	43.2	Very low	121 Å²	121	150.7 Å²	150.7	85%	0.846	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-70.7	144.3	172.7	-63.2	0	0	0	0	111
5	P	50.5	Low	42.9	Very low	119 Å²	119	151.8 Å²	151.8	77%	0.773	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-83.8	153	-175.7	-5.9	25	0	0	0	112.7
6	C	40.7	Very low	43.2	Very low	126 Å²	126	154 Å²	154	85%	0.851	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-68.8	134.7	164.5	-55.9	0	0	0	0	110.4
7	P	52.3	Low	42.9	Very low	128 Å²	128	152.1 Å²	152.1	83%	0.831	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-74.6	155.5	164.8	32.1	-32.8	0	0	0	111
8	S	43.7	Very low	42.5	Very low	115 Å²	115	148.2 Å²	148.2	80%	0.804	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-79.7	164.9	-173.4	53.5	0	0	0	0	114.6
9	E	36.2	Very low	42.4	Very low	185 Å²	185	146.9 Å²	146.9	86%	0.864	80%	0.799	S	S	*	*			trans	-39.6	140.4	166.6	-59	159.2	155.5	0	0	113.6
10	S	41.7	Very low	42.1	Very low	107 Å²	107	149.4 Å²	149.4	75%	0.748	80%	0.804	S	S	*	*			trans	-128.9	110.1	161.5	-176	0	0	0	0	108.7	N12	S10-N12 PolarHBondContact O-N 3.09Å
11	I	36.2	Very low	41.9	Very low	144 Å²	144	149.7 Å²	149.7	74%	0.738	81%	0.806	S	S	*	*			trans	-66.9	121.4	175.7	-66.2	166.7	0	0	0	108.7
12	N	37.5	Very low	41.7	Very low	149 Å²	149	145.6 Å²	145.6	80%	0.797	79%	0.787	S	S	*	*			trans	-148.9	66.4	167.4	-101.1	-16.4	0	0	0	108.7	S10 M14	S10-N12 PolarHBondContact O-N 3.09Å; N12-M14 PolarHBondContact O-N 2.92Å; N12-M14 VanDerWaalsContact O-N 3.14Å
13	E	37.3	Very low	41.1	Very low	144 Å²	144	145 Å²	145	67%	0.673	78%	0.784	S	S	*	*			trans	-71.6	100.1	169.3	-67.1	-179.2	124.7	0	0	109	Y15	E13-Y15 HydrophobicContact CB-CD2 4.03Å; E13-Y15 HydrophobicContact CB-CE2 3.96Å; E13-Y15 PolarHBondContact O-N 3.5Å; E13-Y15 VanDerWaalsContact O-N 3.07Å
14	M	40.8	Very low	40.5	Very low	167 Å²	167	145.5 Å²	145.5	82%	0.823	78%	0.782	S	S	*	*			trans	-81.1	89.6	177.1	-145.9	179.5	-57.4	0	0	109.9	N12 F16	N12-M14 PolarHBondContact O-N 2.92Å; N12-M14 VanDerWaalsContact O-N 3.14Å; M14-F16 PolarHBondContact O-N 2.98Å
15	Y	39.1	Very low	39.5	Very low	167 Å²	167	147.1 Å²	147.1	66%	0.655	78%	0.78	S	S	*	*			trans	-67.7	118.2	177.2	-89	-104.6	0	0	0	111.7	E13	E13-Y15 HydrophobicContact CB-CD2 4.03Å; E13-Y15 HydrophobicContact CB-CE2 3.96Å; E13-Y15 PolarHBondContact O-N 3.5Å; E13-Y15 VanDerWaalsContact O-N 3.07Å
16	F	47.6	Very low	38.6	Very low	187 Å²	187	148.7 Å²	148.7	82%	0.82	78%	0.781	S	S	*	*			trans	-111.8	81.5	160.7	-93.7	-82.6	0	0	0	109.6	M14	M14-F16 PolarHBondContact O-N 2.98Å
17	D	37.8	Very low	38.1	Very low	122 Å²	122	149.4 Å²	149.4	65%	0.652	78%	0.782	S	S	*	*			trans	-82.7	115.3	166.9	-81.9	-32.7	0	0	0	109.3
18	A	36.6	Very low	37.1	Very low	82 Å²	82	151.5 Å²	151.5	68%	0.678	78%	0.781	S	S	*	*			trans	-142.5	108.2	170.8	0	0	0	0	0	109.9
19	I	40.6	Very low	36.6	Very low	124 Å²	124	153.8 Å²	153.8	64%	0.636	78%	0.784	S	S	*	*			trans	174.9	94.4	148	-85.6	145	0	0	0	107.5	F254	I19-F254 HydrophobicContact CD1-CE1 3.81Å
20	E	34.9	Very low	36.3	Very low	196 Å²	196	152.8 Å²	152.8	92%	0.916	78%	0.783	S	S	*	*			trans	-122.6	79.4	163.3	-85.6	-158	126.6	0	0	109
21	N	38.6	Very low	36	Very low	156 Å²	156	156.2 Å²	156.2	83%	0.834	79%	0.787	S	S	*	*			trans	-160.6	21	167.6	-133.2	-22.5	0	0	0	117.8
22	I	36.4	Very low	35.6	Very low	151 Å²	151	154.4 Å²	154.4	77%	0.774	78%	0.783	S	S	*	*			trans	-128.8	63.6	178.4	-44.6	-177.5	0	0	0	111.1
23	Q	33.5	Very low	35.6	Very low	184 Å²	184	154.1 Å²	154.1	86%	0.86	79%	0.786	S	S	*	*			trans	-133.8	68.1	167	-72.4	-162.4	10.2	0	0	111.9
24	Q	34.5	Very low	35.4	Very low	182 Å²	182	154.6 Å²	154.6	85%	0.85	79%	0.789	S	S	*	*			trans	-163.9	159.4	160.7	-110.7	145.1	91.9	0	0	110
25	I	32.9	Very low	35	Very low	155 Å²	155	154.3 Å²	154.3	80%	0.795	79%	0.789	S	S	*	*	S	Bend	trans	83.7	139.9	-173.9	-51.7	165.8	0	0	0	113.9
26	N	32.4	Very low	34.6	Very low	151 Å²	151	150.5 Å²	150.5	81%	0.807	79%	0.787	S	S	*	*			trans	65.8	60.9	174.7	-73.9	-9.1	0	0	0	119.4
27	T	29.9	Very low	33.8	Very low	141 Å²	141	149.4 Å²	149.4	87%	0.865	79%	0.785	S	S	*	*			trans	-118.7	33.4	157.7	62.5	0	0	0	0	113.4
28	Q	31.6	Very low	33.8	Very low	172 Å²	172	151.6 Å²	151.6	80%	0.804	80%	0.795	S	S	*	*			trans	-145.2	100.6	173	-70.8	-167.3	-1.5	0	0	112.8
29	N	33.3	Very low	33.8	Very low	164 Å²	164	152.8 Å²	152.8	88%	0.877	79%	0.79	S	S	*	*			trans	179.1	106.7	130.6	-98.1	-36.6	0	0	0	110.8
30	I	30.1	Very low	33.5	Very low	164 Å²	164	155.9 Å²	155.9	84%	0.841	80%	0.798	S	S	*	*			trans	-118.9	98.9	166.6	-59.6	173	0	0	0	106.4
31	H	34.1	Very low	33.6	Very low	178 Å²	178	150.3 Å²	150.3	82%	0.824	78%	0.78	S	S	*	*			trans	-156.5	114.6	159	-126.1	-82.2	0	0	0	114.8
32	T	28	Very low	33.7	Very low	107 Å²	107	149.8 Å²	149.8	66%	0.656	77%	0.773	S	S	*	*			trans	-13.2	128.2	156.5	-45.6	0	0	0	0	118.5
33	T	36.7	Very low	33.9	Very low	142 Å²	142	147 Å²	147	87%	0.871	76%	0.763	S	S	*	*			trans	-149.9	160.4	142.3	-67.3	0	0	0	0	108.5
34	Q	35	Very low	34.3	Very low	155 Å²	155	141.5 Å²	141.5	72%	0.724	74%	0.738	S	S	*	*			trans	-117.6	-176.3	-166.1	-57.4	-175.6	17	0	0	113.9
35	L	31.7	Very low	34.5	Very low	160 Å²	160	141.4 Å²	141.4	84%	0.838	74%	0.735	S	S	*	*			trans	88.5	141.9	161.9	-56.4	152.7	0	0	0	115.5
36	S	31.5	Very low	34.6	Very low	87 Å²	87	137.8 Å²	137.8	61%	0.608	72%	0.72	S	S	*	*			cis	-163.4	169.4	-14.1	49.7	0	0	0	0	111.6
37	H	30.8	Very low	34.5	Very low	165 Å²	165	136.2 Å²	136.2	76%	0.764	72%	0.721	S	S	*	*			trans	64.5	109.3	172.4	-63.8	-71.5	0	0	0	119.1
38	I	37.1	Very low	34.8	Very low	168 Å²	168	139.6 Å²	139.6	86%	0.862	72%	0.724	S	S	*	*				-149	139.2	124.3	-97	150.2	0	0	0	106.3
39	D	36.9	Very low	35	Very low	107 Å²	107	138.1 Å²	138.1	57%	0.572	72%	0.722	S	S	*	*			trans	-93	137.2	-174.7	-113.9	-77.2	0	0	0	112.2
40	K	34.3	Very low	35	Very low	188 Å²	188	138.9 Å²	138.9	82%	0.817	72%	0.72	S	S	*	*			trans	39.9	83.8	153.6	-58.9	175.8	-169.3	91.1	0	117.7
41	C	36	Very low	35.5	Very low	79 Å²	79	141.1 Å²	141.1	53%	0.534	72%	0.723	S	S	.	*			trans	-103.3	126.5	153.3	-71.3	0	0	0	0	109.8
42	E	42.1	Very low	35.6	Very low	146 Å²	146	138.2 Å²	138.2	68%	0.682	72%	0.724	S	S	*	*			trans	-97.9	103.9	-178.4	-171.4	168.7	-142.8	0	0	110.6	I44	E42-I44 PolarHBondContact O-N 2.92Å
43	V	39.1	Very low	36.1	Very low	93 Å²	93	140 Å²	140	56%	0.564	73%	0.734	S	S	*	*			trans	-82.1	106.3	-177.7	-179.7	0	0	0	0	110.2	K45	V43-K45 HydrophobicContact CG1-CG 4.47Å; V43-K45 PolarHBondContact O-N 3.22Å
44	I	43	Very low	36	Very low	67 Å²	67	139.2 Å²	139.2	34%	0.344	74%	0.735	S	S	.	*			trans	-74.8	96.7	-176.5	-54.9	178.4	0	0	0	110.4	E42 T46	E42-I44 PolarHBondContact O-N 2.92Å; I44-T46 HydrophobicContact CG2-CG2 4.29Å; I44-T46 PolarHBondContact O-N 2.94Å
45	K	37.8	Very low	36.3	Very low	181 Å²	181	137.9 Å²	137.9	79%	0.787	74%	0.743	S	S	*	*			trans	-89.1	96.8	170.2	-66.2	-174.5	179.2	-175.8	0	110.6	V43	V43-K45 HydrophobicContact CG1-CG 4.47Å; V43-K45 PolarHBondContact O-N 3.22Å
46	T	36.3	Very low	36.5	Very low	79 Å²	79	135.5 Å²	135.5	49%	0.485	74%	0.739	S	S	.	*			trans	-77.9	136.5	166.5	47.5	0	0	0	0	110.5	I44	I44-T46 HydrophobicContact CG2-CG2 4.29Å; I44-T46 PolarHBondContact O-N 2.94Å
47	S	30.5	Very low	37.2	Very low	117 Å²	117	137 Å²	137	82%	0.818	75%	0.75	S	S	*	*			trans	-133.7	129.7	166.7	53.6	0	0	0	0	108.3
48	F	34.3	Very low	37.6	Very low	212 Å²	212	139 Å²	139	93%	0.93	75%	0.752	S	S	*	*			trans	-141.1	152.2	175.3	-158.1	-101.1	0	0	0	110.6
49	N	35.9	Very low	37.9	Very low	142 Å²	142	142 Å²	142	76%	0.759	75%	0.754	S	S	*	*			trans	-113	132.7	-160.9	-154.3	-31.2	0	0	0	110.7
50	Q	34.4	Very low	38.1	Very low	179 Å²	179	142.2 Å²	142.2	84%	0.836	76%	0.759	S	S	*	*			trans	-68.2	134.5	-174.4	-67.3	-178.8	-9.5	0	0	112
51	K	40.1	Very low	38.7	Very low	211 Å²	211	137.3 Å²	137.3	92%	0.917	75%	0.754	S	S	*	*			trans	-157.8	125.4	160.1	-110.7	159.4	-170.3	174.2	0	110.8
52	S	36.6	Very low	39.3	Very low	118 Å²	118	142.6 Å²	142.6	83%	0.825	77%	0.771	S	S	*	*			trans	-103.5	135.1	-174	-40.9	0	0	0	0	111.5
53	T	38.2	Very low	39.5	Very low	143 Å²	143	144.1 Å²	144.1	88%	0.877	78%	0.778	S	S	*	*			trans	-146.9	118.3	159.3	47	0	0	0	0	110.7
54	S	35.4	Very low	40.4	Very low	127 Å²	127	145.2 Å²	145.2	89%	0.888	79%	0.787	S	S	*	*			trans	-74.7	154.8	167	-49.7	0	0	0	0	111.2
55	S	39.9	Very low	40.6	Very low	127 Å²	127	148.5 Å²	148.5	89%	0.888	80%	0.804	S	S	*	*			trans	-153.2	154.2	159.7	-166.1	0	0	0	0	110.6
56	S	35.9	Very low	41	Very low	109 Å²	109	146.9 Å²	146.9	76%	0.762	80%	0.804	S	S	*	*			trans	-149.4	144.3	-175.9	61.9	0	0	0	0	111
57	S	47.2	Very low	41.6	Very low	119 Å²	119	151.4 Å²	151.4	83%	0.832	82%	0.82	S	S	*	*			trans	-150.2	133.8	169.2	58.6	0	0	0	0	113.4
58	Y	38.6	Very low	42.1	Very low	207 Å²	207	152.7 Å²	152.7	81%	0.812	82%	0.817	S	S	*	*			trans	-61.4	159.3	176.5	-71.6	-115.1	0	0	0	114
59	Y	43.6	Very low	42.4	Very low	230 Å²	230	149.7 Å²	149.7	90%	0.902	81%	0.806	S	S	*	*				-159.2	170.9	117.2	-114.2	-78.4	0	0	0	111.1
60	T	41.7	Very low	42.7	Very low	112 Å²	112	150 Å²	150	69%	0.687	80%	0.801	S	S	*	*			trans	-138.2	172.2	-159.5	51.8	0	0	0	0	114.3
61	A	45.5	Very low	42.9	Very low	86 Å²	86	148.6 Å²	148.6	71%	0.711	80%	0.799	S	S	*	*			trans	105.3	143.4	171.2	0	0	0	0	0	115
62	E	49.3	Very low	42.9	Very low	190 Å²	190	148.2 Å²	148.2	89%	0.888	80%	0.801	S	S	*	*			cis	-161.8	159.4	-7.1	-115.9	161.9	-154	0	0	110.5
63	E	46.8	Very low	43.2	Very low	177 Å²	177	146.9 Å²	146.9	83%	0.827	80%	0.797	S	S	*	*			trans	-127.7	153.4	175.5	-70.3	-172.5	147.5	0	0	112
64	P	57.8	Low	43.3	Very low	117 Å²	117	146.4 Å²	146.4	76%	0.76	80%	0.796	S	S	*	*				-143.1	136.4	119.7	23.1	-2.2	0	0	0	114
65	I	47.4	Very low	43.2	Very low	136 Å²	136	145 Å²	145	70%	0.697	79%	0.787	S	S	*	*				85.7	115.4	71.4	-67.6	164.4	0	0	0	115.3
66	D	44.9	Very low	43	Very low	147 Å²	147	145.5 Å²	145.5	79%	0.786	78%	0.784	S	S	*	*			trans	43	140.1	151.6	-51.2	-18	0	0	0	121.8
67	E	49	Very low	43.2	Very low	174 Å²	174	147 Å²	147	81%	0.813	78%	0.777	S	S	*	*				-160.4	146.5	53.7	-79.6	-168.1	157.4	0	0	116.2
68	N	42	Very low	42.9	Very low	143 Å²	143	148 Å²	148	77%	0.765	77%	0.772	S	S	*	*			trans	53	142.2	138.6	-73.5	-46.2	0	0	0	127.5
69	E	40.6	Very low	42.7	Very low	149 Å²	149	145.9 Å²	145.9	70%	0.696	77%	0.768	S	S	*	*			trans	83.1	113.1	149.8	-68.7	-120.6	107.8	0	0	123.2
70	K	42.2	Very low	42.8	Very low	149 Å²	149	141 Å²	141	65%	0.648	75%	0.753	S	S	*	*			trans	71.9	99.1	145.4	-64	-171.6	178.2	71.7	0	121.6
71	D	38.1	Very low	42.8	Very low	150 Å²	150	140.5 Å²	140.5	80%	0.802	75%	0.754	S	S	*	*				53.1	84.3	126.5	-51.5	-20.8	0	0	0	120.6
72	Q	40.5	Very low	42.4	Very low	202 Å²	202	146.2 Å²	146.2	94%	0.944	76%	0.759	S	S	*	*			trans	-159	160.4	132.6	-113.4	163	35.4	0	0	113.4
73	A	42.1	Very low	42.1	Very low	90 Å²	90	142.4 Å²	142.4	74%	0.744	75%	0.753	S	S	*	*			trans	-80.6	165.1	-170.5	0	0	0	0	0	112.6
74	P	40.3	Very low	42.2	Very low	133 Å²	133	138 Å²	138	86%	0.864	74%	0.738	S	S	*	*				-131.6	154.7	61.8	37.5	-23.9	0	0	0	115.8
75	S	34	Very low	41.8	Very low	99 Å²	99	141.1 Å²	141.1	69%	0.692	75%	0.748	S	S	*	*			trans	-119.6	141.8	166.3	172.5	0	0	0	0	109.6
76	T	36.3	Very low	41.9	Very low	136 Å²	136	140.6 Å²	140.6	83%	0.834	75%	0.747	S	S	*	*			trans	-133.8	64.7	163.6	55.8	0	0	0	0	110.7
77	K	39.8	Very low	42	Very low	142 Å²	142	137.9 Å²	137.9	62%	0.617	75%	0.753	S	S	*	*			trans	-73	123.9	151.5	-93.7	-170.1	157.5	-157.6	0	108.9	E80	K77-E80 WeakPolarHBondContact CD-OE2 3.48Å; K77-E80 WeakPolarHBondContact CE-OE2 3.43Å; K77-E80 IonicContact NZ-OE1 2.61Å; K77-E80 PolarHBondContact NZ-OE1 2.89Å; K77-E80 IonicContact NZ-OE2 3.53Å; K77-E80 PolarHBondContact NZ-OE2 3.34Å
78	L	40.7	Very low	41.9	Very low	138 Å²	138	134.2 Å²	134.2	72%	0.723	74%	0.742	S	S	*	*			trans	-142.5	129.4	163.7	-75.4	166.2	0	0	0	105.1
79	F	35	Very low	42	Very low	164 Å²	164	136.4 Å²	136.4	72%	0.719	75%	0.748	S	S	*	*	S	Bend	cis	-128.8	112.5	13.8	-141.2	-105.9	0	0	0	109.6
80	E	46	Very low	42.8	Very low	126 Å²	126	134.4 Å²	134.4	59%	0.589	75%	0.746	S	S	*	*	S	Bend	trans	-131.5	126.7	172.8	-82.5	175.9	159.5	0	0	109.1	K77	K77-E80 WeakPolarHBondContact CD-OE2 3.48Å; K77-E80 WeakPolarHBondContact CE-OE2 3.43Å; K77-E80 IonicContact NZ-OE1 2.61Å; K77-E80 PolarHBondContact NZ-OE1 2.89Å; K77-E80 IonicContact NZ-OE2 3.53Å; K77-E80 PolarHBondContact NZ-OE2 3.34Å
81	S	39.9	Very low	43.5	Very low	103 Å²	103	133 Å²	133	72%	0.72	75%	0.752	S	S	*	*			trans	26.7	94.2	161.6	59.8	0	0	0	0	118.5	S83	S81-S83 PolarHBondContact O-N 3.47Å; S81-S83 VanDerWaalsContact O-N 3.11Å
82	Y	38.5	Very low	44.1	Very low	205 Å²	205	132 Å²	132	80%	0.804	74%	0.741	S	S	*	*			trans	-75.8	89.2	153.6	-85.3	-81.2	0	0	0	110	T84	Y82-T84 PolarHBondContact O-N 3.43Å
83	S	43.2	Very low	44.9	Very low	110 Å²	110	125 Å²	125	77%	0.769	71%	0.714	S	S	*	*			trans	-74.1	101.3	161.4	-61.8	0	0	0	0	108.9	S81	S81-S83 PolarHBondContact O-N 3.47Å; S81-S83 VanDerWaalsContact O-N 3.11Å
84	T	48.5	Very low	45.9	Very low	85 Å²	85	128.8 Å²	128.8	52%	0.521	72%	0.717	S	S	.	*			trans	-62.4	139.6	166.2	48.7	0	0	0	0	109.6	Y82 D86	Y82-T84 PolarHBondContact O-N 3.43Å; T84-D86 CarbonylContact C-O 3.56Å; T84-D86 WeakPolarHBondContact CB-O 3.46Å; T84-D86 PolarHBondContact O-N 3.16Å; T84-D86 PolarHBondContact OG1-O 2.9Å
85	L	49.5	Very low	47.2	Very low	182 Å²	182	128.9 Å²	128.9	95%	0.953	71%	0.71	S	S	*	*	S	Bend	trans	-73.1	-17.4	-175.9	-167.4	59.6	0	0	0	112.8
86	D	49.5	Very low	48.5	Very low	126 Å²	126	129.2 Å²	129.2	67%	0.674	70%	0.7	S	S	*	*	S	Bend	trans	-93.3	136.8	158.5	-67	-64	0	0	0	109.7	T84 V88	T84-D86 CarbonylContact C-O 3.56Å; T84-D86 WeakPolarHBondContact CB-O 3.46Å; T84-D86 PolarHBondContact O-N 3.16Å; T84-D86 PolarHBondContact OG1-O 2.9Å; D86-V88 HydrophobicContact CB-CG2 4.29Å; D86-V88 PolarHBondContact O-N 3Å
87	G	46	Very low	49.8	Very low	90 Å²	90	127.9 Å²	127.9	93%	0.928	68%	0.684	S	S	*	*			trans	-72.5	38.9	-176.4	0	0	0	0	0	115.5	Q89	G87-Q89 PolarHBondContact O-N 2.96Å
88	V	47.9	Very low	51	Low	96 Å²	96	124.7 Å²	124.7	58%	0.582	68%	0.68	S	S	*	*			trans	-89.6	95.7	179.6	-176.6	0	0	0	0	109.1	D86 T90	D86-V88 HydrophobicContact CB-CG2 4.29Å; D86-V88 PolarHBondContact O-N 3Å; V88-T90 VanDerWaalsContact C-N 3.3Å; V88-T90 HydrophobicContact CG1-CG2 4.16Å; V88-T90 PolarHBondContact O-N 3.07Å
89	Q	44.2	Very low	51.9	Low	190 Å²	190	123.4 Å²	123.4	89%	0.888	67%	0.673	S	S	*	*			trans	-70.4	86	172.2	-172.9	174.5	2.1	0	0	109.8	G87	G87-Q89 PolarHBondContact O-N 2.96Å
90	T	56.2	Low	53.1	Low	107 Å²	107	117.7 Å²	117.7	66%	0.656	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-65.7	127.3	173.8	52.7	0	0	0	0	109.6	V88	V88-T90 VanDerWaalsContact C-N 3.3Å; V88-T90 HydrophobicContact CG1-CG2 4.16Å; V88-T90 PolarHBondContact O-N 3.07Å
91	P	57.9	Low	53.6	Low	118 Å²	118	116.6 Å²	116.6	77%	0.766	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-60.6	150.7	169.1	27.7	-33.9	0	0	0	109.8	S93	P91-S93 PolarHBondContact O-N 3.3Å
92	F	49.3	Very low	54.3	Low	130 Å²	130	118.6 Å²	118.6	57%	0.57	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-56.5	134.1	171.8	-115	-114.7	0	0	0	109.2	Q96	F92-Q96 HydrophobicContact CD1-CB 3.7Å; F92-Q96 HydrophobicContact CE1-CB 3.84Å
93	S	59	Low	55.1	Low	54 Å²	54	115.3 Å²	115.3	38%	0.378	64%	0.643	S	S	.	*	P	Polyproline II helix	trans	-65.6	135.5	172.9	52.8	0	0	0	0	109.6	P91 D95 Q96 Q97	P91-S93 PolarHBondContact O-N 3.3Å; S93-D95 PolarHBondContact O-N 3.06Å; S93-D95 VanDerWaalsContact O-N 3.09Å; S93-Q96 WeakPolarHBondContact O-CB 3.46Å; S93-Q96 PolarHBondContact O-N 3.44Å; S93-Q96 WeakPolarHBondContact OG-CG 3.48Å; S93-Q97 PolarHBondContact O-N 2.97Å
94	E	63.2	Low	55.6	Low	171 Å²	171	116.3 Å²	116.3	80%	0.799	64%	0.637	S	S	*	*	H	α-helix	trans	-49.5	-39.2	-176.2	-158.9	168.7	171.2	0	0	112.7	Q96 Q97 S98	E94-Q96 VanDerWaalsContact C-N 3.34Å; E94-Q96 PolarHBondContact O-N 2.76Å; E94-Q97 PolarHBondContact O-N 3.36Å; E94-S98 WeakPolarHBondContact O-CB 3.42Å; E94-S98 PolarHBondContact O-N 2.97Å
95	D	67.3	Low	55.8	Low	134 Å²	134	114.1 Å²	114.1	72%	0.717	63%	0.625	S	S	*	*	H	α-helix	trans	-57	-37.9	173.9	-61.2	-26	0	0	0	114.4	S93 L99	S93-D95 PolarHBondContact O-N 3.06Å; S93-D95 VanDerWaalsContact O-N 3.09Å; D95-L99 WeakPolarHBondContact O-CB 3.44Å; D95-L99 PolarHBondContact O-N 3.27Å; D95-L99 VanDerWaalsContact O-N 3.11Å
96	Q	61.2	Low	56.2	Low	107 Å²	107	108.7 Å²	108.7	50%	0.5	60%	0.601	S	S	.	*	H	α-helix	trans	-79.2	-32.1	179.7	-70.2	-176.8	24.3	0	0	111.7	F92 S93 E94 L99 A100	F92-Q96 HydrophobicContact CD1-CB 3.7Å; F92-Q96 HydrophobicContact CE1-CB 3.84Å; S93-Q96 WeakPolarHBondContact O-CB 3.46Å; S93-Q96 PolarHBondContact O-N 3.44Å; S93-Q96 WeakPolarHBondContact OG-CG 3.48Å; E94-Q96 VanDerWaalsContact C-N 3.34Å; E94-Q96 PolarHBondContact O-N 2.76Å; Q96-L99 PolarHBondContact O-N 3.32Å; Q96-A100 PolarHBondContact O-N 3.01Å; Q96-A100 VanDerWaalsContact O-N 3.1Å
97	Q	63.6	Low	56.6	Low	107 Å²	107	108.7 Å²	108.7	50%	0.5	60%	0.596	S	S	.	*	H	α-helix	trans	-69.7	-47.2	174.7	-159.6	153	8.2	0	0	109.7	S93 E94 L99 A100 D101	S93-Q97 PolarHBondContact O-N 2.97Å; E94-Q97 PolarHBondContact O-N 3.36Å; Q97-L99 VanDerWaalsContact C-N 3.26Å; Q97-L99 PolarHBondContact O-N 2.84Å; Q97-A100 WeakPolarHBondContact O-CB 3.45Å; Q97-A100 PolarHBondContact O-N 3.49Å; Q97-A100 VanDerWaalsContact O-N 3.08Å; Q97-D101 VanDerWaalsContact O-CG 3.23Å; Q97-D101 PolarHBondContact O-N 2.83Å
98	S	64.5	Low	57	Low	76 Å²	76	105.3 Å²	105.3	53%	0.531	56%	0.557	S	S	.	*	H	α-helix	trans	-49.9	-42.7	168.4	175	0	0	0	0	113.3	E94 F102	E94-S98 WeakPolarHBondContact O-CB 3.42Å; E94-S98 PolarHBondContact O-N 2.97Å; S98-F102 VanDerWaalsContact O-CB 3.23Å; S98-F102 WeakPolarHBondContact O-CB 3.41Å; S98-F102 PolarHBondContact O-N 2.85Å
99	L	60.2	Low	57.3	Low	110 Å²	110	103.3 Å²	103.3	58%	0.576	54%	0.541	S	S	*	.	H	α-helix	trans	-73.7	-31.5	-178.8	-160	140.2	0	0	0	112.9	D95 Q96 Q97 Q103	D95-L99 WeakPolarHBondContact O-CB 3.44Å; D95-L99 PolarHBondContact O-N 3.27Å; D95-L99 VanDerWaalsContact O-N 3.11Å; Q96-L99 PolarHBondContact O-N 3.32Å; Q97-L99 VanDerWaalsContact C-N 3.26Å; Q97-L99 PolarHBondContact O-N 2.84Å; L99-Q103 WeakPolarHBondContact O-CG 3.38Å; L99-Q103 PolarHBondContact O-N 2.82Å
100	A	58.5	Low	57.7	Low	44 Å²	44	95.9 Å²	95.9	36%	0.364	51%	0.508	S	S	.	.	H	α-helix	trans	-69.9	-48.6	170.2	0	0	0	0	0	111.4	Q96 Q97 F102 Q103 M104	Q96-A100 PolarHBondContact O-N 3.01Å; Q96-A100 VanDerWaalsContact O-N 3.1Å; Q97-A100 WeakPolarHBondContact O-CB 3.45Å; Q97-A100 PolarHBondContact O-N 3.49Å; Q97-A100 VanDerWaalsContact O-N 3.08Å; A100-F102 VanDerWaalsContact C-N 3.27Å; A100-F102 PolarHBondContact O-N 3.13Å; A100-Q103 PolarHBondContact O-N 3Å; A100-M104 WeakPolarHBondContact O-CG 3.43Å; A100-M104 PolarHBondContact O-N 3.3Å
101	D	57.1	Low	57.5	Low	104 Å²	104	95.9 Å²	95.9	56%	0.556	50%	0.499	S	S	*	.	H	α-helix	trans	-60.2	-38.1	178.6	-63.7	-30.4	0	0	0	111.4	Q97 Q103 M104 S105	Q97-D101 VanDerWaalsContact O-CG 3.23Å; Q97-D101 PolarHBondContact O-N 2.83Å; D101-Q103 PolarHBondContact O-N 2.94Å; D101-M104 PolarHBondContact O-N 3.31Å; D101-S105 PolarHBondContact O-N 3.04Å
102	F	55.8	Low	56.8	Low	144 Å²	144	96.5 Å²	96.5	63%	0.632	50%	0.495	S	S	*	.	H	α-helix	trans	-65.3	-34.7	173.8	-171.4	-94.8	0	0	0	113	S98 A100 N108	S98-F102 VanDerWaalsContact O-CB 3.23Å; S98-F102 WeakPolarHBondContact O-CB 3.41Å; S98-F102 PolarHBondContact O-N 2.85Å; A100-F102 VanDerWaalsContact C-N 3.27Å; A100-F102 PolarHBondContact O-N 3.13Å; F102-N108 WeakPolarHBondContact CE1-ND2 3.48Å; F102-N108 WeakPolarHBondContact CZ-ND2 3.16Å; F102-N108 PolarHBondContact O-ND2 3Å
103	Q	53.8	Low	56.7	Low	137 Å²	137	93.2 Å²	93.2	64%	0.64	49%	0.486	S	S	*	.	H	α-helix	trans	-75.4	-32.4	173.6	-74.9	-174.3	-12	0	0	112.7	L99 A100 D101	L99-Q103 WeakPolarHBondContact O-CG 3.38Å; L99-Q103 PolarHBondContact O-N 2.82Å; A100-Q103 PolarHBondContact O-N 3Å; D101-Q103 PolarHBondContact O-N 2.94Å
104	M	54.4	Low	56.3	Low	131 Å²	131	92.9 Å²	92.9	65%	0.645	48%	0.48	S	S	*	.	H	α-helix	trans	-81.1	-18.4	-178.6	-67.3	-58.7	-66	0	0	114	A100 D101 Q109	A100-M104 WeakPolarHBondContact O-CG 3.43Å; A100-M104 PolarHBondContact O-N 3.3Å; D101-M104 PolarHBondContact O-N 3.31Å; M104-Q109 PolarHBondContact O-NE2 3.49Å
105	S	53.4	Low	55.2	Low	39 Å²	39	93.4 Å²	93.4	27%	0.273	48%	0.48	S	S	.	.			trans	-48.2	126.6	176.6	177.8	0	0	0	0	112.9	D101 E107 N108 Q109	D101-S105 PolarHBondContact O-N 3.04Å; S105-E107 PolarHBondContact O-N 3.09Å; S105-N108 PolarHBondContact O-N 3.36Å; S105-Q109 PolarHBondContact O-N 3.17Å
106	P	56.6	Low	54	Low	68 Å²	68	95.2 Å²	95.2	44%	0.442	49%	0.486	S	S	.	.	H	α-helix	trans	-56.2	-34.6	-178.2	-28.5	35.7	0	0	0	114.2	N108 Q109 L110 L128	P106-N108 VanDerWaalsContact C-N 3.29Å; P106-N108 PolarHBondContact O-N 2.9Å; P106-Q109 PolarHBondContact O-N 3.38Å; P106-L110 PolarHBondContact O-N 3.05Å; P106-L128 HydrophobicContact CB-CD1 3.71Å
107	E	58.4	Low	53.6	Low	125 Å²	125	93 Å²	93	58%	0.584	48%	0.475	S	S	*	.	H	α-helix	trans	-63.2	-37.2	174.9	-62	-167	177.8	0	0	112.6	S105 K111	S105-E107 PolarHBondContact O-N 3.09Å; E107-K111 WeakPolarHBondContact O-CD 3.28Å; E107-K111 VanDerWaalsContact O-CE 3.27Å; E107-K111 WeakPolarHBondContact O-CE 3.4Å; E107-K111 WeakPolarHBondContact O-CG 3.48Å; E107-K111 PolarHBondContact O-N 3.38Å; E107-K111 IonicContact OE2-NZ 2.64Å; E107-K111 PolarHBondContact OE2-NZ 2.99Å
108	N	55.4	Low	53.1	Low	19 Å²	19	92.2 Å²	92.2	10%	0.102	48%	0.478	C	S	.	.	H	α-helix	trans	-79	-32	-178.8	-70.2	-13	0	0	0	110.7	F102 S105 P106 K111 L112	F102-N108 WeakPolarHBondContact CE1-ND2 3.48Å; F102-N108 WeakPolarHBondContact CZ-ND2 3.16Å; F102-N108 PolarHBondContact O-ND2 3Å; S105-N108 PolarHBondContact O-N 3.36Å; P106-N108 VanDerWaalsContact C-N 3.29Å; P106-N108 PolarHBondContact O-N 2.9Å; N108-K111 PolarHBondContact O-N 2.94Å; N108-K111 WeakPolarHBondContact OD1-CD 3.41Å; N108-K111 PolarHBondContact OD1-NZ 2.8Å; N108-L112 WeakPolarHBondContact O-CD1 3.39Å; N108-L112 PolarHBondContact O-N 3.47Å
109	Q	52.3	Low	53.3	Low	54 Å²	54	94 Å²	94	25%	0.252	48%	0.481	S	S	.	.	H	α-helix	trans	-57.6	-47.7	166.6	-63.2	-171.9	45	0	0	111.4	M104 S105 P106 K111 L112 T113 P222	M104-Q109 PolarHBondContact O-NE2 3.49Å; S105-Q109 PolarHBondContact O-N 3.17Å; P106-Q109 PolarHBondContact O-N 3.38Å; Q109-K111 VanDerWaalsContact C-N 3.33Å; Q109-K111 PolarHBondContact O-N 3.09Å; Q109-L112 PolarHBondContact O-N 3.21Å; Q109-T113 WeakPolarHBondContact O-CG2 3.48Å; Q109-T113 PolarHBondContact O-N 2.66Å; Q109-T113 PolarHBondContact O-OG1 3.15Å; Q109-P222 HydrophobicContact CB-CG 4.49Å
110	L	54	Low	54.4	Low	34 Å²	34	88.7 Å²	88.7	18%	0.178	45%	0.454	C	S	.	.	H	α-helix	trans	-61.5	-36.7	174.4	-74.9	-179.3	0	0	0	113.4	P106 T113 N114 L128 I221	P106-L110 PolarHBondContact O-N 3.05Å; L110-T113 PolarHBondContact O-OG1 3.3Å; L110-N114 PolarHBondContact O-N 2.69Å; L110-L128 HydrophobicContact CD1-CD1 3.75Å; L110-L128 HydrophobicContact CD1-CD2 4.37Å; L110-L128 HydrophobicContact CG-CD1 4.35Å; L110-I221 HydrophobicContact CD2-CG1 4.23Å
111	K	51.9	Low	55.7	Low	107 Å²	107	86.8 Å²	86.8	47%	0.465	44%	0.438	S	S	.	.	H	α-helix	trans	-69.1	-34.4	176	-67.9	159.3	-151.7	159.8	0	111.9	E107 N108 Q109	E107-K111 WeakPolarHBondContact O-CD 3.28Å; E107-K111 VanDerWaalsContact O-CE 3.27Å; E107-K111 WeakPolarHBondContact O-CE 3.4Å; E107-K111 WeakPolarHBondContact O-CG 3.48Å; E107-K111 PolarHBondContact O-N 3.38Å; E107-K111 IonicContact OE2-NZ 2.64Å; E107-K111 PolarHBondContact OE2-NZ 2.99Å; N108-K111 PolarHBondContact O-N 2.94Å; N108-K111 WeakPolarHBondContact OD1-CD 3.41Å; N108-K111 PolarHBondContact OD1-NZ 2.8Å; Q109-K111 VanDerWaalsContact C-N 3.33Å; Q109-K111 PolarHBondContact O-N 3.09Å
112	L	41.9	Very low	57	Low	131 Å²	131	85.1 Å²	85.1	69%	0.686	43%	0.428	S	S	*	.	H	α-helix	trans	-75.4	-42.3	176.7	-94.3	76.5	0	0	0	112.7	N108 Q109 N114 F115	N108-L112 WeakPolarHBondContact O-CD1 3.39Å; N108-L112 PolarHBondContact O-N 3.47Å; Q109-L112 PolarHBondContact O-N 3.21Å; L112-N114 VanDerWaalsContact C-N 3.3Å; L112-N114 PolarHBondContact O-N 2.94Å; L112-F115 WeakPolarHBondContact O-CB 3.36Å; L112-F115 PolarHBondContact O-N 2.82Å; L112-F115 VanDerWaalsContact O-N 3.12Å
113	T	48.7	Very low	58.4	Low	62 Å²	62	80.4 Å²	80.4	38%	0.38	41%	0.412	S	S	.	.	H	α-helix	trans	-64.9	-34.9	179.8	55	0	0	0	0	112.1	Q109 L110 F115	Q109-T113 WeakPolarHBondContact O-CG2 3.48Å; Q109-T113 PolarHBondContact O-N 2.66Å; Q109-T113 PolarHBondContact O-OG1 3.15Å; L110-T113 PolarHBondContact O-OG1 3.3Å; T113-F115 PolarHBondContact O-N 3Å
114	N	50.4	Low	59.9	Low	47 Å²	47	76.6 Å²	76.6	25%	0.251	40%	0.396	S	S	.	.	G	3₁₀ helix	trans	-74.8	-7.1	176.2	-128.3	15.8	0	0	0	114	L110 L112	L110-N114 PolarHBondContact O-N 2.69Å; L112-N114 VanDerWaalsContact C-N 3.3Å; L112-N114 PolarHBondContact O-N 2.94Å
115	F	39.8	Very low	61.1	Low	182 Å²	182	71.4 Å²	71.4	80%	0.798	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-84.8	-8.3	-171.9	-143.6	-91.4	0	0	0	114.7	L112 T113	L112-F115 WeakPolarHBondContact O-CB 3.36Å; L112-F115 PolarHBondContact O-N 2.82Å; L112-F115 VanDerWaalsContact O-N 3.12Å; T113-F115 PolarHBondContact O-N 3Å
116	M	41.1	Very low	61.9	Low	172 Å²	172	79 Å²	79	85%	0.847	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-106.8	-3.3	-173	-78	-68.1	-167.3	0	0	115
117	Q	53.3	Low	62.6	Low	59 Å²	59	80 Å²	80	28%	0.276	40%	0.399	S	S	.	.	S	Bend	trans	-138.1	154.6	179.8	-62.9	-176.2	1.3	0	0	109.8	P217 S218	Q117-P217 VanDerWaalsContact OE1-CA 3.24Å; Q117-S218 PolarHBondContact NE2-OG 3.35Å; Q117-S218 VanDerWaalsContact NE2-OG 3.15Å; Q117-S218 PolarHBondContact OE1-O 3.09Å
118	T	53.6	Low	63.7	Low	91 Å²	91	75.2 Å²	75.2	56%	0.558	38%	0.377	S	S	*	.			trans	-57.9	146.1	174.4	46.6	0	0	0	0	110.4	V120	T118-V120 PolarHBondContact O-N 3.41Å
119	N	69.7	Low	65.1	Low	113 Å²	113	77.8 Å²	77.8	60%	0.604	39%	0.391	S	S	*	.	S	Bend	trans	-65.8	53.8	-172.1	-61.7	7.4	0	0	0	115.1
120	V	82	Confident	66.7	Low	0 Å²	0	75.6 Å²	75.6	0%	0	38%	0.381	C	S	.	.			trans	-72.9	-38.9	178.3	168.2	0	0	0	0	110.7	T118 I142 D143 V147 L150 P217	T118-V120 PolarHBondContact O-N 3.41Å; V120-I142 HydrophobicContact CG1-CG2 4.24Å; V120-I142 CarbonylContact O-C 3.45Å; V120-I142 WeakPolarHBondContact O-CA 3.22Å; V120-D143 PolarHBondContact O-N 3.3Å; V120-V147 HydrophobicContact CG1-CG2 3.58Å; V120-L150 HydrophobicContact CG2-CD1 3.6Å; V120-P217 HydrophobicContact CG1-CB 4.34Å
121	F	85.1	Confident	68.3	Low	4 Å²	4	74.1 Å²	74.1	2%	0.018	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	135.8	-179.2	-61.6	-81.1	0	0	0	111.6	V140 I142 L205 P217 I219	F121-V140 HydrophobicContact CB-CG1 3.99Å; F121-V140 HydrophobicContact CD1-CG1 3.61Å; F121-V140 HydrophobicContact CG-CG1 4.26Å; F121-I142 HydrophobicContact CD1-CD1 3.98Å; F121-I142 HydrophobicContact CD1-CG1 3.77Å; F121-I142 HydrophobicContact CE1-CD1 3.55Å; F121-I142 HydrophobicContact CE1-CG1 3.89Å; F121-I142 HydrophobicContact CZ-CD1 4.46Å; F121-L205 HydrophobicContact CZ-CB 3.98Å; F121-P217 VanDerWaalsContact CE2-C 3.49Å; F121-P217 HydrophobicContact CE2-CB 3.73Å; F121-I219 HydrophobicContact CB-CB 3.82Å; F121-I219 HydrophobicContact CB-CD1 3.91Å; F121-I219 HydrophobicContact CB-CG1 4.46Å; F121-I219 HydrophobicContact CB-CG2 3.71Å; F121-I219 HydrophobicContact CD1-CG2 3.71Å; F121-I219 HydrophobicContact CD2-CB 4.02Å; F121-I219 HydrophobicContact CD2-CG2 4.03Å; F121-I219 HydrophobicContact CE1-CG2 4.25Å; F121-I219 HydrophobicContact CG-CB 3.9Å; F121-I219 HydrophobicContact CG-CG2 3.55Å
122	N	86.3	Confident	69.9	Low	68 Å²	68	69 Å²	69	36%	0.364	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	101.7	175.8	-64	-91.4	0	0	0	107.2	K141	N122-K141 HydrophobicContact CB-CB 4.23Å; N122-K141 PolarHBondContact N-O 3.15Å; N122-K141 PolarHBondContact O-N 3.04Å
123	P	84.9	Confident	71.8	Confident	46 Å²	46	62.9 Å²	62.9	30%	0.299	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	135.1	-179.2	28.4	-33.1	0	0	0	110.1	I219 I221	P123-I219 HydrophobicContact CB-CD1 4.02Å; P123-I219 HydrophobicContact CG-CD1 3.87Å; P123-I221 HydrophobicContact CB-CD1 4.06Å
124	I	84.7	Confident	73.5	Confident	56 Å²	56	61.9 Å²	61.9	29%	0.287	31%	0.309	S	S	.	.			trans	-100.8	-36.4	178.3	-68.9	161.8	0	0	0	110.9	K126 Q139 K141 R183	I124-K126 PolarHBondContact O-N 3.34Å; I124-Q139 HydrophobicContact CB-CB 3.78Å; I124-Q139 HydrophobicContact CD1-CB 4.3Å; I124-Q139 HydrophobicContact CG2-CB 4.06Å; I124-Q139 PolarHBondContact N-O 2.72Å; I124-K141 HydrophobicContact CD1-CB 3.81Å; I124-K141 HydrophobicContact CG1-CB 4.28Å; I124-R183 HydrophobicContact CD1-CG 3.93Å
125	T	80.7	Confident	75.2	Confident	23 Å²	23	61.5 Å²	61.5	14%	0.141	31%	0.307	C	S	.	.			trans	-62.4	119.7	179.5	-64.3	0	0	0	0	110.6	E127 E137 I138 Q139	T125-E127 WeakPolarHBondContact CG2-O 3.19Å; T125-E137 PolarHBondContact OG1-O 2.99Å; T125-I138 WeakPolarHBondContact OG1-CA 3.14Å; T125-Q139 PolarHBondContact N-O 3.28Å; T125-Q139 PolarHBondContact OG1-N 2.89Å
126	K	69.6	Low	77.5	Confident	199 Å²	199	52.9 Å²	52.9	87%	0.865	27%	0.269	S	S	*	.			trans	-95.1	-25.6	176.4	-59.4	-176.7	180	-177.2	0	113	I124 L128	I124-K126 PolarHBondContact O-N 3.34Å; K126-L128 PolarHBondContact O-N 3.05Å
127	E	71	Confident	79.8	Confident	89 Å²	89	47.4 Å²	47.4	42%	0.416	24%	0.242	S	C	.	.			trans	-86.2	100.6	-176.6	-164.7	173.4	-176.1	0	0	108.5	T125 L130 K134	T125-E127 WeakPolarHBondContact CG2-O 3.19Å; E127-L130 VanDerWaalsContact CD-CD2 3.43Å; E127-L130 HydrophobicContact CG-CD2 3.69Å; E127-L130 HydrophobicContact CG-CG 4.27Å; E127-L130 WeakPolarHBondContact OE1-CD2 3.42Å; E127-K134 IonicContact OE1-NZ 3.68Å; E127-K134 PolarHBondContact OE1-NZ 3.44Å; E127-K134 IonicContact OE2-NZ 2.72Å
128	L	80.7	Confident	81.6	Confident	23 Å²	23	44.6 Å²	44.6	12%	0.12	23%	0.229	C	C	.	.			trans	-101.7	-4.7	-177.3	-56.4	177.1	0	0	0	112.7	P106 L110 K126 I221 V223 S224	P106-L128 HydrophobicContact CB-CD1 3.71Å; L110-L128 HydrophobicContact CD1-CD1 3.75Å; L110-L128 HydrophobicContact CD1-CD2 4.37Å; L110-L128 HydrophobicContact CG-CD1 4.35Å; K126-L128 PolarHBondContact O-N 3.05Å; L128-I221 HydrophobicContact CD2-CG2 3.74Å; L128-V223 CarbonylContact O-C 3.59Å; L128-V223 VanDerWaalsContact O-CA 3.27Å; L128-V223 WeakPolarHBondContact O-CA 3.44Å; L128-S224 PolarHBondContact O-N 3.24Å; L128-S224 PolarHBondContact O-OG 2.73Å
129	D	85.8	Confident	83.4	Confident	74 Å²	74	41.9 Å²	41.9	40%	0.396	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	123.9	177.9	-171.3	36.5	0	0	0	108.4	S224 H226	D129-S224 WeakPolarHBondContact CA-O 3.23Å; D129-S224 WeakPolarHBondContact CB-OG 3.14Å; D129-S224 WeakPolarHBondContact OD1-CB 3.18Å; D129-S224 PolarHBondContact OD1-OG 2.59Å; D129-H226 IonicContact OD1-CE1 2.8Å; D129-H226 IonicContact OD1-ND1 2.67Å; D129-H226 PolarHBondContact OD1-ND1 3.45Å; D129-H226 VanDerWaalsContact OD1-ND1 3.07Å; D129-H226 IonicContact OD2-CE1 2.63Å; D129-H226 PolarHBondContact OD2-CE1 2.75Å; D129-H226 IonicContact OD2-ND1 2.57Å; D129-H226 PolarHBondContact OD2-ND1 2.92Å
130	L	85.8	Confident	84.4	Confident	8 Å²	8	36.5 Å²	36.5	4%	0.042	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	133.4	-164.4	-75.1	165.2	0	0	0	112.5	E127 I132 K134 L136 V223 S224 F225 H226	E127-L130 VanDerWaalsContact CD-CD2 3.43Å; E127-L130 HydrophobicContact CG-CD2 3.69Å; E127-L130 HydrophobicContact CG-CG 4.27Å; E127-L130 WeakPolarHBondContact OE1-CD2 3.42Å; L130-I132 PolarHBondContact O-N 2.97Å; L130-K134 HydrophobicContact CD2-CD 3.77Å; L130-K134 HydrophobicContact CD2-CG 4.37Å; L130-L136 HydrophobicContact CD1-CD1 3.49Å; L130-L136 VanDerWaalsContact CD1-CD1 3.49Å; L130-V223 HydrophobicContact CD1-CG1 4.09Å; L130-S224 PolarHBondContact N-O 2.76Å; L130-S224 VanDerWaalsContact N-O 3.16Å; L130-F225 HydrophobicContact CB-CD1 3.79Å; L130-F225 HydrophobicContact CB-CE1 3.88Å; L130-F225 HydrophobicContact CD1-CE1 3.98Å; L130-F225 VanDerWaalsContact O-CA 3.22Å; L130-F225 WeakPolarHBondContact O-CA 3.46Å; L130-H226 PolarHBondContact O-N 2.82Å; L130-H226 VanDerWaalsContact O-N 3.16Å
131	P	87.2	Confident	84.8	Confident	2 Å²	2	40.5 Å²	40.5	1%	0.013	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66	129.6	175.1	19.5	-28.4	0	0	0	112.2	G133 K134 H226 P228 E232 F237	P131-G133 PolarHBondContact O-N 3.47Å; P131-K134 HydrophobicContact CG-CB 4.19Å; P131-K134 HydrophobicContact CG-CD 3.81Å; P131-K134 WeakPolarHBondContact O-CB 3.43Å; P131-K134 PolarHBondContact O-N 2.9Å; P131-H226 WeakPolarHBondContact CA-NE2 3.38Å; P131-H226 WeakPolarHBondContact CD-NE2 3.27Å; P131-P228 HydrophobicContact CB-CB 3.73Å; P131-E232 HydrophobicContact CG-CG 4.41Å; P131-F237 HydrophobicContact CB-CE2 4.19Å; P131-F237 HydrophobicContact CB-CZ 4.45Å; P131-F237 HydrophobicContact CG-CE2 4.36Å
132	I	86.1	Confident	84.9	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	125.1	177.3	-65.5	179.6	0	0	0	110.2	L130 P195 F225 H226 V280 W282	L130-I132 PolarHBondContact O-N 2.97Å; I132-P195 HydrophobicContact CD1-CB 3.9Å; I132-P195 HydrophobicContact CD1-CG 4.35Å; I132-P195 VanDerWaalsContact CD1-N 3.27Å; I132-F225 HydrophobicContact CD1-CB 4.03Å; I132-F225 HydrophobicContact CG1-CB 3.66Å; I132-F225 HydrophobicContact CG1-CG 4.48Å; I132-H226 PolarHBondContact N-O 3.35Å; I132-V280 HydrophobicContact CG2-CG1 4.24Å; I132-W282 HydrophobicContact CB-CZ2 3.86Å; I132-W282 HydrophobicContact CG2-CZ2 3.89Å; I132-W282 PolarHBondContact O-NE1 3.4Å
133	G	81.9	Confident	84.9	Confident	2 Å²	2	39.8 Å²	39.8	2%	0.021	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	121.8	-39.7	-162.6	0	0	0	0	0	111	P131 T190 Q339	P131-G133 PolarHBondContact O-N 3.47Å; G133-T190 PolarHBondContact N-OG1 3.13Å; G133-Q339 PolarHBondContact O-NE2 3.43Å
134	K	84.4	Confident	84.8	Confident	41 Å²	41	41.9 Å²	41.9	18%	0.178	20%	0.2	C	C	.	.	S	Bend	trans	-71	148.1	-179.1	-164.2	166.8	179.9	173.7	0	109.8	E127 L130 P131 T190 E236 F237	E127-K134 IonicContact OE1-NZ 3.68Å; E127-K134 PolarHBondContact OE1-NZ 3.44Å; E127-K134 IonicContact OE2-NZ 2.72Å; L130-K134 HydrophobicContact CD2-CD 3.77Å; L130-K134 HydrophobicContact CD2-CG 4.37Å; P131-K134 HydrophobicContact CG-CB 4.19Å; P131-K134 HydrophobicContact CG-CD 3.81Å; P131-K134 WeakPolarHBondContact O-CB 3.43Å; P131-K134 PolarHBondContact O-N 2.9Å; K134-T190 WeakPolarHBondContact O-CG2 3.13Å; K134-T190 PolarHBondContact O-OG1 3.41Å; K134-E236 WeakPolarHBondContact CD-OE2 3.43Å; K134-E236 WeakPolarHBondContact CE-OE2 3.37Å; K134-E236 IonicContact NZ-OE1 2.73Å; K134-E236 PolarHBondContact NZ-OE1 3.17Å; K134-E236 IonicContact NZ-OE2 2.89Å; K134-E236 PolarHBondContact NZ-OE2 2.93Å; K134-F237 HydrophobicContact CB-CE1 4.5Å; K134-F237 HydrophobicContact CB-CZ 4.18Å
135	L	84.8	Confident	84.6	Confident	39 Å²	39	45 Å²	45	20%	0.204	21%	0.213	C	C	.	.	P	Polyproline II helix	trans	-75	125.3	175.1	-177	72.1	0	0	0	109.1	S188 L341	L135-S188 WeakPolarHBondContact CD1-O 3.44Å; L135-L341 HydrophobicContact CD1-CD2 3.86Å
136	L	88	Confident	84.7	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.005	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	128.9	171.7	175.4	65.1	0	0	0	109.2	L130 I138 R187 S188 T190 Y201 V223 F225	L130-L136 HydrophobicContact CD1-CD1 3.49Å; L130-L136 VanDerWaalsContact CD1-CD1 3.49Å; L136-I138 HydrophobicContact CD1-CD1 4.14Å; L136-I138 HydrophobicContact CD1-CG1 3.75Å; L136-I138 HydrophobicContact CD2-CD1 4.11Å; L136-I138 HydrophobicContact CD2-CG1 4.26Å; L136-I138 HydrophobicContact CG-CD1 4.34Å; L136-I138 HydrophobicContact CG-CG1 3.97Å; L136-R187 WeakPolarHBondContact O-CA 3.3Å; L136-S188 WeakPolarHBondContact CB-O 3.38Å; L136-S188 PolarHBondContact N-O 3.44Å; L136-S188 PolarHBondContact O-N 2.71Å; L136-T190 HydrophobicContact CB-CG2 4.19Å; L136-Y201 HydrophobicContact CD2-CD2 4.45Å; L136-Y201 HydrophobicContact CD2-CE1 3.87Å; L136-Y201 HydrophobicContact CD2-CE2 3.72Å; L136-Y201 WeakPolarHBondContact CD2-OH 3.41Å; L136-V223 HydrophobicContact CD1-CG1 4.07Å; L136-F225 HydrophobicContact CD1-CE1 4.35Å; L136-F225 HydrophobicContact CD1-CZ 4.03Å; L136-F225 HydrophobicContact CD2-CZ 4.13Å; L136-F225 HydrophobicContact CG-CZ 4.48Å
137	E	90.2	Very high	85.2	Confident	58 Å²	58	36.2 Å²	36.2	27%	0.271	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	107	169	-170.2	178.1	110.5	0	0	111	T125 Q139 I185 L186 R187	T125-E137 PolarHBondContact OG1-O 2.99Å; E137-Q139 HydrophobicContact CG-CG 4.31Å; E137-Q139 PolarHBondContact OE1-NE2 3.31Å; E137-I185 HydrophobicContact CG-CG2 3.53Å; E137-L186 WeakPolarHBondContact CA-O 3.45Å; E137-R187 HydrophobicContact CB-CG 4.21Å; E137-R187 HydrophobicContact CG-CG 3.87Å; E137-R187 IonicContact OE2-CZ 2.69Å; E137-R187 IonicContact OE2-NE 2.65Å; E137-R187 PolarHBondContact OE2-NE 2.69Å; E137-R187 IonicContact OE2-NH2 3.21Å; E137-R187 PolarHBondContact OE2-NH2 3.36Å
138	I	90.6	Very high	85.6	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	106.1	176.1	-50.1	-175.5	0	0	0	109.1	T125 L136 V140 W162 I185 L186 Y201 I221 V223	T125-I138 WeakPolarHBondContact OG1-CA 3.14Å; L136-I138 HydrophobicContact CD1-CD1 4.14Å; L136-I138 HydrophobicContact CD1-CG1 3.75Å; L136-I138 HydrophobicContact CD2-CD1 4.11Å; L136-I138 HydrophobicContact CD2-CG1 4.26Å; L136-I138 HydrophobicContact CG-CD1 4.34Å; L136-I138 HydrophobicContact CG-CG1 3.97Å; I138-V140 HydrophobicContact CG2-CG2 4.44Å; I138-W162 HydrophobicContact CB-CH2 4.11Å; I138-W162 HydrophobicContact CB-CZ3 4.26Å; I138-W162 HydrophobicContact CG2-CH2 3.69Å; I138-W162 HydrophobicContact CG2-CZ3 3.87Å; I138-I185 WeakPolarHBondContact O-CA 3.34Å; I138-L186 HydrophobicContact CB-CB 4.46Å; I138-L186 PolarHBondContact N-O 3.1Å; I138-L186 PolarHBondContact O-N 2.81Å; I138-Y201 VanDerWaalsContact CD1-CB 3.46Å; I138-Y201 HydrophobicContact CD1-CD1 3.97Å; I138-Y201 HydrophobicContact CD1-CD2 3.57Å; I138-Y201 HydrophobicContact CD1-CE2 4.28Å; I138-Y201 HydrophobicContact CD1-CG 3.38Å; I138-I221 HydrophobicContact CG2-CD1 3.55Å; I138-V223 HydrophobicContact CD1-CG2 3.98Å
139	Q	91.6	Very high	85.5	Confident	34 Å²	34	42.7 Å²	42.7	16%	0.159	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	127.6	173.4	-64.8	-165.9	26.9	0	0	110.8	I124 T125 E137 I185	I124-Q139 HydrophobicContact CB-CB 3.78Å; I124-Q139 HydrophobicContact CD1-CB 4.3Å; I124-Q139 HydrophobicContact CG2-CB 4.06Å; I124-Q139 PolarHBondContact N-O 2.72Å; T125-Q139 PolarHBondContact N-O 3.28Å; T125-Q139 PolarHBondContact OG1-N 2.89Å; E137-Q139 HydrophobicContact CG-CG 4.31Å; E137-Q139 PolarHBondContact OE1-NE2 3.31Å; Q139-I185 HydrophobicContact CG-CD1 4.12Å; Q139-I185 HydrophobicContact CG-CG1 4.02Å; Q139-I185 HydrophobicContact CG-CG2 4.07Å
140	V	90.6	Very high	85.1	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	126.1	170.6	177.8	0	0	0	0	109.5	F121 I138 W162 R183 F184 I219 I221	F121-V140 HydrophobicContact CB-CG1 3.99Å; F121-V140 HydrophobicContact CD1-CG1 3.61Å; F121-V140 HydrophobicContact CG-CG1 4.26Å; I138-V140 HydrophobicContact CG2-CG2 4.44Å; V140-W162 HydrophobicContact CB-CH2 4.46Å; V140-W162 HydrophobicContact CG2-CH2 3.8Å; V140-W162 HydrophobicContact CG2-CZ2 4.45Å; V140-R183 WeakPolarHBondContact O-CA 3.43Å; V140-F184 PolarHBondContact N-O 3.21Å; V140-F184 PolarHBondContact O-N 2.78Å; V140-I219 HydrophobicContact CG1-CG2 4.17Å; V140-I219 HydrophobicContact CG2-CG2 4.41Å; V140-I221 HydrophobicContact CG2-CD1 3.56Å
141	K	90.4	Very high	84.5	Confident	84 Å²	84	40.4 Å²	40.4	37%	0.365	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	136.2	170.8	-166.3	-168.6	-172.1	-166.5	0	109.5	N122 I124 D182	N122-K141 HydrophobicContact CB-CB 4.23Å; N122-K141 PolarHBondContact N-O 3.15Å; N122-K141 PolarHBondContact O-N 3.04Å; I124-K141 HydrophobicContact CD1-CB 3.81Å; I124-K141 HydrophobicContact CG1-CB 4.28Å; K141-D182 WeakPolarHBondContact CE-OD2 3.27Å; K141-D182 HydrophobicContact CG-CB 4.35Å; K141-D182 IonicContact NZ-OD2 2.62Å; K141-D182 PolarHBondContact NZ-OD2 3.13Å
142	I	87.7	Confident	83.9	Confident	2 Å²	2	44.5 Å²	44.5	1%	0.01	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	136.3	172	-64.1	-170.2	0	0	0	109.5	V120 F121 E144 V147 V160 D182 F184	V120-I142 HydrophobicContact CG1-CG2 4.24Å; V120-I142 CarbonylContact O-C 3.45Å; V120-I142 WeakPolarHBondContact O-CA 3.22Å; F121-I142 HydrophobicContact CD1-CD1 3.98Å; F121-I142 HydrophobicContact CD1-CG1 3.77Å; F121-I142 HydrophobicContact CE1-CD1 3.55Å; F121-I142 HydrophobicContact CE1-CG1 3.89Å; F121-I142 HydrophobicContact CZ-CD1 4.46Å; I142-E144 PolarHBondContact O-N 3.06Å; I142-V147 HydrophobicContact CG2-CB 4.38Å; I142-V147 HydrophobicContact CG2-CG2 3.41Å; I142-V147 VanDerWaalsContact CG2-CG2 3.41Å; I142-V160 HydrophobicContact CD1-CG1 3.65Å; I142-D182 PolarHBondContact N-O 2.81Å; I142-F184 HydrophobicContact CB-CD2 4.41Å; I142-F184 HydrophobicContact CB-CE2 4.24Å; I142-F184 HydrophobicContact CD1-CD2 3.53Å; I142-F184 HydrophobicContact CD1-CE2 3.5Å; I142-F184 HydrophobicContact CD1-CG 4.42Å; I142-F184 HydrophobicContact CD1-CZ 4.34Å; I142-F184 HydrophobicContact CG1-CD2 3.79Å; I142-F184 HydrophobicContact CG1-CE2 3.97Å
143	D	85.5	Confident	83	Confident	55 Å²	55	49.7 Å²	49.7	29%	0.294	24%	0.236	S	C	.	.			trans	-76.7	103.1	166.8	172	43.3	0	0	0	110.1	V120 E145 T146 V147	V120-D143 PolarHBondContact O-N 3.3Å; D143-E145 PolarHBondContact O-N 2.63Å; D143-E145 PolarHBondContact OD1-N 3.49Å; D143-T146 WeakPolarHBondContact CB-OG1 3.47Å; D143-T146 PolarHBondContact O-N 2.8Å; D143-T146 PolarHBondContact O-OG1 2.73Å; D143-T146 VanDerWaalsContact OD2-CB 3.24Å; D143-T146 WeakPolarHBondContact OD2-CB 3.16Å; D143-T146 WeakPolarHBondContact OD2-CG2 3.48Å; D143-T146 PolarHBondContact OD2-N 3.21Å; D143-T146 PolarHBondContact OD2-OG1 3.38Å; D143-V147 PolarHBondContact O-N 3.02Å; D143-V147 VanDerWaalsContact O-N 3.15Å
144	E	82.9	Confident	82.3	Confident	89 Å²	89	50.8 Å²	50.8	42%	0.416	24%	0.243	S	C	.	.	H	α-helix	trans	-63.4	-23.3	179.8	-59.8	-158.9	139.6	0	0	112.3	I142 W148 I158 K179	I142-E144 PolarHBondContact O-N 3.06Å; E144-W148 WeakPolarHBondContact O-CB 3.38Å; E144-W148 PolarHBondContact O-N 3.15Å; E144-I158 HydrophobicContact CB-CD1 4.19Å; E144-I158 HydrophobicContact CG-CD1 3.85Å; E144-K179 IonicContact OE1-NZ 2.75Å
145	E	81.8	Confident	81.4	Confident	121 Å²	121	58.4 Å²	58.4	57%	0.565	28%	0.277	S	S	*	.	H	α-helix	trans	-70.2	-45.6	177.4	-94.1	-151.7	-143.2	0	0	113.2	D143 K149	D143-E145 PolarHBondContact O-N 2.63Å; D143-E145 PolarHBondContact OD1-N 3.49Å; E145-K149 WeakPolarHBondContact O-CD 3.34Å; E145-K149 WeakPolarHBondContact O-CE 3.17Å; E145-K149 VanDerWaalsContact O-CG 3.24Å; E145-K149 WeakPolarHBondContact O-CG 3.44Å; E145-K149 PolarHBondContact O-N 3.42Å; E145-K149 IonicContact OE2-NZ 2.62Å; E145-K149 PolarHBondContact OE2-NZ 2.63Å
146	T	82.1	Confident	80.6	Confident	38 Å²	38	61.9 Å²	61.9	23%	0.233	29%	0.292	C	S	.	.	H	α-helix	trans	-69.7	-37.8	173.8	45.6	0	0	0	0	111.7	D143 K149 L150	D143-T146 WeakPolarHBondContact CB-OG1 3.47Å; D143-T146 PolarHBondContact O-N 2.8Å; D143-T146 PolarHBondContact O-OG1 2.73Å; D143-T146 VanDerWaalsContact OD2-CB 3.24Å; D143-T146 WeakPolarHBondContact OD2-CB 3.16Å; D143-T146 WeakPolarHBondContact OD2-CG2 3.48Å; D143-T146 PolarHBondContact OD2-N 3.21Å; D143-T146 PolarHBondContact OD2-OG1 3.38Å; T146-K149 PolarHBondContact O-N 3.13Å; T146-L150 WeakPolarHBondContact O-CD1 3.33Å; T146-L150 VanDerWaalsContact O-CG 3.27Å; T146-L150 WeakPolarHBondContact O-CG 3.43Å; T146-L150 PolarHBondContact O-N 2.98Å
147	V	79.8	Confident	80	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-64.1	-42.9	175.3	173.8	0	0	0	0	112.3	V120 I142 D143 K149 L150 M151 I158 L205	V120-V147 HydrophobicContact CG1-CG2 3.58Å; I142-V147 HydrophobicContact CG2-CB 4.38Å; I142-V147 HydrophobicContact CG2-CG2 3.41Å; I142-V147 VanDerWaalsContact CG2-CG2 3.41Å; D143-V147 PolarHBondContact O-N 3.02Å; D143-V147 VanDerWaalsContact O-N 3.15Å; V147-K149 VanDerWaalsContact C-N 3.25Å; V147-K149 PolarHBondContact O-N 3.28Å; V147-L150 CarbonylContact O-C 3.59Å; V147-L150 PolarHBondContact O-N 2.88Å; V147-M151 HydrophobicContact CG1-CE 4Å; V147-M151 HydrophobicContact CG1-CG 4.06Å; V147-M151 HydrophobicContact CG1-SD 3.87Å; V147-M151 WeakPolarHBondContact O-CG 3.36Å; V147-M151 PolarHBondContact O-N 3.41Å; V147-I158 HydrophobicContact CB-CD1 4.17Å; V147-I158 HydrophobicContact CG1-CD1 3.73Å; V147-I158 HydrophobicContact CG1-CG1 3.84Å; V147-I158 HydrophobicContact CG1-CG2 4.16Å; V147-L205 HydrophobicContact CG1-CD1 4.13Å; V147-L205 HydrophobicContact CG1-CD2 4.13Å; V147-L205 HydrophobicContact CG2-CD1 4.31Å; V147-L205 HydrophobicContact CG2-CD2 3.87Å
148	W	79.1	Confident	79.5	Confident	133 Å²	133	65.9 Å²	65.9	50%	0.504	32%	0.315	S	S	.	.	H	α-helix	trans	-61.3	-35.4	177.5	-174.3	33.2	0	0	0	112.3	E144 N153	E144-W148 WeakPolarHBondContact O-CB 3.38Å; E144-W148 PolarHBondContact O-N 3.15Å; W148-N153 PolarHBondContact NE1-O 3.49Å; W148-N153 WeakPolarHBondContact O-CA 3.37Å; W148-N153 PolarHBondContact O-N 2.89Å
149	K	78.9	Confident	79.3	Confident	115 Å²	115	68.8 Å²	68.8	50%	0.5	33%	0.328	S	S	.	.	H	α-helix	trans	-66.9	-42.1	172.1	-65.5	156.9	-161	157.4	0	111.6	E145 T146 V147 N152	E145-K149 WeakPolarHBondContact O-CD 3.34Å; E145-K149 WeakPolarHBondContact O-CE 3.17Å; E145-K149 VanDerWaalsContact O-CG 3.24Å; E145-K149 WeakPolarHBondContact O-CG 3.44Å; E145-K149 PolarHBondContact O-N 3.42Å; E145-K149 IonicContact OE2-NZ 2.62Å; E145-K149 PolarHBondContact OE2-NZ 2.63Å; T146-K149 PolarHBondContact O-N 3.13Å; V147-K149 VanDerWaalsContact C-N 3.25Å; V147-K149 PolarHBondContact O-N 3.28Å; K149-N152 PolarHBondContact O-N 3.37Å
150	L	76.9	Confident	79.2	Confident	27 Å²	27	68 Å²	68	14%	0.141	33%	0.326	C	S	.	.	H	α-helix	trans	-69.8	-26.8	178.2	-70.9	163.5	0	0	0	114.1	V120 T146 V147 N152 L207 S211 M213 P217	V120-L150 HydrophobicContact CG2-CD1 3.6Å; T146-L150 WeakPolarHBondContact O-CD1 3.33Å; T146-L150 VanDerWaalsContact O-CG 3.27Å; T146-L150 WeakPolarHBondContact O-CG 3.43Å; T146-L150 PolarHBondContact O-N 2.98Å; V147-L150 CarbonylContact O-C 3.59Å; V147-L150 PolarHBondContact O-N 2.88Å; L150-N152 VanDerWaalsContact C-N 3.27Å; L150-N152 PolarHBondContact O-N 3.36Å; L150-L207 HydrophobicContact CB-CD2 4.49Å; L150-S211 PolarHBondContact O-OG 3.12Å; L150-M213 HydrophobicContact CD2-CG 3.69Å; L150-M213 HydrophobicContact CD2-SD 3.85Å; L150-P217 HydrophobicContact CD1-CG 4.11Å
151	M	73.9	Confident	79.2	Confident	7 Å²	7	69.6 Å²	69.6	3%	0.034	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	22.9	175.3	-59.6	-168.5	-45.2	0	0	113	V147 N153 S154 I158 L207	V147-M151 HydrophobicContact CG1-CE 4Å; V147-M151 HydrophobicContact CG1-CG 4.06Å; V147-M151 HydrophobicContact CG1-SD 3.87Å; V147-M151 WeakPolarHBondContact O-CG 3.36Å; V147-M151 PolarHBondContact O-N 3.41Å; M151-N153 VanDerWaalsContact C-N 3.25Å; M151-N153 PolarHBondContact O-N 2.67Å; M151-S154 VanDerWaalsContact O-CB 3.3Å; M151-S154 WeakPolarHBondContact O-CB 3.08Å; M151-S154 PolarHBondContact O-N 3.15Å; M151-S154 PolarHBondContact O-OG 2.67Å; M151-I158 HydrophobicContact CE-CG1 3.93Å; M151-L207 HydrophobicContact CG-CD2 4.34Å
152	N	73.8	Confident	79.3	Confident	88 Å²	88	65.7 Å²	65.7	47%	0.471	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.6	36.5	178.8	-68.3	-46.3	0	0	0	114	K149 L150 S154 N210	K149-N152 PolarHBondContact O-N 3.37Å; L150-N152 VanDerWaalsContact C-N 3.27Å; L150-N152 PolarHBondContact O-N 3.36Å; N152-S154 PolarHBondContact O-N 2.84Å; N152-N210 PolarHBondContact ND2-O 3.15Å; N152-N210 VanDerWaalsContact ND2-O 3.1Å
153	N	68.2	Low	79.5	Confident	109 Å²	109	68.3 Å²	68.3	58%	0.583	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.5	11.1	-172.2	-50	-68.6	0	0	0	115.7	W148 M151	W148-N153 PolarHBondContact NE1-O 3.49Å; W148-N153 WeakPolarHBondContact O-CA 3.37Å; W148-N153 PolarHBondContact O-N 2.89Å; M151-N153 VanDerWaalsContact C-N 3.25Å; M151-N153 PolarHBondContact O-N 2.67Å
154	S	66.8	Low	79.7	Confident	25 Å²	25	67.4 Å²	67.4	18%	0.175	32%	0.322	C	S	.	.			trans	-62.2	142.4	172.5	89.5	0	0	0	0	110.3	M151 N152 E156	M151-S154 VanDerWaalsContact O-CB 3.3Å; M151-S154 WeakPolarHBondContact O-CB 3.08Å; M151-S154 PolarHBondContact O-N 3.15Å; M151-S154 PolarHBondContact O-OG 2.67Å; N152-S154 PolarHBondContact O-N 2.84Å; S154-E156 VanDerWaalsContact C-N 3.31Å; S154-E156 PolarHBondContact O-N 2.57Å
155	K	65.7	Low	79.9	Confident	202 Å²	202	66.3 Å²	66.3	88%	0.878	32%	0.318	S	S	*	.			trans	-100.8	40.3	-179.4	-157.8	-177.3	179	178.7	0	111.2
156	E	66.8	Low	80.1	Confident	112 Å²	112	65.9 Å²	65.9	52%	0.523	33%	0.329	S	S	.	.			trans	-78.9	151.1	179.5	-69.7	176.3	-159.6	0	0	110.8	S154 I158	S154-E156 VanDerWaalsContact C-N 3.31Å; S154-E156 PolarHBondContact O-N 2.57Å; E156-I158 PolarHBondContact O-N 2.68Å
157	N	75.8	Confident	80.5	Confident	125 Å²	125	68.8 Å²	68.8	67%	0.668	35%	0.347	S	S	*	.			trans	-65.9	108.1	179.5	-82.3	1	0	0	0	109.5	Q159	N157-Q159 WeakPolarHBondContact O-CG 3.21Å; N157-Q159 PolarHBondContact O-N 2.72Å; N157-Q159 VanDerWaalsContact O-N 3.15Å
158	I	81.2	Confident	81	Confident	17 Å²	17	72.7 Å²	72.7	9%	0.087	37%	0.367	C	S	.	.			trans	-51.2	120.7	176.7	-56.8	172.5	0	0	0	109.4	E144 V147 M151 E156 F184 L205	E144-I158 HydrophobicContact CB-CD1 4.19Å; E144-I158 HydrophobicContact CG-CD1 3.85Å; V147-I158 HydrophobicContact CB-CD1 4.17Å; V147-I158 HydrophobicContact CG1-CD1 3.73Å; V147-I158 HydrophobicContact CG1-CG1 3.84Å; V147-I158 HydrophobicContact CG1-CG2 4.16Å; M151-I158 HydrophobicContact CE-CG1 3.93Å; E156-I158 PolarHBondContact O-N 2.68Å; I158-F184 HydrophobicContact CB-CZ 4.25Å; I158-F184 HydrophobicContact CG2-CE2 4.19Å; I158-F184 HydrophobicContact CG2-CZ 3.81Å; I158-F184 WeakPolarHBondContact O-CZ 3.48Å; I158-L205 HydrophobicContact CG2-CD1 3.79Å
159	Q	85.8	Confident	81.6	Confident	62 Å²	62	67.3 Å²	67.3	29%	0.29	35%	0.348	S	S	.	.			trans	-121.7	153.3	178.5	-77.3	173.4	22.6	0	0	110.2	N157 R206	N157-Q159 WeakPolarHBondContact O-CG 3.21Å; N157-Q159 PolarHBondContact O-N 2.72Å; N157-Q159 VanDerWaalsContact O-N 3.15Å; Q159-R206 HydrophobicContact CB-CB 4.06Å; Q159-R206 WeakPolarHBondContact O-CB 3.36Å; Q159-R206 PolarHBondContact O-N 2.84Å
160	V	89.3	Confident	81.9	Confident	17 Å²	17	68.9 Å²	68.9	10%	0.103	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	151.4	173.4	-58.5	0	0	0	0	110.8	I142 F184 I204	I142-V160 HydrophobicContact CD1-CG1 3.65Å; V160-F184 HydrophobicContact CB-CD1 4.4Å; V160-F184 HydrophobicContact CG1-CD1 4.08Å; V160-F184 HydrophobicContact CG1-CD2 4.44Å; V160-F184 HydrophobicContact CG1-CE1 4.15Å; V160-F184 HydrophobicContact CG1-CG 4.2Å; V160-F184 HydrophobicContact CG1-CZ 4.38Å; V160-F184 HydrophobicContact CG2-CB 4.13Å; V160-F184 HydrophobicContact CG2-CD1 3.5Å; V160-F184 VanDerWaalsContact CG2-CD1 3.5Å; V160-F184 HydrophobicContact CG2-CE1 4.12Å; V160-F184 HydrophobicContact CG2-CG 3.95Å; V160-I204 CarbonylContact C-O 3.57Å; V160-I204 VanDerWaalsContact CA-O 3.27Å; V160-I204 WeakPolarHBondContact CA-O 3.44Å
161	N	91	Very high	82.3	Confident	33 Å²	33	70.2 Å²	70.2	18%	0.176	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	133.9	166.1	-64.8	-17.8	0	0	0	108.1	Y163 L168 I204 R206	N161-Y163 HydrophobicContact CB-CD2 4.37Å; N161-Y163 HydrophobicContact CB-CE2 3.61Å; N161-L168 HydrophobicContact CB-CD1 3.98Å; N161-I204 PolarHBondContact N-O 3Å; N161-I204 PolarHBondContact O-N 3.34Å; N161-R206 PolarHBondContact OD1-NE 3.44Å; N161-R206 VanDerWaalsContact OD1-NE 3.14Å; N161-R206 PolarHBondContact OD1-NH2 2.98Å
162	W	92.8	Very high	82.8	Confident	3 Å²	3	72.6 Å²	72.6	1%	0.011	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	139.5	172.5	-74.7	93.8	0	0	0	110.4	I138 V140 I169 L186 T202 C203	I138-W162 HydrophobicContact CB-CH2 4.11Å; I138-W162 HydrophobicContact CB-CZ3 4.26Å; I138-W162 HydrophobicContact CG2-CH2 3.69Å; I138-W162 HydrophobicContact CG2-CZ3 3.87Å; V140-W162 HydrophobicContact CB-CH2 4.46Å; V140-W162 HydrophobicContact CG2-CH2 3.8Å; V140-W162 HydrophobicContact CG2-CZ2 4.45Å; W162-I169 HydrophobicContact CB-CB 4.37Å; W162-I169 HydrophobicContact CB-CD1 3.93Å; W162-I169 PolarHBondContact O-N 3.01Å; W162-L186 HydrophobicContact CB-CD2 4.3Å; W162-L186 HydrophobicContact CD2-CB 3.78Å; W162-L186 HydrophobicContact CD2-CD2 3.92Å; W162-L186 HydrophobicContact CD2-CG 4.36Å; W162-L186 HydrophobicContact CE3-CB 4.06Å; W162-L186 HydrophobicContact CE3-CD2 3.67Å; W162-L186 HydrophobicContact CE3-CG 4.49Å; W162-L186 HydrophobicContact CG-CB 4.24Å; W162-L186 HydrophobicContact CG-CD1 4.46Å; W162-L186 HydrophobicContact CG-CD2 4.22Å; W162-L186 HydrophobicContact CH2-CB 4.17Å; W162-L186 HydrophobicContact CZ2-CB 3.92Å; W162-L186 HydrophobicContact CZ3-CB 4.24Å; W162-L186 HydrophobicContact CZ3-CD2 4.22Å; W162-T202 CarbonylContact C-O 3.58Å; W162-C203 HydrophobicContact CD2-CB 3.96Å; W162-C203 HydrophobicContact CE3-CB 3.75Å; W162-C203 HydrophobicContact CH2-CB 3.86Å; W162-C203 HydrophobicContact CZ2-CB 4.03Å; W162-C203 HydrophobicContact CZ3-CB 3.71Å
163	Y	91.4	Very high	83.1	Confident	57 Å²	57	72.7 Å²	72.7	22%	0.224	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	143.1	177.2	-63.8	-104	0	0	0	110.1	N161 T167 L168 Y201 T202 I204	N161-Y163 HydrophobicContact CB-CD2 4.37Å; N161-Y163 HydrophobicContact CB-CE2 3.61Å; Y163-T167 CarbonylContact C-O 3.55Å; Y163-T167 WeakPolarHBondContact CA-O 3.43Å; Y163-L168 HydrophobicContact CD1-CB 4Å; Y163-L168 HydrophobicContact CD1-CD1 4.26Å; Y163-L168 HydrophobicContact CD2-CD1 4.37Å; Y163-L168 HydrophobicContact CE1-CB 3.82Å; Y163-L168 HydrophobicContact CE1-CD1 3.83Å; Y163-L168 HydrophobicContact CE1-CG 4.42Å; Y163-L168 HydrophobicContact CE2-CD1 3.94Å; Y163-Y201 CarbonylContact O-C 3.59Å; Y163-Y201 VanDerWaalsContact O-CA 3.29Å; Y163-Y201 WeakPolarHBondContact O-CA 2.85Å; Y163-T202 PolarHBondContact N-O 3.39Å; Y163-T202 PolarHBondContact O-N 2.81Å; Y163-I204 HydrophobicContact CD2-CD1 3.82Å; Y163-I204 HydrophobicContact CD2-CG1 3.99Å; Y163-I204 HydrophobicContact CE2-CB 4.29Å; Y163-I204 HydrophobicContact CE2-CD1 3.57Å; Y163-I204 HydrophobicContact CE2-CG1 3.93Å
164	Q	89.1	Confident	83.7	Confident	36 Å²	36	69 Å²	69	17%	0.168	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	117.6	171.8	-177.7	-167.8	44.1	0	0	107.8	S166 T167 I169 Y199 Y201	Q164-S166 VanDerWaalsContact C-N 3.27Å; Q164-S166 PolarHBondContact O-N 3.5Å; Q164-T167 PolarHBondContact N-O 3.2Å; Q164-T167 WeakPolarHBondContact O-CB 3.28Å; Q164-T167 PolarHBondContact O-N 2.59Å; Q164-I169 HydrophobicContact CB-CD1 3.97Å; Q164-I169 HydrophobicContact CB-CG1 4.01Å; Q164-Y199 HydrophobicContact CG-CD1 4.05Å; Q164-Y201 HydrophobicContact CB-CD1 4.15Å; Q164-Y201 HydrophobicContact CB-CE1 3.91Å; Q164-Y201 HydrophobicContact CG-CD1 4.27Å; Q164-Y201 HydrophobicContact CG-CE1 3.7Å; Q164-Y201 PolarHBondContact NE2-OH 3.24Å
165	N	87.6	Confident	84.6	Confident	65 Å²	65	68.4 Å²	68.4	35%	0.348	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.5	49.3	-177	-67.6	-26.1	0	0	0	112.5	T167 Y199 N200	N165-T167 PolarHBondContact O-N 3.48Å; N165-Y199 WeakPolarHBondContact ND2-CD1 2.83Å; N165-N200 PolarHBondContact N-O 3.46Å; N165-N200 PolarHBondContact OD1-N 2.96Å
166	S	86.6	Confident	85.7	Confident	113 Å²	113	61 Å²	61	79%	0.79	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.4	-0.1	-175	-49.1	0	0	0	0	117.2	Q164	Q164-S166 VanDerWaalsContact C-N 3.27Å; Q164-S166 PolarHBondContact O-N 3.5Å
167	T	90.3	Very high	86.8	Confident	98 Å²	98	57.8 Å²	57.8	60%	0.601	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.3	130.2	173	-54.8	0	0	0	0	110	Y163 Q164 N165 I169	Y163-T167 CarbonylContact C-O 3.55Å; Y163-T167 WeakPolarHBondContact CA-O 3.43Å; Q164-T167 PolarHBondContact N-O 3.2Å; Q164-T167 WeakPolarHBondContact O-CB 3.28Å; Q164-T167 PolarHBondContact O-N 2.59Å; N165-T167 PolarHBondContact O-N 3.48Å; T167-I169 PolarHBondContact O-N 2.92Å
168	L	90.5	Very high	87.4	Confident	83 Å²	83	52.9 Å²	52.9	44%	0.435	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	131.7	177.4	-178.5	71.3	0	0	0	110.4	N161 Y163	N161-L168 HydrophobicContact CB-CD1 3.98Å; Y163-L168 HydrophobicContact CD1-CB 4Å; Y163-L168 HydrophobicContact CD1-CD1 4.26Å; Y163-L168 HydrophobicContact CD2-CD1 4.37Å; Y163-L168 HydrophobicContact CE1-CB 3.82Å; Y163-L168 HydrophobicContact CE1-CD1 3.83Å; Y163-L168 HydrophobicContact CE1-CG 4.42Å; Y163-L168 HydrophobicContact CE2-CD1 3.94Å
169	I	90.2	Very high	87.8	Confident	20 Å²	20	55 Å²	55	10%	0.103	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-87.6	123.1	173.7	-58.2	162.5	0	0	0	108.7	W162 Q164 T167 C175 M177 L186 Y201	W162-I169 HydrophobicContact CB-CB 4.37Å; W162-I169 HydrophobicContact CB-CD1 3.93Å; W162-I169 PolarHBondContact O-N 3.01Å; Q164-I169 HydrophobicContact CB-CD1 3.97Å; Q164-I169 HydrophobicContact CB-CG1 4.01Å; T167-I169 PolarHBondContact O-N 2.92Å; I169-C175 HydrophobicContact CG2-CB 4.06Å; I169-M177 HydrophobicContact CG2-SD 4.46Å; I169-L186 HydrophobicContact CD1-CD1 4.23Å; I169-L186 HydrophobicContact CD1-CD2 3.6Å; I169-L186 HydrophobicContact CG2-CD1 4.32Å; I169-Y201 HydrophobicContact CD1-CD1 4Å; I169-Y201 HydrophobicContact CD1-CE1 4.14Å
170	E	86.9	Confident	87.9	Confident	147 Å²	147	55.4 Å²	55.4	69%	0.687	31%	0.309	S	S	*	.	P	Polyproline II helix	trans	-98.7	146.3	170	-63.7	-165.8	156	0	0	110.9	S172	E170-S172 PolarHBondContact O-N 2.91Å
171	P	85.1	Confident	87.6	Confident	56 Å²	56	61.1 Å²	61.1	36%	0.364	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-67.6	125.8	178.7	27.3	-34.1	0	0	0	111.2	M177	P171-M177 HydrophobicContact CB-SD 4.28Å
172	S	82.8	Confident	87.3	Confident	57 Å²	57	61.8 Å²	61.8	40%	0.399	34%	0.343	S	S	.	.			trans	-138.5	-173.2	-169.9	68.4	0	0	0	0	111.3	E170 T174 C175	E170-S172 PolarHBondContact O-N 2.91Å; S172-T174 VanDerWaalsContact C-N 3.25Å; S172-T174 PolarHBondContact OG-N 2.75Å; S172-T174 PolarHBondContact OG-OG1 2.66Å; S172-C175 PolarHBondContact N-O 2.7Å; S172-C175 WeakPolarHBondContact OG-CB 3.34Å; S172-C175 PolarHBondContact OG-N 2.93Å
173	S	80.5	Confident	87.2	Confident	89 Å²	89	66.6 Å²	66.6	62%	0.622	36%	0.361	S	S	*	.	S	Bend	trans	-70.1	-23.3	169.7	48.7	0	0	0	0	113.2	L341	S173-L341 WeakPolarHBondContact O-CD1 3.45Å
174	T	81.1	Confident	87.2	Confident	32 Å²	32	64.2 Å²	64.2	20%	0.196	35%	0.352	C	S	.	.	S	Bend	trans	-98.6	-17.4	-178.4	48.7	0	0	0	0	113.5	S172 S188 T189	S172-T174 VanDerWaalsContact C-N 3.25Å; S172-T174 PolarHBondContact OG-N 2.75Å; S172-T174 PolarHBondContact OG-OG1 2.66Å; T174-S188 CarbonylContact O-C 3.48Å; T174-S188 VanDerWaalsContact O-CA 3.3Å; T174-S188 WeakPolarHBondContact O-CA 3.26Å; T174-T189 VanDerWaalsContact CB-OG1 3.23Å; T174-T189 WeakPolarHBondContact CB-OG1 3.46Å; T174-T189 WeakPolarHBondContact CG2-OG1 3.49Å; T174-T189 PolarHBondContact O-N 2.82Å
175	C	86.6	Confident	87.3	Confident	13 Å²	13	63 Å²	63	9%	0.088	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	120.4	-177.2	-59.8	0	0	0	0	111.7	I169 S172 R187 S188	I169-C175 HydrophobicContact CG2-CB 4.06Å; S172-C175 PolarHBondContact N-O 2.7Å; S172-C175 WeakPolarHBondContact OG-CB 3.34Å; S172-C175 PolarHBondContact OG-N 2.93Å; C175-R187 CarbonylContact C-O 3.57Å; C175-R187 VanDerWaalsContact CA-O 3.27Å; C175-R187 WeakPolarHBondContact CA-O 3.45Å; C175-S188 PolarHBondContact SG-OG 3.02Å
176	E	88.5	Confident	87.5	Confident	46 Å²	46	59.9 Å²	59.9	22%	0.215	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	145.4	169.9	65	177.8	-169.6	0	0	112.2	L178 R187 L341	E176-L178 HydrophobicContact CG-CG 4.33Å; E176-R187 HydrophobicContact CG-CB 3.72Å; E176-R187 HydrophobicContact CG-CG 4.45Å; E176-R187 PolarHBondContact N-O 3.46Å; E176-R187 PolarHBondContact O-N 3.26Å; E176-R187 WeakPolarHBondContact OE1-CD 3.4Å; E176-R187 IonicContact OE1-CZ 2.61Å; E176-R187 IonicContact OE1-NE 2.61Å; E176-R187 IonicContact OE1-NH1 2.68Å; E176-R187 PolarHBondContact OE1-NH1 2.77Å; E176-L341 HydrophobicContact CB-CD1 3.89Å; E176-L341 HydrophobicContact CG-CD1 3.95Å; E176-L341 HydrophobicContact CG-CD2 4.33Å
177	M	89.9	Confident	87.6	Confident	45 Å²	45	57.7 Å²	57.7	22%	0.222	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	109.5	178.6	-65	140.5	75.1	0	0	107.7	I169 P171 I185 L186	I169-M177 HydrophobicContact CG2-SD 4.46Å; P171-M177 HydrophobicContact CB-SD 4.28Å; M177-I185 WeakPolarHBondContact CA-O 3.11Å; M177-L186 HydrophobicContact CG-CD1 3.83Å
178	L	89	Confident	87.5	Confident	22 Å²	22	53.2 Å²	53.2	12%	0.115	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	142.5	-174.9	-55.1	176.7	0	0	0	110.4	E176 I185	E176-L178 HydrophobicContact CG-CG 4.33Å; L178-I185 HydrophobicContact CB-CB 4.37Å; L178-I185 PolarHBondContact N-O 2.81Å; L178-I185 PolarHBondContact O-N 3.41Å
179	K	88.9	Confident	87.3	Confident	60 Å²	60	49.3 Å²	49.3	26%	0.261	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	122.1	164.4	-171.5	-177	-179.9	179	0	108.8	E144 N181 R183 F184	E144-K179 IonicContact OE1-NZ 2.75Å; K179-N181 WeakPolarHBondContact CE-O 3.45Å; K179-R183 WeakPolarHBondContact CA-O 3.35Å; K179-F184 HydrophobicContact CB-CD1 4.25Å; K179-F184 HydrophobicContact CB-CE1 4.15Å; K179-F184 HydrophobicContact CD-CD1 4.48Å; K179-F184 HydrophobicContact CD-CE1 3.64Å; K179-F184 HydrophobicContact CD-CE2 4.26Å; K179-F184 HydrophobicContact CD-CZ 3.52Å; K179-F184 VanDerWaalsContact CE-CZ 3.45Å; K179-F184 HydrophobicContact CG-CD1 4.13Å; K179-F184 HydrophobicContact CG-CE1 3.79Å; K179-F184 HydrophobicContact CG-CE2 4.35Å; K179-F184 HydrophobicContact CG-CZ 3.92Å
180	I	87.1	Confident	87.1	Confident	71 Å²	71	48.3 Å²	48.3	36%	0.364	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	104.4	176.9	-54.8	-175.8	0	0	0	107.5	D182 R183 I185	I180-D182 PolarHBondContact O-N 3.45Å; I180-R183 PolarHBondContact N-O 2.71Å; I180-R183 WeakPolarHBondContact O-CB 3Å; I180-R183 PolarHBondContact O-N 3Å; I180-I185 HydrophobicContact CD1-CD1 3.88Å; I180-I185 HydrophobicContact CG1-CD1 4.31Å
181	N	84.1	Confident	86.7	Confident	138 Å²	138	42.8 Å²	42.8	74%	0.738	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.4	-122.2	-171.1	-52.8	-38	0	0	0	111.4	K179 R183	K179-N181 WeakPolarHBondContact CE-O 3.45Å; N181-R183 VanDerWaalsContact C-N 3.31Å
182	D	85.4	Confident	86.4	Confident	47 Å²	47	44.3 Å²	44.3	25%	0.251	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	2.2	177.8	55.8	14.7	0	0	0	113.9	K141 I142 I180	K141-D182 WeakPolarHBondContact CE-OD2 3.27Å; K141-D182 HydrophobicContact CG-CB 4.35Å; K141-D182 IonicContact NZ-OD2 2.62Å; K141-D182 PolarHBondContact NZ-OD2 3.13Å; I142-D182 PolarHBondContact N-O 2.81Å; I180-D182 PolarHBondContact O-N 3.45Å
183	R	90	Very high	86.4	Confident	103 Å²	103	41.7 Å²	41.7	39%	0.389	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	135	179.8	-53.2	-174.1	-174.7	-161.4	4	112	I124 V140 K179 I180 N181 I185	I124-R183 HydrophobicContact CD1-CG 3.93Å; V140-R183 WeakPolarHBondContact O-CA 3.43Å; K179-R183 WeakPolarHBondContact CA-O 3.35Å; I180-R183 PolarHBondContact N-O 2.71Å; I180-R183 WeakPolarHBondContact O-CB 3Å; I180-R183 PolarHBondContact O-N 3Å; N181-R183 VanDerWaalsContact C-N 3.31Å; R183-I185 HydrophobicContact CB-CG1 4.45Å
184	F	90.8	Very high	86.5	Confident	7 Å²	7	41.5 Å²	41.5	3%	0.031	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	127.4	166.5	-66.4	-97.2	0	0	0	108.1	V140 I142 I158 V160 K179	V140-F184 PolarHBondContact N-O 3.21Å; V140-F184 PolarHBondContact O-N 2.78Å; I142-F184 HydrophobicContact CB-CD2 4.41Å; I142-F184 HydrophobicContact CB-CE2 4.24Å; I142-F184 HydrophobicContact CD1-CD2 3.53Å; I142-F184 HydrophobicContact CD1-CE2 3.5Å; I142-F184 HydrophobicContact CD1-CG 4.42Å; I142-F184 HydrophobicContact CD1-CZ 4.34Å; I142-F184 HydrophobicContact CG1-CD2 3.79Å; I142-F184 HydrophobicContact CG1-CE2 3.97Å; I158-F184 HydrophobicContact CB-CZ 4.25Å; I158-F184 HydrophobicContact CG2-CE2 4.19Å; I158-F184 HydrophobicContact CG2-CZ 3.81Å; I158-F184 WeakPolarHBondContact O-CZ 3.48Å; V160-F184 HydrophobicContact CB-CD1 4.4Å; V160-F184 HydrophobicContact CG1-CD1 4.08Å; V160-F184 HydrophobicContact CG1-CD2 4.44Å; V160-F184 HydrophobicContact CG1-CE1 4.15Å; V160-F184 HydrophobicContact CG1-CG 4.2Å; V160-F184 HydrophobicContact CG1-CZ 4.38Å; V160-F184 HydrophobicContact CG2-CB 4.13Å; V160-F184 HydrophobicContact CG2-CD1 3.5Å; V160-F184 VanDerWaalsContact CG2-CD1 3.5Å; V160-F184 HydrophobicContact CG2-CE1 4.12Å; V160-F184 HydrophobicContact CG2-CG 3.95Å; K179-F184 HydrophobicContact CB-CD1 4.25Å; K179-F184 HydrophobicContact CB-CE1 4.15Å; K179-F184 HydrophobicContact CD-CD1 4.48Å; K179-F184 HydrophobicContact CD-CE1 3.64Å; K179-F184 HydrophobicContact CD-CE2 4.26Å; K179-F184 HydrophobicContact CD-CZ 3.52Å; K179-F184 VanDerWaalsContact CE-CZ 3.45Å; K179-F184 HydrophobicContact CG-CD1 4.13Å; K179-F184 HydrophobicContact CG-CE1 3.79Å; K179-F184 HydrophobicContact CG-CE2 4.35Å; K179-F184 HydrophobicContact CG-CZ 3.92Å
185	I	91.2	Very high	86.5	Confident	10 Å²	10	40.9 Å²	40.9	5%	0.051	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	120	-173.6	-47.8	-174.5	0	0	0	108	E137 I138 Q139 M177 L178 I180 R183 R187	E137-I185 HydrophobicContact CG-CG2 3.53Å; I138-I185 WeakPolarHBondContact O-CA 3.34Å; Q139-I185 HydrophobicContact CG-CD1 4.12Å; Q139-I185 HydrophobicContact CG-CG1 4.02Å; Q139-I185 HydrophobicContact CG-CG2 4.07Å; M177-I185 WeakPolarHBondContact CA-O 3.11Å; L178-I185 HydrophobicContact CB-CB 4.37Å; L178-I185 PolarHBondContact N-O 2.81Å; L178-I185 PolarHBondContact O-N 3.41Å; I180-I185 HydrophobicContact CD1-CD1 3.88Å; I180-I185 HydrophobicContact CG1-CD1 4.31Å; R183-I185 HydrophobicContact CB-CG1 4.45Å; I185-R187 HydrophobicContact CG2-CG 4.23Å
186	L	91.5	Very high	86.2	Confident	0 Å²	0	47 Å²	47	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	126.7	166.5	172.6	67.7	0	0	0	108.3	E137 I138 W162 I169 M177 Y201	E137-L186 WeakPolarHBondContact CA-O 3.45Å; I138-L186 HydrophobicContact CB-CB 4.46Å; I138-L186 PolarHBondContact N-O 3.1Å; I138-L186 PolarHBondContact O-N 2.81Å; W162-L186 HydrophobicContact CB-CD2 4.3Å; W162-L186 HydrophobicContact CD2-CB 3.78Å; W162-L186 HydrophobicContact CD2-CD2 3.92Å; W162-L186 HydrophobicContact CD2-CG 4.36Å; W162-L186 HydrophobicContact CE3-CB 4.06Å; W162-L186 HydrophobicContact CE3-CD2 3.67Å; W162-L186 HydrophobicContact CE3-CG 4.49Å; W162-L186 HydrophobicContact CG-CB 4.24Å; W162-L186 HydrophobicContact CG-CD1 4.46Å; W162-L186 HydrophobicContact CG-CD2 4.22Å; W162-L186 HydrophobicContact CH2-CB 4.17Å; W162-L186 HydrophobicContact CZ2-CB 3.92Å; W162-L186 HydrophobicContact CZ3-CB 4.24Å; W162-L186 HydrophobicContact CZ3-CD2 4.22Å; I169-L186 HydrophobicContact CD1-CD1 4.23Å; I169-L186 HydrophobicContact CD1-CD2 3.6Å; I169-L186 HydrophobicContact CG2-CD1 4.32Å; M177-L186 HydrophobicContact CG-CD1 3.83Å; L186-Y201 HydrophobicContact CD2-CD1 3.65Å; L186-Y201 HydrophobicContact CD2-CE1 4.09Å
187	R	89.9	Confident	85.9	Confident	68 Å²	68	49 Å²	49	26%	0.257	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	141.2	170	-75.2	164.7	164.7	-162.3	-10.7	110.7	L136 E137 C175 E176 I185 L341	L136-R187 WeakPolarHBondContact O-CA 3.3Å; E137-R187 HydrophobicContact CB-CG 4.21Å; E137-R187 HydrophobicContact CG-CG 3.87Å; E137-R187 IonicContact OE2-CZ 2.69Å; E137-R187 IonicContact OE2-NE 2.65Å; E137-R187 PolarHBondContact OE2-NE 2.69Å; E137-R187 IonicContact OE2-NH2 3.21Å; E137-R187 PolarHBondContact OE2-NH2 3.36Å; C175-R187 CarbonylContact C-O 3.57Å; C175-R187 VanDerWaalsContact CA-O 3.27Å; C175-R187 WeakPolarHBondContact CA-O 3.45Å; E176-R187 HydrophobicContact CG-CB 3.72Å; E176-R187 HydrophobicContact CG-CG 4.45Å; E176-R187 PolarHBondContact N-O 3.46Å; E176-R187 PolarHBondContact O-N 3.26Å; E176-R187 WeakPolarHBondContact OE1-CD 3.4Å; E176-R187 IonicContact OE1-CZ 2.61Å; E176-R187 IonicContact OE1-NE 2.61Å; E176-R187 IonicContact OE1-NH1 2.68Å; E176-R187 PolarHBondContact OE1-NH1 2.77Å; I185-R187 HydrophobicContact CG2-CG 4.23Å; R187-L341 HydrophobicContact CB-CD2 4.28Å
188	S	88.4	Confident	85.7	Confident	3 Å²	3	50.6 Å²	50.6	2%	0.021	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	141	-178.5	-166.1	0	0	0	0	112.8	L135 L136 T174 C175	L135-S188 WeakPolarHBondContact CD1-O 3.44Å; L136-S188 WeakPolarHBondContact CB-O 3.38Å; L136-S188 PolarHBondContact N-O 3.44Å; L136-S188 PolarHBondContact O-N 2.71Å; T174-S188 CarbonylContact O-C 3.48Å; T174-S188 VanDerWaalsContact O-CA 3.3Å; T174-S188 WeakPolarHBondContact O-CA 3.26Å; C175-S188 PolarHBondContact SG-OG 3.02Å
189	T	85.6	Confident	85.7	Confident	1 Å²	1	50.2 Å²	50.2	1%	0.006	24%	0.242	C	C	.	.			trans	-72.6	140.5	169.5	62	0	0	0	0	110.2	T174 N191 H192 Q339 L341	T174-T189 VanDerWaalsContact CB-OG1 3.23Å; T174-T189 WeakPolarHBondContact CB-OG1 3.46Å; T174-T189 WeakPolarHBondContact CG2-OG1 3.49Å; T174-T189 PolarHBondContact O-N 2.82Å; T189-N191 WeakPolarHBondContact CB-OD1 3.08Å; T189-N191 PolarHBondContact OG1-OD1 3.4Å; T189-H192 PolarHBondContact O-CE1 2.96Å; T189-H192 PolarHBondContact O-ND1 2.84Å; T189-Q339 HydrophobicContact CG2-CB 3.98Å; T189-L341 HydrophobicContact CG2-CD2 4.33Å
190	T	84.9	Confident	85.8	Confident	0 Å²	0	50 Å²	50	0%	0	24%	0.244	C	C	.	.	S	Bend	trans	-93.2	2	-173.6	53.1	0	0	0	0	114.3	G133 K134 L136 H192 L193 F225 Q339	G133-T190 PolarHBondContact N-OG1 3.13Å; K134-T190 WeakPolarHBondContact O-CG2 3.13Å; K134-T190 PolarHBondContact O-OG1 3.41Å; L136-T190 HydrophobicContact CB-CG2 4.19Å; T190-H192 PolarHBondContact O-N 3.25Å; T190-L193 HydrophobicContact CG2-CD1 3.75Å; T190-L193 WeakPolarHBondContact O-CB 3.18Å; T190-L193 PolarHBondContact O-N 3.4Å; T190-F225 HydrophobicContact CG2-CD1 3.98Å; T190-F225 HydrophobicContact CG2-CE1 3.55Å; T190-F225 HydrophobicContact CG2-CZ 4.38Å; T190-Q339 PolarHBondContact OG1-NE2 2.92Å
191	N	79.2	Confident	86	Confident	30 Å²	30	46.7 Å²	46.7	16%	0.16	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-19.7	179.4	61.4	-23.9	0	0	0	115.6	T189 V280 H294	T189-N191 WeakPolarHBondContact CB-OD1 3.08Å; T189-N191 PolarHBondContact OG1-OD1 3.4Å; N191-V280 HydrophobicContact CB-CG2 4.14Å; N191-H294 PolarHBondContact O-CE1 3.01Å; N191-H294 PolarHBondContact O-ND1 2.76Å
192	H	78.5	Confident	86.3	Confident	88 Å²	88	41.2 Å²	41.2	41%	0.407	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100	6.5	176.6	68.6	-79.5	0	0	0	112.8	T189 T190	T189-H192 PolarHBondContact O-CE1 2.96Å; T189-H192 PolarHBondContact O-ND1 2.84Å; T190-H192 PolarHBondContact O-N 3.25Å
193	L	83	Confident	86.6	Confident	2 Å²	2	39 Å²	39	1%	0.01	19%	0.186	C	C	.	.			trans	-100.8	158.7	-178.4	-49.6	-177.8	0	0	0	111.1	T190 Y199 F225	T190-L193 HydrophobicContact CG2-CD1 3.75Å; T190-L193 WeakPolarHBondContact O-CB 3.18Å; T190-L193 PolarHBondContact O-N 3.4Å; L193-Y199 WeakPolarHBondContact CA-OH 3.41Å; L193-Y199 HydrophobicContact CB-CE2 4.19Å; L193-Y199 HydrophobicContact CD2-CD1 4.09Å; L193-Y199 HydrophobicContact CD2-CE1 3.61Å; L193-Y199 HydrophobicContact CD2-CE2 4.27Å; L193-F225 HydrophobicContact CD1-CD1 4.04Å; L193-F225 HydrophobicContact CD1-CD2 3.8Å; L193-F225 HydrophobicContact CD1-CE1 3.73Å; L193-F225 HydrophobicContact CD1-CE2 3.48Å; L193-F225 VanDerWaalsContact CD1-CE2 3.48Å; L193-F225 HydrophobicContact CD1-CG 4.09Å; L193-F225 HydrophobicContact CD1-CZ 3.43Å; L193-F225 VanDerWaalsContact CD1-CZ 3.43Å
194	Q	82.1	Confident	86.6	Confident	86 Å²	86	36.2 Å²	36.2	40%	0.402	18%	0.178	S	C	.	.			trans	-112.6	145	177.2	-59.8	-176.6	-83.9	0	0	109.7	K197 Y199	Q194-K197 HydrophobicContact CB-CB 4.45Å; Q194-K197 HydrophobicContact CB-CD 4.17Å; Q194-Y199 PolarHBondContact N-OH 2.81Å
195	P	82.4	Confident	86.4	Confident	19 Å²	19	36 Å²	36	12%	0.123	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	160.1	173.8	28.6	-33.8	0	0	0	111.1	I132 K197 F225 L295	I132-P195 HydrophobicContact CD1-CB 3.9Å; I132-P195 HydrophobicContact CD1-CG 4.35Å; I132-P195 VanDerWaalsContact CD1-N 3.27Å; P195-K197 PolarHBondContact O-N 2.8Å; P195-F225 CarbonylContact C-O 3.58Å; P195-F225 WeakPolarHBondContact CA-O 2.83Å; P195-L295 HydrophobicContact CG-CD2 3.95Å
196	D	79.7	Confident	86.2	Confident	141 Å²	141	40.4 Å²	40.4	75%	0.754	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.9	14.6	174.6	-46.6	-44.6	0	0	0	114.3	F225	D196-F225 PolarHBondContact N-O 3.47Å
197	K	83.1	Confident	85.6	Confident	89 Å²	89	42 Å²	42	39%	0.387	20%	0.202	S	C	.	.			trans	-112.9	126.4	-178.6	-171.9	173.7	-175.1	179.9	0	110.2	Q194 P195 Y199	Q194-K197 HydrophobicContact CB-CB 4.45Å; Q194-K197 HydrophobicContact CB-CD 4.17Å; P195-K197 PolarHBondContact O-N 2.8Å; K197-Y199 HydrophobicContact CB-CE2 3.88Å; K197-Y199 HydrophobicContact CD-CE2 4.02Å; K197-Y199 HydrophobicContact CG-CD2 4.42Å; K197-Y199 HydrophobicContact CG-CE2 3.86Å; K197-Y199 WeakPolarHBondContact O-CD2 3.3Å; K197-Y199 WeakPolarHBondContact O-CE2 3.26Å
198	L	85.8	Confident	84.9	Confident	78 Å²	78	39.9 Å²	39.9	41%	0.408	20%	0.197	S	C	.	.			trans	-83.3	128.8	177.3	-172.5	150.6	0	0	0	110.6	N200 P222	L198-N200 WeakPolarHBondContact CD2-ND2 3.35Å; L198-P222 HydrophobicContact CD1-CB 4.13Å; L198-P222 HydrophobicContact CD2-CB 3.93Å; L198-P222 HydrophobicContact CG-CB 4.2Å
199	Y	88.7	Confident	84.1	Confident	14 Å²	14	49.6 Å²	49.6	6%	0.055	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	119.2	178.6	-70.3	-100.2	0	0	0	110.1	Q164 N165 L193 Q194 K197 Y201 V223 F225	Q164-Y199 HydrophobicContact CG-CD1 4.05Å; N165-Y199 WeakPolarHBondContact ND2-CD1 2.83Å; L193-Y199 WeakPolarHBondContact CA-OH 3.41Å; L193-Y199 HydrophobicContact CB-CE2 4.19Å; L193-Y199 HydrophobicContact CD2-CD1 4.09Å; L193-Y199 HydrophobicContact CD2-CE1 3.61Å; L193-Y199 HydrophobicContact CD2-CE2 4.27Å; Q194-Y199 PolarHBondContact N-OH 2.81Å; K197-Y199 HydrophobicContact CB-CE2 3.88Å; K197-Y199 HydrophobicContact CD-CE2 4.02Å; K197-Y199 HydrophobicContact CG-CD2 4.42Å; K197-Y199 HydrophobicContact CG-CE2 3.86Å; K197-Y199 WeakPolarHBondContact O-CD2 3.3Å; K197-Y199 WeakPolarHBondContact O-CE2 3.26Å; Y199-Y201 PolarHBondContact O-N 3.49Å; Y199-V223 PolarHBondContact N-O 3.45Å; Y199-V223 PolarHBondContact O-N 2.59Å; Y199-F225 AromaticContact CD2-CD2 3.75Å; Y199-F225 HydrophobicContact CD2-CD2 3.75Å; Y199-F225 AromaticContact CD2-CE2 3.93Å; Y199-F225 HydrophobicContact CD2-CE2 3.93Å; Y199-F225 HydrophobicContact CE2-CD2 4.18Å; Y199-F225 HydrophobicContact CG-CE2 4.35Å
200	N	90.4	Very high	83.2	Confident	56 Å²	56	54.4 Å²	54.4	30%	0.299	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	104.8	178.8	-74	-62.6	0	0	0	110.5	N165 L198 T220	N165-N200 PolarHBondContact N-O 3.46Å; N165-N200 PolarHBondContact OD1-N 2.96Å; L198-N200 WeakPolarHBondContact CD2-ND2 3.35Å; N200-T220 HydrophobicContact CB-CG2 3.87Å
201	Y	91.1	Very high	82.3	Confident	1 Å²	1	55.4 Å²	55.4	0%	0.004	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	114	174.9	-70.3	-88.5	0	0	0	110	L136 I138 Y163 Q164 I169 L186 Y199 T220 I221 V223 F225	L136-Y201 HydrophobicContact CD2-CD2 4.45Å; L136-Y201 HydrophobicContact CD2-CE1 3.87Å; L136-Y201 HydrophobicContact CD2-CE2 3.72Å; L136-Y201 WeakPolarHBondContact CD2-OH 3.41Å; I138-Y201 VanDerWaalsContact CD1-CB 3.46Å; I138-Y201 HydrophobicContact CD1-CD1 3.97Å; I138-Y201 HydrophobicContact CD1-CD2 3.57Å; I138-Y201 HydrophobicContact CD1-CE2 4.28Å; I138-Y201 HydrophobicContact CD1-CG 3.38Å; Y163-Y201 CarbonylContact O-C 3.59Å; Y163-Y201 VanDerWaalsContact O-CA 3.29Å; Y163-Y201 WeakPolarHBondContact O-CA 2.85Å; Q164-Y201 HydrophobicContact CB-CD1 4.15Å; Q164-Y201 HydrophobicContact CB-CE1 3.91Å; Q164-Y201 HydrophobicContact CG-CD1 4.27Å; Q164-Y201 HydrophobicContact CG-CE1 3.7Å; Q164-Y201 PolarHBondContact NE2-OH 3.24Å; I169-Y201 HydrophobicContact CD1-CD1 4Å; I169-Y201 HydrophobicContact CD1-CE1 4.14Å; L186-Y201 HydrophobicContact CD2-CD1 3.65Å; L186-Y201 HydrophobicContact CD2-CE1 4.09Å; Y199-Y201 PolarHBondContact O-N 3.49Å; Y201-T220 WeakPolarHBondContact O-CA 3.28Å; Y201-I221 PolarHBondContact N-O 2.96Å; Y201-I221 PolarHBondContact O-N 3.41Å; Y201-V223 HydrophobicContact CD2-CB 4.13Å; Y201-V223 HydrophobicContact CD2-CG2 3.88Å; Y201-V223 HydrophobicContact CE2-CB 4.17Å; Y201-V223 HydrophobicContact CE2-CG2 4.33Å; Y201-F225 HydrophobicContact CE2-CE2 4.39Å
202	T	90.6	Very high	81.5	Confident	22 Å²	22	59.1 Å²	59.1	14%	0.135	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	118.3	-178	-54.9	0	0	0	0	110.9	W162 Y163 I204 I219 T220	W162-T202 CarbonylContact C-O 3.58Å; Y163-T202 PolarHBondContact N-O 3.39Å; Y163-T202 PolarHBondContact O-N 2.81Å; T202-I204 HydrophobicContact CG2-CD1 4.25Å; T202-I204 HydrophobicContact CG2-CG1 3.87Å; T202-I219 CarbonylContact C-O 3.6Å; T202-I219 VanDerWaalsContact CA-O 3.27Å; T202-I219 WeakPolarHBondContact CA-O 3.22Å; T202-T220 WeakPolarHBondContact CG2-OG1 3.17Å; T202-T220 WeakPolarHBondContact OG1-CG2 3.32Å; T202-T220 PolarHBondContact OG1-OG1 3.44Å
203	C	91.1	Very high	80.9	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	122.9	172.9	-175.2	0	0	0	0	108.8	W162 S218 I219	W162-C203 HydrophobicContact CD2-CB 3.96Å; W162-C203 HydrophobicContact CE3-CB 3.75Å; W162-C203 HydrophobicContact CH2-CB 3.86Å; W162-C203 HydrophobicContact CZ2-CB 4.03Å; W162-C203 HydrophobicContact CZ3-CB 3.71Å; C203-S218 CarbonylContact O-C 3.58Å; C203-S218 VanDerWaalsContact O-CA 3.25Å; C203-S218 WeakPolarHBondContact O-CA 3.36Å; C203-I219 HydrophobicContact CB-CG2 3.89Å; C203-I219 PolarHBondContact N-O 2.88Å; C203-I219 PolarHBondContact O-N 2.94Å
204	I	90	Very high	80.4	Confident	45 Å²	45	64 Å²	64	23%	0.231	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	129.5	-178	-52	-170.8	0	0	0	109.7	V160 N161 Y163 T202 R206 A216	V160-I204 CarbonylContact C-O 3.57Å; V160-I204 VanDerWaalsContact CA-O 3.27Å; V160-I204 WeakPolarHBondContact CA-O 3.44Å; N161-I204 PolarHBondContact N-O 3Å; N161-I204 PolarHBondContact O-N 3.34Å; Y163-I204 HydrophobicContact CD2-CD1 3.82Å; Y163-I204 HydrophobicContact CD2-CG1 3.99Å; Y163-I204 HydrophobicContact CE2-CB 4.29Å; Y163-I204 HydrophobicContact CE2-CD1 3.57Å; Y163-I204 HydrophobicContact CE2-CG1 3.93Å; T202-I204 HydrophobicContact CG2-CD1 4.25Å; T202-I204 HydrophobicContact CG2-CG1 3.87Å; I204-R206 PolarHBondContact O-N 3.38Å; I204-A216 HydrophobicContact CG2-CB 4.17Å
205	L	88.3	Confident	80.1	Confident	3 Å²	3	64.8 Å²	64.8	2%	0.016	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	125.4	176.4	-178.1	65.1	0	0	0	110.4	F121 V147 I158 L207 P217	F121-L205 HydrophobicContact CZ-CB 3.98Å; V147-L205 HydrophobicContact CG1-CD1 4.13Å; V147-L205 HydrophobicContact CG1-CD2 4.13Å; V147-L205 HydrophobicContact CG2-CD1 4.31Å; V147-L205 HydrophobicContact CG2-CD2 3.87Å; I158-L205 HydrophobicContact CG2-CD1 3.79Å; L205-L207 HydrophobicContact CD2-CD2 3.74Å; L205-L207 HydrophobicContact CD2-CG 4.41Å; L205-L207 HydrophobicContact CG-CD2 4.18Å; L205-L207 HydrophobicContact CG-CG 4.49Å; L205-L207 PolarHBondContact O-N 3.28Å; L205-L207 VanDerWaalsContact O-N 3.11Å; L205-P217 HydrophobicContact CB-CB 4.14Å; L205-P217 HydrophobicContact CD2-CB 4.24Å; L205-P217 HydrophobicContact CD2-CG 3.98Å; L205-P217 PolarHBondContact N-O 2.98Å
206	R	85.9	Confident	80.1	Confident	102 Å²	102	65.3 Å²	65.3	39%	0.385	36%	0.357	S	S	.	.			trans	-81.3	91.6	175.2	-173.3	-177.8	-69.8	-168.8	-10.3	109.6	Q159 N161 I204	Q159-R206 HydrophobicContact CB-CB 4.06Å; Q159-R206 WeakPolarHBondContact O-CB 3.36Å; Q159-R206 PolarHBondContact O-N 2.84Å; N161-R206 PolarHBondContact OD1-NE 3.44Å; N161-R206 VanDerWaalsContact OD1-NE 3.14Å; N161-R206 PolarHBondContact OD1-NH2 2.98Å; I204-R206 PolarHBondContact O-N 3.38Å
207	L	78.7	Confident	80.4	Confident	33 Å²	33	58.9 Å²	58.9	17%	0.173	32%	0.323	C	S	.	.			trans	-72.4	147.7	173.6	-67.4	176.3	0	0	0	111.7	L150 M151 L205 M213 A216	L150-L207 HydrophobicContact CB-CD2 4.49Å; M151-L207 HydrophobicContact CG-CD2 4.34Å; L205-L207 HydrophobicContact CD2-CD2 3.74Å; L205-L207 HydrophobicContact CD2-CG 4.41Å; L205-L207 HydrophobicContact CG-CD2 4.18Å; L205-L207 HydrophobicContact CG-CG 4.49Å; L205-L207 PolarHBondContact O-N 3.28Å; L205-L207 VanDerWaalsContact O-N 3.11Å; L207-M213 HydrophobicContact CD1-CB 3.96Å; L207-M213 WeakPolarHBondContact CD1-O 3.4Å; L207-A216 HydrophobicContact CD1-CB 3.84Å; L207-A216 HydrophobicContact CG-CB 4.22Å
208	P	76.3	Confident	80.7	Confident	24 Å²	24	56.5 Å²	56.5	16%	0.156	32%	0.317	C	S	.	.			trans	-69.8	156	169.9	29.9	-35.3	0	0	0	111.6	N210 S211	P208-N210 WeakPolarHBondContact CG-OD1 2.96Å; P208-N210 PolarHBondContact O-N 2.94Å; P208-S211 WeakPolarHBondContact O-CB 2.96Å; P208-S211 PolarHBondContact O-N 3.37Å
209	E	70.8	Confident	80.8	Confident	208 Å²	208	53 Å²	53	97%	0.972	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-16.5	-177.4	-62.6	-176.4	166.6	0	0	114.7
210	N	66	Low	80.8	Confident	101 Å²	101	54.1 Å²	54.1	54%	0.54	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	0.2	178.7	68.7	12.2	0	0	0	114.3	N152 P208	N152-N210 PolarHBondContact ND2-O 3.15Å; N152-N210 VanDerWaalsContact ND2-O 3.1Å; P208-N210 WeakPolarHBondContact CG-OD1 2.96Å; P208-N210 PolarHBondContact O-N 2.94Å
211	S	66.3	Low	80.7	Confident	21 Å²	21	51.6 Å²	51.6	15%	0.147	29%	0.294	C	S	.	.			trans	-78.1	134.7	175.4	-169.9	0	0	0	0	110.6	L150 P208 M213	L150-S211 PolarHBondContact O-OG 3.12Å; P208-S211 WeakPolarHBondContact O-CB 2.96Å; P208-S211 PolarHBondContact O-N 3.37Å; S211-M213 VanDerWaalsContact C-N 3.3Å; S211-M213 PolarHBondContact O-N 3.02Å
212	S	63	Low	80.6	Confident	108 Å²	108	51.9 Å²	51.9	76%	0.755	30%	0.296	S	S	*	.			trans	-83.4	-3.4	-178.9	51.7	0	0	0	0	114	S214	S212-S214 PolarHBondContact O-N 3.37Å
213	M	66.4	Low	80.5	Confident	89 Å²	89	50.9 Å²	50.9	44%	0.438	29%	0.29	S	S	.	.			trans	-86.5	105.6	-176.5	-79.9	-101.3	55.3	0	0	111.8	L150 L207 S211	L150-M213 HydrophobicContact CD2-CG 3.69Å; L150-M213 HydrophobicContact CD2-SD 3.85Å; L207-M213 HydrophobicContact CD1-CB 3.96Å; L207-M213 WeakPolarHBondContact CD1-O 3.4Å; S211-M213 VanDerWaalsContact C-N 3.3Å; S211-M213 PolarHBondContact O-N 3.02Å
214	S	71.5	Confident	80.4	Confident	104 Å²	104	52.6 Å²	52.6	73%	0.727	30%	0.302	S	S	*	.	S	Bend	trans	-125.1	135.6	165.2	58.9	0	0	0	0	109.6	S212	S212-S214 PolarHBondContact O-N 3.37Å
215	P	76.2	Confident	80.3	Confident	102 Å²	102	50.6 Å²	50.6	66%	0.662	29%	0.291	S	S	*	.	S	Bend	cis	-60.9	156.3	-9.2	30.2	-36.5	0	0	0	112.2
216	A	83.3	Confident	80.2	Confident	30 Å²	30	52.1 Å²	52.1	25%	0.248	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-66.9	148.5	172.4	0	0	0	0	0	110.1	I204 L207 S218	I204-A216 HydrophobicContact CG2-CB 4.17Å; L207-A216 HydrophobicContact CD1-CB 3.84Å; L207-A216 HydrophobicContact CG-CB 4.22Å; A216-S218 PolarHBondContact O-N 3.04Å
217	P	85.3	Confident	80.2	Confident	7 Å²	7	48.6 Å²	48.6	5%	0.045	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-53.9	136.2	177.2	-28.5	35.6	0	0	0	112.6	Q117 V120 F121 L150 L205	Q117-P217 VanDerWaalsContact OE1-CA 3.24Å; V120-P217 HydrophobicContact CG1-CB 4.34Å; F121-P217 VanDerWaalsContact CE2-C 3.49Å; F121-P217 HydrophobicContact CE2-CB 3.73Å; L150-P217 HydrophobicContact CD1-CG 4.11Å; L205-P217 HydrophobicContact CB-CB 4.14Å; L205-P217 HydrophobicContact CD2-CB 4.24Å; L205-P217 HydrophobicContact CD2-CG 3.98Å; L205-P217 PolarHBondContact N-O 2.98Å
218	S	88.5	Confident	80.5	Confident	38 Å²	38	47 Å²	47	27%	0.266	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	134.6	-174.8	59.3	0	0	0	0	111.9	Q117 C203 A216	Q117-S218 PolarHBondContact NE2-OG 3.35Å; Q117-S218 VanDerWaalsContact NE2-OG 3.15Å; Q117-S218 PolarHBondContact OE1-O 3.09Å; C203-S218 CarbonylContact O-C 3.58Å; C203-S218 VanDerWaalsContact O-CA 3.25Å; C203-S218 WeakPolarHBondContact O-CA 3.36Å; A216-S218 PolarHBondContact O-N 3.04Å
219	I	88.2	Confident	80.8	Confident	5 Å²	5	49.2 Å²	49.2	3%	0.026	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	131.4	169	-174.7	170.2	0	0	0	110.4	F121 P123 V140 T202 C203 I221	F121-I219 HydrophobicContact CB-CB 3.82Å; F121-I219 HydrophobicContact CB-CD1 3.91Å; F121-I219 HydrophobicContact CB-CG1 4.46Å; F121-I219 HydrophobicContact CB-CG2 3.71Å; F121-I219 HydrophobicContact CD1-CG2 3.71Å; F121-I219 HydrophobicContact CD2-CB 4.02Å; F121-I219 HydrophobicContact CD2-CG2 4.03Å; F121-I219 HydrophobicContact CE1-CG2 4.25Å; F121-I219 HydrophobicContact CG-CB 3.9Å; F121-I219 HydrophobicContact CG-CG2 3.55Å; P123-I219 HydrophobicContact CB-CD1 4.02Å; P123-I219 HydrophobicContact CG-CD1 3.87Å; V140-I219 HydrophobicContact CG1-CG2 4.17Å; V140-I219 HydrophobicContact CG2-CG2 4.41Å; T202-I219 CarbonylContact C-O 3.6Å; T202-I219 VanDerWaalsContact CA-O 3.27Å; T202-I219 WeakPolarHBondContact CA-O 3.22Å; C203-I219 HydrophobicContact CB-CG2 3.89Å; C203-I219 PolarHBondContact N-O 2.88Å; C203-I219 PolarHBondContact O-N 2.94Å; I219-I221 HydrophobicContact CD1-CG1 4.49Å; I219-I221 HydrophobicContact CG1-CG1 4.32Å
220	T	88.8	Confident	81.3	Confident	38 Å²	38	40.2 Å²	40.2	23%	0.233	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	126.4	173.2	-58	0	0	0	0	110	N200 Y201 T202	N200-T220 HydrophobicContact CB-CG2 3.87Å; Y201-T220 WeakPolarHBondContact O-CA 3.28Å; T202-T220 WeakPolarHBondContact CG2-OG1 3.17Å; T202-T220 WeakPolarHBondContact OG1-CG2 3.32Å; T202-T220 PolarHBondContact OG1-OG1 3.44Å
221	I	88.7	Confident	82.1	Confident	2 Å²	2	43.2 Å²	43.2	1%	0.01	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	111.5	178.6	-62.1	171.8	0	0	0	107.2	L110 P123 L128 I138 V140 Y201 I219 V223	L110-I221 HydrophobicContact CD2-CG1 4.23Å; P123-I221 HydrophobicContact CB-CD1 4.06Å; L128-I221 HydrophobicContact CD2-CG2 3.74Å; I138-I221 HydrophobicContact CG2-CD1 3.55Å; V140-I221 HydrophobicContact CG2-CD1 3.56Å; Y201-I221 PolarHBondContact N-O 2.96Å; Y201-I221 PolarHBondContact O-N 3.41Å; I219-I221 HydrophobicContact CD1-CG1 4.49Å; I219-I221 HydrophobicContact CG1-CG1 4.32Å; I221-V223 HydrophobicContact CG2-CG2 4.08Å
222	P	89.1	Confident	82.9	Confident	7 Å²	7	44.4 Å²	44.4	5%	0.045	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	132.8	172.3	30.5	-32	0	0	0	109.6	Q109 L198	Q109-P222 HydrophobicContact CB-CG 4.49Å; L198-P222 HydrophobicContact CD1-CB 4.13Å; L198-P222 HydrophobicContact CD2-CB 3.93Å; L198-P222 HydrophobicContact CG-CB 4.2Å
223	V	88.5	Confident	83.7	Confident	1 Å²	1	39.2 Å²	39.2	1%	0.006	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	124.3	175	-174.6	0	0	0	0	109.1	L128 L130 L136 I138 Y199 Y201 I221 F225	L128-V223 CarbonylContact O-C 3.59Å; L128-V223 VanDerWaalsContact O-CA 3.27Å; L128-V223 WeakPolarHBondContact O-CA 3.44Å; L130-V223 HydrophobicContact CD1-CG1 4.09Å; L136-V223 HydrophobicContact CD1-CG1 4.07Å; I138-V223 HydrophobicContact CD1-CG2 3.98Å; Y199-V223 PolarHBondContact N-O 3.45Å; Y199-V223 PolarHBondContact O-N 2.59Å; Y201-V223 HydrophobicContact CD2-CB 4.13Å; Y201-V223 HydrophobicContact CD2-CG2 3.88Å; Y201-V223 HydrophobicContact CE2-CB 4.17Å; Y201-V223 HydrophobicContact CE2-CG2 4.33Å; I221-V223 HydrophobicContact CG2-CG2 4.08Å; V223-F225 HydrophobicContact CB-CE2 4.15Å; V223-F225 HydrophobicContact CB-CZ 4.3Å; V223-F225 HydrophobicContact CG1-CD2 4.44Å; V223-F225 HydrophobicContact CG1-CE1 4.13Å; V223-F225 HydrophobicContact CG1-CE2 3.65Å; V223-F225 HydrophobicContact CG1-CZ 3.47Å; V223-F225 VanDerWaalsContact CG1-CZ 3.47Å
224	S	88.6	Confident	84.2	Confident	37 Å²	37	38.6 Å²	38.6	26%	0.259	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	158.7	168.3	53.3	0	0	0	0	110.9	L128 D129 L130	L128-S224 PolarHBondContact O-N 3.24Å; L128-S224 PolarHBondContact O-OG 2.73Å; D129-S224 WeakPolarHBondContact CA-O 3.23Å; D129-S224 WeakPolarHBondContact CB-OG 3.14Å; D129-S224 WeakPolarHBondContact OD1-CB 3.18Å; D129-S224 PolarHBondContact OD1-OG 2.59Å; L130-S224 PolarHBondContact N-O 2.76Å; L130-S224 VanDerWaalsContact N-O 3.16Å
225	F	88.1	Confident	84.3	Confident	2 Å²	2	37.4 Å²	37.4	1%	0.009	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	138.4	172.7	-60.7	-90.5	0	0	0	109	L130 I132 L136 T190 L193 P195 D196 Y199 Y201 V223	L130-F225 HydrophobicContact CB-CD1 3.79Å; L130-F225 HydrophobicContact CB-CE1 3.88Å; L130-F225 HydrophobicContact CD1-CE1 3.98Å; L130-F225 VanDerWaalsContact O-CA 3.22Å; L130-F225 WeakPolarHBondContact O-CA 3.46Å; I132-F225 HydrophobicContact CD1-CB 4.03Å; I132-F225 HydrophobicContact CG1-CB 3.66Å; I132-F225 HydrophobicContact CG1-CG 4.48Å; L136-F225 HydrophobicContact CD1-CE1 4.35Å; L136-F225 HydrophobicContact CD1-CZ 4.03Å; L136-F225 HydrophobicContact CD2-CZ 4.13Å; L136-F225 HydrophobicContact CG-CZ 4.48Å; T190-F225 HydrophobicContact CG2-CD1 3.98Å; T190-F225 HydrophobicContact CG2-CE1 3.55Å; T190-F225 HydrophobicContact CG2-CZ 4.38Å; L193-F225 HydrophobicContact CD1-CD1 4.04Å; L193-F225 HydrophobicContact CD1-CD2 3.8Å; L193-F225 HydrophobicContact CD1-CE1 3.73Å; L193-F225 HydrophobicContact CD1-CE2 3.48Å; L193-F225 VanDerWaalsContact CD1-CE2 3.48Å; L193-F225 HydrophobicContact CD1-CG 4.09Å; L193-F225 HydrophobicContact CD1-CZ 3.43Å; L193-F225 VanDerWaalsContact CD1-CZ 3.43Å; P195-F225 CarbonylContact C-O 3.58Å; P195-F225 WeakPolarHBondContact CA-O 2.83Å; D196-F225 PolarHBondContact N-O 3.47Å; Y199-F225 AromaticContact CD2-CD2 3.75Å; Y199-F225 HydrophobicContact CD2-CD2 3.75Å; Y199-F225 AromaticContact CD2-CE2 3.93Å; Y199-F225 HydrophobicContact CD2-CE2 3.93Å; Y199-F225 HydrophobicContact CE2-CD2 4.18Å; Y199-F225 HydrophobicContact CG-CE2 4.35Å; Y201-F225 HydrophobicContact CE2-CE2 4.39Å; V223-F225 HydrophobicContact CB-CE2 4.15Å; V223-F225 HydrophobicContact CB-CZ 4.3Å; V223-F225 HydrophobicContact CG1-CD2 4.44Å; V223-F225 HydrophobicContact CG1-CE1 4.13Å; V223-F225 HydrophobicContact CG1-CE2 3.65Å; V223-F225 HydrophobicContact CG1-CZ 3.47Å; V223-F225 VanDerWaalsContact CG1-CZ 3.47Å
226	H	86.9	Confident	83.9	Confident	35 Å²	35	36 Å²	36	16%	0.162	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	163.6	-178.8	54.2	-107	0	0	0	111.6	D129 L130 P131 I132 E232	D129-H226 IonicContact OD1-CE1 2.8Å; D129-H226 IonicContact OD1-ND1 2.67Å; D129-H226 PolarHBondContact OD1-ND1 3.45Å; D129-H226 VanDerWaalsContact OD1-ND1 3.07Å; D129-H226 IonicContact OD2-CE1 2.63Å; D129-H226 PolarHBondContact OD2-CE1 2.75Å; D129-H226 IonicContact OD2-ND1 2.57Å; D129-H226 PolarHBondContact OD2-ND1 2.92Å; L130-H226 PolarHBondContact O-N 2.82Å; L130-H226 VanDerWaalsContact O-N 3.16Å; P131-H226 WeakPolarHBondContact CA-NE2 3.38Å; P131-H226 WeakPolarHBondContact CD-NE2 3.27Å; I132-H226 PolarHBondContact N-O 3.35Å; H226-E232 IonicContact NE2-OE1 3.04Å
227	C	84.5	Confident	83.1	Confident	29 Å²	29	35 Å²	35	20%	0.196	19%	0.188	C	C	.	.	P	Polyproline II helix	trans	-66.3	125.9	166.4	-74.6	0	0	0	0	109.7	T229 W282 L289	C227-T229 PolarHBondContact O-N 3.44Å; C227-W282 HydrophobicContact CB-CH2 4.39Å; C227-W282 HydrophobicContact CB-CZ3 4.35Å; C227-L289 HydrophobicContact CB-CD2 3.67Å
228	P	84.7	Confident	81.9	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.211	C	C	.	.	P	Polyproline II helix	trans	-64.7	136.1	-175.5	26.1	-34	0	0	0	111.8	P131 E232 L233 F237 W282	P131-P228 HydrophobicContact CB-CB 3.73Å; P228-E232 HydrophobicContact CB-CB 4.48Å; P228-L233 HydrophobicContact CB-CD2 4.09Å; P228-L233 HydrophobicContact CB-CG 4.09Å; P228-L233 HydrophobicContact CG-CD1 4.43Å; P228-L233 HydrophobicContact CG-CD2 3.9Å; P228-L233 HydrophobicContact CG-CG 4.2Å; P228-F237 HydrophobicContact CB-CE2 4.15Å; P228-W282 HydrophobicContact CG-CD2 3.86Å; P228-W282 HydrophobicContact CG-CG 3.87Å; P228-W282 HydrophobicContact CG-CZ2 4.3Å; P228-W282 VanDerWaalsContact CG-NE1 3.32Å
229	T	83.9	Confident	80	Confident	69 Å²	69	44.4 Å²	44.4	42%	0.423	23%	0.229	S	C	.	.	P	Polyproline II helix	trans	-68.2	156	168.2	68.2	0	0	0	0	110.6	C227 K231 E232 L233	C227-T229 PolarHBondContact O-N 3.44Å; T229-K231 PolarHBondContact O-N 3.2Å; T229-K231 VanDerWaalsContact O-N 3.13Å; T229-E232 WeakPolarHBondContact CA-OE2 3.33Å; T229-E232 VanDerWaalsContact CB-OE2 3.3Å; T229-E232 WeakPolarHBondContact CB-OE2 3.44Å; T229-E232 WeakPolarHBondContact CG2-OE2 3.38Å; T229-E232 PolarHBondContact N-OE2 3.43Å; T229-E232 PolarHBondContact O-N 2.61Å; T229-E232 PolarHBondContact OG1-N 2.89Å; T229-E232 PolarHBondContact OG1-OE2 2.86Å; T229-L233 PolarHBondContact O-N 3.1Å; T229-L233 VanDerWaalsContact O-N 3.07Å
230	V	80.7	Confident	77.9	Confident	19 Å²	19	47.3 Å²	47.3	12%	0.115	25%	0.249	C	C	.	.	H	α-helix	trans	-59.5	-27.3	176.5	-172.7	0	0	0	0	111.8	E234 T284 D287	V230-E234 WeakPolarHBondContact O-CB 3.2Å; V230-E234 WeakPolarHBondContact O-CG 3.3Å; V230-E234 PolarHBondContact O-N 3.42Å; V230-T284 HydrophobicContact CG2-CG2 3.65Å; V230-D287 HydrophobicContact CG1-CB 4.33Å; V230-D287 WeakPolarHBondContact CG2-O 3.36Å
231	K	82.6	Confident	75.6	Confident	164 Å²	164	50 Å²	50	71%	0.713	26%	0.26	S	S	*	.	H	α-helix	trans	-65	-47.4	172.2	-68.3	177.2	-177.9	170.4	0	111.9	T229 L233 E234 T235	T229-K231 PolarHBondContact O-N 3.2Å; T229-K231 VanDerWaalsContact O-N 3.13Å; K231-L233 VanDerWaalsContact C-N 3.35Å; K231-L233 PolarHBondContact O-N 2.88Å; K231-E234 CarbonylContact O-C 3.59Å; K231-E234 PolarHBondContact O-N 2.88Å; K231-T235 WeakPolarHBondContact O-CB 3.39Å; K231-T235 PolarHBondContact O-N 2.91Å; K231-T235 PolarHBondContact O-OG1 3.37Å
232	E	83.8	Confident	73.3	Confident	46 Å²	46	55.3 Å²	55.3	22%	0.215	29%	0.289	C	S	.	.	H	α-helix	trans	-63.3	-41.7	176.8	-73.9	135.5	173.4	0	0	111.5	P131 H226 P228 T229 E234 T235 E236 F237	P131-E232 HydrophobicContact CG-CG 4.41Å; H226-E232 IonicContact NE2-OE1 3.04Å; P228-E232 HydrophobicContact CB-CB 4.48Å; T229-E232 WeakPolarHBondContact CA-OE2 3.33Å; T229-E232 VanDerWaalsContact CB-OE2 3.3Å; T229-E232 WeakPolarHBondContact CB-OE2 3.44Å; T229-E232 WeakPolarHBondContact CG2-OE2 3.38Å; T229-E232 PolarHBondContact N-OE2 3.43Å; T229-E232 PolarHBondContact O-N 2.61Å; T229-E232 PolarHBondContact OG1-N 2.89Å; T229-E232 PolarHBondContact OG1-OE2 2.86Å; E232-E234 VanDerWaalsContact C-N 3.29Å; E232-E234 PolarHBondContact O-N 3.22Å; E232-T235 PolarHBondContact O-N 2.91Å; E232-E236 HydrophobicContact CB-CG 4.35Å; E232-E236 HydrophobicContact CG-CG 4.19Å; E232-E236 WeakPolarHBondContact O-CA 3.4Å; E232-E236 WeakPolarHBondContact O-CB 3.21Å; E232-E236 PolarHBondContact O-N 3.43Å; E232-F237 WeakPolarHBondContact O-CD2 3.4Å; E232-F237 PolarHBondContact O-N 2.63Å; E232-F237 VanDerWaalsContact O-N 3.09Å
233	L	79.1	Confident	71.1	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-57.1	-40.4	172.7	-65.5	172.6	0	0	0	112.1	P228 T229 K231 F237 W282 T284 L289 W335	P228-L233 HydrophobicContact CB-CD2 4.09Å; P228-L233 HydrophobicContact CB-CG 4.09Å; P228-L233 HydrophobicContact CG-CD1 4.43Å; P228-L233 HydrophobicContact CG-CD2 3.9Å; P228-L233 HydrophobicContact CG-CG 4.2Å; T229-L233 PolarHBondContact O-N 3.1Å; T229-L233 VanDerWaalsContact O-N 3.07Å; K231-L233 VanDerWaalsContact C-N 3.35Å; K231-L233 PolarHBondContact O-N 2.88Å; L233-F237 HydrophobicContact CD2-CD2 3.91Å; L233-F237 HydrophobicContact CD2-CE2 4.21Å; L233-W282 HydrophobicContact CD1-CB 4.24Å; L233-W282 HydrophobicContact CD2-CG 4.49Å; L233-T284 HydrophobicContact CD1-CG2 3.95Å; L233-L289 HydrophobicContact CD1-CD1 4.35Å; L233-W335 HydrophobicContact CB-CD2 3.91Å; L233-W335 HydrophobicContact CB-CE3 4.07Å; L233-W335 HydrophobicContact CB-CG 4.4Å; L233-W335 HydrophobicContact CB-CH2 4.43Å; L233-W335 HydrophobicContact CB-CZ2 4.25Å; L233-W335 HydrophobicContact CB-CZ3 4.33Å; L233-W335 HydrophobicContact CD1-CD2 4.32Å; L233-W335 HydrophobicContact CD1-CG 4Å; L233-W335 HydrophobicContact CD2-CB 4.19Å; L233-W335 HydrophobicContact CD2-CD2 4.46Å; L233-W335 HydrophobicContact CD2-CG 4.23Å; L233-W335 HydrophobicContact CG-CD2 4.46Å; L233-W335 HydrophobicContact CG-CG 4.44Å; L233-W335 WeakPolarHBondContact O-CZ3 3.48Å
234	E	77.7	Confident	68.7	Low	76 Å²	76	71.4 Å²	71.4	36%	0.355	37%	0.366	S	S	.	.	H	α-helix	trans	-83.5	-25.3	179.6	-76	-170.8	171.1	0	0	115.4	V230 K231 E232 K238 K333 W335	V230-E234 WeakPolarHBondContact O-CB 3.2Å; V230-E234 WeakPolarHBondContact O-CG 3.3Å; V230-E234 PolarHBondContact O-N 3.42Å; K231-E234 CarbonylContact O-C 3.59Å; K231-E234 PolarHBondContact O-N 2.88Å; E232-E234 VanDerWaalsContact C-N 3.29Å; E232-E234 PolarHBondContact O-N 3.22Å; E234-K238 WeakPolarHBondContact O-CB 3.28Å; E234-K238 WeakPolarHBondContact O-CD 3.16Å; E234-K333 IonicContact OE1-NZ 2.62Å; E234-K333 PolarHBondContact OE1-NZ 2.91Å; E234-W335 HydrophobicContact CG-CH2 3.55Å; E234-W335 HydrophobicContact CG-CZ2 3.84Å
235	T	73.5	Confident	66.2	Low	79 Å²	79	76.7 Å²	76.7	49%	0.485	38%	0.384	S	S	.	.	H	α-helix	trans	-115.6	-43	-174.9	67.4	0	0	0	0	115	K231 E232 N239	K231-T235 WeakPolarHBondContact O-CB 3.39Å; K231-T235 PolarHBondContact O-N 2.91Å; K231-T235 PolarHBondContact O-OG1 3.37Å; E232-T235 PolarHBondContact O-N 2.91Å; T235-N239 PolarHBondContact O-ND2 3.35Å
236	E	66.6	Low	63.4	Low	73 Å²	73	83.5 Å²	83.5	34%	0.341	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-55.1	-178.9	-63.9	-147	128	0	0	110.6	K134 E232 K238 N239	K134-E236 WeakPolarHBondContact CD-OE2 3.43Å; K134-E236 WeakPolarHBondContact CE-OE2 3.37Å; K134-E236 IonicContact NZ-OE1 2.73Å; K134-E236 PolarHBondContact NZ-OE1 3.17Å; K134-E236 IonicContact NZ-OE2 2.89Å; K134-E236 PolarHBondContact NZ-OE2 2.93Å; E232-E236 HydrophobicContact CB-CG 4.35Å; E232-E236 HydrophobicContact CG-CG 4.19Å; E232-E236 WeakPolarHBondContact O-CA 3.4Å; E232-E236 WeakPolarHBondContact O-CB 3.21Å; E232-E236 PolarHBondContact O-N 3.43Å; E236-K238 VanDerWaalsContact C-N 3.3Å; E236-K238 PolarHBondContact O-N 2.79Å; E236-N239 WeakPolarHBondContact O-CB 3.47Å; E236-N239 PolarHBondContact O-N 2.84Å; E236-N239 VanDerWaalsContact O-N 3.09Å
237	F	66.5	Low	60.6	Low	8 Å²	8	86.7 Å²	86.7	4%	0.035	45%	0.447	C	S	.	.	G	3₁₀ helix	trans	-62.9	-37.2	-178.9	-75.6	-72.4	0	0	0	112.3	P131 K134 P228 E232 L233 N239 C240 V337 V346	P131-F237 HydrophobicContact CB-CE2 4.19Å; P131-F237 HydrophobicContact CB-CZ 4.45Å; P131-F237 HydrophobicContact CG-CE2 4.36Å; K134-F237 HydrophobicContact CB-CE1 4.5Å; K134-F237 HydrophobicContact CB-CZ 4.18Å; P228-F237 HydrophobicContact CB-CE2 4.15Å; E232-F237 WeakPolarHBondContact O-CD2 3.4Å; E232-F237 PolarHBondContact O-N 2.63Å; E232-F237 VanDerWaalsContact O-N 3.09Å; L233-F237 HydrophobicContact CD2-CD2 3.91Å; L233-F237 HydrophobicContact CD2-CE2 4.21Å; F237-N239 VanDerWaalsContact C-N 3.28Å; F237-N239 PolarHBondContact O-N 2.82Å; F237-C240 WeakPolarHBondContact O-CB 3.32Å; F237-C240 PolarHBondContact O-N 3.35Å; F237-V337 HydrophobicContact CD1-CG1 3.89Å; F237-V337 HydrophobicContact CD1-CG2 3.76Å; F237-V337 HydrophobicContact CE1-CG1 3.8Å; F237-V337 HydrophobicContact CE1-CG2 4.03Å; F237-V337 HydrophobicContact CG-CG2 4.34Å; F237-V346 HydrophobicContact CB-CB 4.5Å; F237-V346 HydrophobicContact CB-CG1 4.02Å; F237-V346 HydrophobicContact CB-CG2 3.92Å; F237-V346 HydrophobicContact CD1-CG2 4.06Å; F237-V346 HydrophobicContact CG-CG2 4.5Å; F237-V346 VanDerWaalsContact O-CG2 3.32Å; F237-V346 WeakPolarHBondContact O-CG2 3.42Å
238	K	60.2	Low	58.2	Low	122 Å²	122	89.8 Å²	89.8	53%	0.53	47%	0.465	S	S	.	.	G	3₁₀ helix	trans	-69.2	-22	176.7	-152.9	170.8	-173.1	173.9	0	113.7	E234 E236 C240 I241	E234-K238 WeakPolarHBondContact O-CB 3.28Å; E234-K238 WeakPolarHBondContact O-CD 3.16Å; E236-K238 VanDerWaalsContact C-N 3.3Å; E236-K238 PolarHBondContact O-N 2.79Å; K238-C240 VanDerWaalsContact C-N 3.27Å; K238-C240 PolarHBondContact O-N 3.47Å; K238-I241 HydrophobicContact CG-CD1 4.03Å; K238-I241 WeakPolarHBondContact O-CG1 3.2Å; K238-I241 PolarHBondContact O-N 2.76Å
239	N	49.7	Very low	55.9	Low	121 Å²	121	99.4 Å²	99.4	65%	0.647	51%	0.51	S	S	*	.	G	3₁₀ helix	trans	-78.1	-7.1	174.9	-91.4	-51	0	0	0	113.6	T235 E236 F237 I241	T235-N239 PolarHBondContact O-ND2 3.35Å; E236-N239 WeakPolarHBondContact O-CB 3.47Å; E236-N239 PolarHBondContact O-N 2.84Å; E236-N239 VanDerWaalsContact O-N 3.09Å; F237-N239 VanDerWaalsContact C-N 3.28Å; F237-N239 PolarHBondContact O-N 2.82Å; N239-I241 PolarHBondContact O-N 3.1Å
240	C	44.2	Very low	53.8	Low	65 Å²	65	102.7 Å²	102.7	44%	0.439	53%	0.525	S	S	.	.	G	3₁₀ helix	trans	-77.7	-3.8	168.4	-62.1	0	0	0	0	113.4	F237 K238 D242 N344	F237-C240 WeakPolarHBondContact O-CB 3.32Å; F237-C240 PolarHBondContact O-N 3.35Å; K238-C240 VanDerWaalsContact C-N 3.27Å; K238-C240 PolarHBondContact O-N 3.47Å; C240-D242 PolarHBondContact O-N 3.04Å; C240-D242 VanDerWaalsContact O-N 3.16Å; C240-N344 VanDerWaalsContact CB-O 3.32Å; C240-N344 WeakPolarHBondContact CB-O 3.45Å
241	I	39.3	Very low	52.5	Low	94 Å²	94	105 Å²	105	48%	0.482	54%	0.537	S	S	.	.	S	Bend	trans	-69.4	112.2	172.2	-61	173.7	0	0	0	109.1	K238 N239 K243	K238-I241 HydrophobicContact CG-CD1 4.03Å; K238-I241 WeakPolarHBondContact O-CG1 3.2Å; K238-I241 PolarHBondContact O-N 2.76Å; N239-I241 PolarHBondContact O-N 3.1Å; I241-K243 PolarHBondContact O-N 2.97Å
242	D	41.1	Very low	51.2	Low	114 Å²	114	100.2 Å²	100.2	61%	0.61	52%	0.522	S	S	*	.			trans	-57.9	124.7	-177.7	-164.9	2.8	0	0	0	111.7	C240 N244 K245	C240-D242 PolarHBondContact O-N 3.04Å; C240-D242 VanDerWaalsContact O-N 3.16Å; D242-N244 PolarHBondContact O-N 2.94Å; D242-K245 PolarHBondContact O-N 2.62Å
243	K	42.7	Very low	50.3	Low	195 Å²	195	101.8 Å²	101.8	85%	0.848	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	2.9	-170.7	-68.2	178.4	-179.5	172	0	114.2	I241	I241-K243 PolarHBondContact O-N 2.97Å
244	N	37.7	Very low	49.9	Very low	152 Å²	152	104.8 Å²	104.8	81%	0.813	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.5	2.1	176.8	-84	-28.1	0	0	0	114.5	D242	D242-N244 PolarHBondContact O-N 2.94Å
245	K	36.7	Very low	49.8	Very low	147 Å²	147	105.9 Å²	105.9	64%	0.639	55%	0.553	S	S	*	*			trans	-115.7	85.7	-178.8	-158.6	175.2	-176.8	-175.8	0	113.3	D242 T247	D242-K245 PolarHBondContact O-N 2.62Å; K245-T247 PolarHBondContact O-N 3.47Å
246	V	28.3	Very low	50.2	Low	146 Å²	146	104.2 Å²	104.2	89%	0.885	54%	0.543	S	S	*	.			trans	-73.6	87.9	173.4	-179.1	0	0	0	0	110
247	T	30	Very low	51	Low	101 Å²	101	104.9 Å²	104.9	62%	0.62	55%	0.546	S	S	*	.			trans	-177.9	127.2	172.8	11.2	0	0	0	0	107.4	K245	K245-T247 PolarHBondContact O-N 3.47Å
248	V	33.9	Very low	51.7	Low	95 Å²	95	105.9 Å²	105.9	58%	0.576	55%	0.552	S	S	*	*			cis	-148.7	135.6	6.5	162.3	0	0	0	0	108.3	N250	V248-N250 VanDerWaalsContact C-N 3.31Å; V248-N250 HydrophobicContact CG1-CB 3.51Å
249	E	35.6	Very low	52.6	Low	201 Å²	201	104 Å²	104	94%	0.939	55%	0.545	S	S	*	.			trans	-83.1	-0.6	174.1	-77.6	-166.3	127.5	0	0	114.5	N251	E249-N251 VanDerWaalsContact C-N 3.35Å; E249-N251 PolarHBondContact O-N 3.29Å
250	N	39.4	Very low	54	Low	139 Å²	139	101.3 Å²	101.3	74%	0.743	53%	0.528	S	S	*	.			trans	-84.3	69.8	179.3	-54.5	-23.8	0	0	0	111.8	V248 P252	V248-N250 VanDerWaalsContact C-N 3.31Å; V248-N250 HydrophobicContact CG1-CB 3.51Å; N250-P252 WeakPolarHBondContact O-CD 3.26Å
251	N	53.9	Low	55.7	Low	67 Å²	67	104.3 Å²	104.3	36%	0.358	54%	0.54	S	S	.	.			trans	-65.1	120	162.1	-91.4	8.3	0	0	0	109.1	E249 V253 C348	E249-N251 VanDerWaalsContact C-N 3.35Å; E249-N251 PolarHBondContact O-N 3.29Å; N251-V253 PolarHBondContact O-N 3.49Å; N251-C348 VanDerWaalsContact CG-O 3.26Å; N251-C348 PolarHBondContact ND2-O 2.9Å; N251-C348 PolarHBondContact OD1-O 3.4Å
252	P	55.3	Low	57.7	Low	63 Å²	63	104.7 Å²	104.7	41%	0.409	54%	0.543	S	S	.	.			trans	-64.4	121.1	170.4	27	-32.2	0	0	0	108.7	N250 F254	N250-P252 WeakPolarHBondContact O-CD 3.26Å; P252-F254 HydrophobicContact CB-CE1 4.5Å; P252-F254 HydrophobicContact CB-CE2 4Å; P252-F254 HydrophobicContact CB-CZ 3.94Å; P252-F254 HydrophobicContact CG-CE2 3.73Å; P252-F254 HydrophobicContact CG-CZ 3.82Å
253	V	63.9	Low	59.6	Low	80 Å²	80	102.3 Å²	102.3	49%	0.485	54%	0.539	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	105.6	168.6	-178.8	0	0	0	0	107.1	N251 N350 R352	N251-V253 PolarHBondContact O-N 3.49Å; V253-N350 WeakPolarHBondContact CA-O 3.24Å; V253-N350 HydrophobicContact CG2-CB 4.34Å; V253-R352 HydrophobicContact CG1-CB 4.29Å
254	F	71.9	Confident	61.6	Low	62 Å²	62	93.4 Å²	93.4	27%	0.272	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	122.7	172.6	-58.4	-84.1	0	0	0	108.3	I19 P252 T349 N350 V351 R352	I19-F254 HydrophobicContact CD1-CE1 3.81Å; P252-F254 HydrophobicContact CB-CE1 4.5Å; P252-F254 HydrophobicContact CB-CE2 4Å; P252-F254 HydrophobicContact CB-CZ 3.94Å; P252-F254 HydrophobicContact CG-CE2 3.73Å; P252-F254 HydrophobicContact CG-CZ 3.82Å; F254-T349 HydrophobicContact CD2-CG2 4.06Å; F254-T349 HydrophobicContact CE2-CG2 3.65Å; F254-N350 PolarHBondContact N-O 3.38Å; F254-V351 HydrophobicContact CB-CG1 4.19Å; F254-V351 HydrophobicContact CB-CG2 4.23Å; F254-V351 HydrophobicContact CD2-CG2 4.24Å; F254-V351 CarbonylContact O-C 3.6Å; F254-V351 WeakPolarHBondContact O-CA 3.47Å; F254-V351 WeakPolarHBondContact O-CG1 3.49Å; F254-R352 PolarHBondContact O-N 3.27Å
255	E	75.8	Confident	63.9	Low	99 Å²	99	91.2 Å²	91.2	46%	0.463	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	127.7	167.4	-61	-150.6	157.1	0	0	109.3	R352 K354	E255-R352 WeakPolarHBondContact CA-O 3.3Å; E255-R352 HydrophobicContact CG-CB 4.34Å; E255-R352 VanDerWaalsContact OE1-CD 3.31Å; E255-R352 WeakPolarHBondContact OE1-CD 3.36Å; E255-R352 IonicContact OE1-CZ 2.61Å; E255-R352 IonicContact OE1-NE 3.95Å; E255-R352 IonicContact OE1-NH1 2.61Å; E255-R352 PolarHBondContact OE1-NH1 3.45Å; E255-K354 WeakPolarHBondContact OE2-CE 3.41Å; E255-K354 IonicContact OE2-NZ 3.07Å; E255-K354 PolarHBondContact OE2-NZ 3.21Å
256	V	82.2	Confident	66.3	Low	44 Å²	44	84.6 Å²	84.6	27%	0.267	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	131.2	176.8	-179	0	0	0	0	108	L258 L266 V351 R352 V353 K354	V256-L258 HydrophobicContact CG1-CD2 3.76Å; V256-L258 HydrophobicContact CG1-CG 4.15Å; V256-L266 HydrophobicContact CB-CD2 4.35Å; V256-L266 HydrophobicContact CG1-CD2 4.23Å; V256-L266 HydrophobicContact CG2-CD2 4.08Å; V256-V351 HydrophobicContact CG2-CG1 3.9Å; V256-R352 PolarHBondContact N-O 2.87Å; V256-V353 WeakPolarHBondContact O-CA 3.49Å; V256-K354 PolarHBondContact O-N 3.22Å
257	E	82.1	Confident	69.1	Low	88 Å²	88	82.4 Å²	82.4	41%	0.411	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	132.7	173.1	-55.5	-161.6	166.7	0	0	108.9	K354 R356	E257-K354 WeakPolarHBondContact CA-O 3.35Å; E257-K354 HydrophobicContact CG-CB 4.3Å; E257-K354 HydrophobicContact CG-CD 4.49Å; E257-K354 IonicContact OE1-NZ 2.63Å; E257-K354 PolarHBondContact OE1-NZ 2.95Å; E257-R356 IonicContact OE2-CZ 2.65Å; E257-R356 IonicContact OE2-NE 2.65Å; E257-R356 PolarHBondContact OE2-NE 3.16Å; E257-R356 IonicContact OE2-NH2 2.61Å; E257-R356 PolarHBondContact OE2-NH2 2.72Å
258	L	81.8	Confident	71.7	Confident	28 Å²	28	77.7 Å²	77.7	15%	0.147	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	153.4	-176.1	-57.2	174.8	0	0	0	109.4	V256 F264 T324 V353 K354 V355 R356	V256-L258 HydrophobicContact CG1-CD2 3.76Å; V256-L258 HydrophobicContact CG1-CG 4.15Å; L258-F264 HydrophobicContact CD1-CB 3.56Å; L258-F264 HydrophobicContact CD1-CD1 3.87Å; L258-F264 HydrophobicContact CD1-CD2 3.89Å; L258-F264 HydrophobicContact CD1-CE1 4.42Å; L258-F264 HydrophobicContact CD1-CE2 4.47Å; L258-F264 HydrophobicContact CD1-CG 3.55Å; L258-F264 HydrophobicContact CD2-CB 3.72Å; L258-F264 HydrophobicContact CG-CB 4.28Å; L258-T324 HydrophobicContact CB-CG2 4.07Å; L258-T324 HydrophobicContact CD1-CG2 3.68Å; L258-T324 HydrophobicContact CG-CG2 4.47Å; L258-V353 HydrophobicContact CD1-CG1 3.49Å; L258-V353 VanDerWaalsContact CD1-CG1 3.49Å; L258-V353 HydrophobicContact CG-CG1 4.1Å; L258-K354 PolarHBondContact N-O 2.85Å; L258-V355 CarbonylContact O-C 3.49Å; L258-V355 WeakPolarHBondContact O-CA 3.4Å; L258-R356 PolarHBondContact O-N 2.87Å
259	E	79.4	Confident	74	Confident	82 Å²	82	75 Å²	75	38%	0.383	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	163.4	166.2	-51.7	-159.5	-172.4	0	0	109.4	T324 R361	E259-T324 WeakPolarHBondContact O-CB 3.49Å; E259-T324 PolarHBondContact O-OG1 3.18Å; E259-R361 IonicContact OE1-CZ 2.64Å; E259-R361 IonicContact OE1-NH1 3.62Å; E259-R361 IonicContact OE1-NH2 2.66Å; E259-R361 PolarHBondContact OE1-NH2 2.6Å; E259-R361 IonicContact OE2-CZ 2.63Å; E259-R361 VanDerWaalsContact OE2-CZ 3.22Å; E259-R361 IonicContact OE2-NH1 2.68Å; E259-R361 PolarHBondContact OE2-NH1 2.96Å; E259-R361 IonicContact OE2-NH2 2.57Å; E259-R361 PolarHBondContact OE2-NH2 3.18Å
260	E	79.6	Confident	75.9	Confident	65 Å²	65	65.9 Å²	65.9	30%	0.304	35%	0.349	S	S	.	.	S	Bend	trans	-79.1	153	176.2	-163.8	159.9	-158.1	0	0	110.5	D262 T324 T326 V355 R356 Q357	E260-D262 PolarHBondContact O-N 2.98Å; E260-T324 WeakPolarHBondContact CA-OG1 3.29Å; E260-T326 WeakPolarHBondContact OE1-CG2 3.29Å; E260-V355 HydrophobicContact CB-CG1 4.07Å; E260-V355 HydrophobicContact CG-CG1 4.45Å; E260-R356 PolarHBondContact N-O 3.41Å; E260-Q357 WeakPolarHBondContact OE2-CG 3.36Å; E260-Q357 PolarHBondContact OE2-NE2 3.39Å
261	D	79.2	Confident	77.1	Confident	129 Å²	129	65 Å²	65	69%	0.69	34%	0.34	S	S	*	.	S	Bend	trans	61.3	-5.2	-172	-67.7	-37.6	0	0	0	117.7	S323 T324	D261-S323 PolarHBondContact O-OG 3.43Å; D261-T324 WeakPolarHBondContact CA-O 3.47Å; D261-T324 PolarHBondContact N-O 2.88Å; D261-T324 PolarHBondContact N-OG1 3.27Å; D261-T324 VanDerWaalsContact N-OG1 3.1Å
262	D	80.4	Confident	77.4	Confident	102 Å²	102	68.3 Å²	68.3	55%	0.545	36%	0.358	S	S	.	.			trans	-82.5	154.9	-176.7	-126	-13.4	0	0	0	113.9	E260 S323 T324	E260-D262 PolarHBondContact O-N 2.98Å; D262-S323 CarbonylContact O-C 3.51Å; D262-T324 PolarHBondContact N-OG1 2.82Å; D262-T324 PolarHBondContact O-N 2.62Å; D262-T324 PolarHBondContact O-OG1 2.87Å
263	A	82.9	Confident	77.2	Confident	64 Å²	64	67 Å²	67	53%	0.529	36%	0.355	S	S	.	.			trans	-88.9	111.8	-178.4	0	0	0	0	0	112.6	T322	A263-T322 WeakPolarHBondContact CB-O 3.36Å
264	F	84.6	Confident	76.6	Confident	7 Å²	7	66.6 Å²	66.6	3%	0.031	36%	0.356	C	S	.	.			trans	-101.2	154.3	-173.3	84.7	-94.2	0	0	0	115.8	L258 L266 Y302 S320 K321 T324 D328 Y332	L258-F264 HydrophobicContact CD1-CB 3.56Å; L258-F264 HydrophobicContact CD1-CD1 3.87Å; L258-F264 HydrophobicContact CD1-CD2 3.89Å; L258-F264 HydrophobicContact CD1-CE1 4.42Å; L258-F264 HydrophobicContact CD1-CE2 4.47Å; L258-F264 HydrophobicContact CD1-CG 3.55Å; L258-F264 HydrophobicContact CD2-CB 3.72Å; L258-F264 HydrophobicContact CG-CB 4.28Å; F264-L266 HydrophobicContact CD2-CD2 4.06Å; F264-L266 HydrophobicContact CD2-CG 3.97Å; F264-L266 HydrophobicContact CE2-CD1 4.08Å; F264-L266 HydrophobicContact CE2-CD2 4.25Å; F264-L266 HydrophobicContact CE2-CG 3.82Å; F264-Y302 HydrophobicContact CZ-CE1 4.22Å; F264-S320 WeakPolarHBondContact O-CA 3.45Å; F264-K321 HydrophobicContact CD1-CB 3.68Å; F264-K321 HydrophobicContact CD1-CD 4.29Å; F264-K321 HydrophobicContact CE1-CB 3.45Å; F264-K321 VanDerWaalsContact CE1-CB 3.45Å; F264-K321 HydrophobicContact CE1-CD 3.57Å; F264-K321 HydrophobicContact CE1-CG 4.11Å; F264-K321 HydrophobicContact CG-CB 4.46Å; F264-K321 HydrophobicContact CZ-CB 4.02Å; F264-K321 HydrophobicContact CZ-CD 4.36Å; F264-K321 PolarHBondContact N-O 3.46Å; F264-K321 PolarHBondContact O-N 2.92Å; F264-T324 HydrophobicContact CB-CG2 4.22Å; F264-T324 HydrophobicContact CD1-CG2 3.45Å; F264-T324 VanDerWaalsContact CD1-CG2 3.45Å; F264-T324 HydrophobicContact CE1-CG2 4.11Å; F264-T324 HydrophobicContact CG-CG2 4.21Å; F264-D328 HydrophobicContact CE1-CB 4.2Å; F264-Y332 HydrophobicContact CZ-CE1 4.32Å
265	Q	85.9	Confident	75.7	Confident	106 Å²	106	70.7 Å²	70.7	50%	0.495	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	116.7	179.3	-54	-179.5	23.1	0	0	110.6	L319	Q265-L319 CarbonylContact C-O 3.6Å; Q265-L319 VanDerWaalsContact CA-O 3.28Å; Q265-L319 WeakPolarHBondContact CA-O 3.29Å
266	L	86.4	Confident	74.6	Confident	8 Å²	8	70.3 Å²	70.3	4%	0.042	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	120	172.3	-52	-178.7	0	0	0	109	V256 F264 W283 K318 L319 Y332 V351 V353	V256-L266 HydrophobicContact CB-CD2 4.35Å; V256-L266 HydrophobicContact CG1-CD2 4.23Å; V256-L266 HydrophobicContact CG2-CD2 4.08Å; F264-L266 HydrophobicContact CD2-CD2 4.06Å; F264-L266 HydrophobicContact CD2-CG 3.97Å; F264-L266 HydrophobicContact CE2-CD1 4.08Å; F264-L266 HydrophobicContact CE2-CD2 4.25Å; F264-L266 HydrophobicContact CE2-CG 3.82Å; L266-W283 HydrophobicContact CB-CH2 3.93Å; L266-W283 HydrophobicContact CB-CZ3 4.28Å; L266-W283 HydrophobicContact CD1-CZ3 4.06Å; L266-K318 CarbonylContact O-C 3.57Å; L266-K318 VanDerWaalsContact O-CA 3.32Å; L266-K318 WeakPolarHBondContact O-CA 3.31Å; L266-L319 HydrophobicContact CB-CB 4.27Å; L266-L319 HydrophobicContact CD1-CD2 4.21Å; L266-L319 PolarHBondContact N-O 3.41Å; L266-L319 PolarHBondContact O-N 2.85Å; L266-Y332 HydrophobicContact CD1-CD1 4.22Å; L266-Y332 HydrophobicContact CD1-CD2 4.34Å; L266-Y332 HydrophobicContact CD1-CG 4.05Å; L266-V351 HydrophobicContact CD1-CB 4.36Å; L266-V351 HydrophobicContact CD1-CG1 4.07Å; L266-V351 HydrophobicContact CD2-CG1 4.22Å; L266-V353 HydrophobicContact CD1-CG2 4.15Å; L266-V353 HydrophobicContact CD2-CG2 4.24Å
267	K	86.5	Confident	73.6	Confident	100 Å²	100	75.5 Å²	75.5	44%	0.435	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	131.3	174.8	-56.6	-167.3	-171.5	-166.6	0	110.2	E307 M316 T317 K318	K267-E307 WeakPolarHBondContact CE-OE2 3.47Å; K267-E307 IonicContact NZ-OE1 2.58Å; K267-E307 IonicContact NZ-OE2 2.68Å; K267-E307 PolarHBondContact NZ-OE2 2.64Å; K267-M316 HydrophobicContact CD-CE 4.07Å; K267-T317 WeakPolarHBondContact CA-O 3.1Å; K267-K318 HydrophobicContact CG-CG 4.47Å
268	I	84.3	Confident	73.1	Confident	3 Å²	3	73.1 Å²	73.1	2%	0.015	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	130.5	178	-64.8	176.1	0	0	0	109.7	W283 M316 T317 C334 T349 V351	I268-W283 HydrophobicContact CD1-CH2 3.32Å; I268-W283 HydrophobicContact CD1-CZ2 4.09Å; I268-W283 HydrophobicContact CD1-CZ3 3.78Å; I268-W283 HydrophobicContact CG1-CH2 3.89Å; I268-M316 CarbonylContact O-C 3.59Å; I268-M316 VanDerWaalsContact O-CA 3.29Å; I268-M316 WeakPolarHBondContact O-CA 3.35Å; I268-T317 HydrophobicContact CB-CG2 4.03Å; I268-T317 PolarHBondContact N-O 3.02Å; I268-T317 PolarHBondContact O-N 3.27Å; I268-C334 HydrophobicContact CD1-CB 3.47Å; I268-C334 VanDerWaalsContact CD1-CB 3.47Å; I268-T349 HydrophobicContact CD1-CG2 4.01Å; I268-T349 HydrophobicContact CG2-CG2 3.86Å; I268-V351 HydrophobicContact CD1-CG2 3.66Å; I268-V351 HydrophobicContact CG1-CG2 4.28Å
269	P	82.2	Confident	72.9	Confident	38 Å²	38	72.4 Å²	72.4	25%	0.247	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	131.4	173.4	30.3	-33.9	0	0	0	111.5	Q271	P269-Q271 PolarHBondContact O-N 3.08Å
270	I	77.2	Confident	73.1	Confident	10 Å²	10	68.5 Å²	68.5	5%	0.051	37%	0.366	C	S	.	.			trans	-82.7	104.6	177.3	-53.9	-179.3	0	0	0	108.4	G273 V281 F306 M315 T317 T336	I270-G273 PolarHBondContact O-N 3.35Å; I270-V281 HydrophobicContact CD1-CG2 4.21Å; I270-F306 HydrophobicContact CD1-CD1 4.1Å; I270-F306 HydrophobicContact CD1-CE1 3.84Å; I270-M315 WeakPolarHBondContact CB-O 3.48Å; I270-M315 HydrophobicContact CD1-CG 4.01Å; I270-M315 WeakPolarHBondContact CG1-O 3.43Å; I270-M315 PolarHBondContact N-O 3.04Å; I270-T317 HydrophobicContact CG1-CG2 4.17Å; I270-T336 HydrophobicContact CB-CG2 4.38Å; I270-T336 HydrophobicContact CD1-CG2 4.28Å; I270-T336 HydrophobicContact CG1-CG2 3.89Å; I270-T336 HydrophobicContact CG2-CG2 3.94Å
271	Q	64.4	Low	73.5	Confident	121 Å²	121	65.4 Å²	65.4	57%	0.565	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	147.1	177.7	-62.9	-175.3	-2.4	0	0	110	P269 G273 Q347	P269-Q271 PolarHBondContact O-N 3.08Å; Q271-G273 PolarHBondContact O-N 2.77Å; Q271-Q347 VanDerWaalsContact N-OE1 3.12Å
272	N	59.3	Low	74	Confident	135 Å²	135	59.2 Å²	59.2	72%	0.722	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	63	18.4	-168	-50.2	-33	0	0	0	115.1	S274	N272-S274 PolarHBondContact O-N 3.25Å
273	G	51.7	Low	74.4	Confident	35 Å²	35	54.4 Å²	54.4	36%	0.361	29%	0.293	S	S	.	.			trans	-62.8	94.2	170.7	0	0	0	0	0	113	I270 Q271	I270-G273 PolarHBondContact O-N 3.35Å; Q271-G273 PolarHBondContact O-N 2.77Å
274	S	51.6	Low	74.6	Confident	73 Å²	73	51.3 Å²	51.3	51%	0.51	27%	0.268	S	S	.	.			trans	-54.6	152.5	154.9	-173.8	0	0	0	0	110.1	N272 N276 F279	N272-S274 PolarHBondContact O-N 3.25Å; S274-N276 PolarHBondContact O-N 3.33Å; S274-F279 WeakPolarHBondContact O-CE2 3.13Å; S274-F279 WeakPolarHBondContact O-CZ 3.23Å
275	Q	51.3	Low	74.7	Confident	147 Å²	147	52.1 Å²	52.1	69%	0.687	27%	0.271	S	S	*	.	S	Bend	trans	-69.9	-10.9	179.3	-68.8	-159.9	-47.2	0	0	113.9	N313	Q275-N313 PolarHBondContact NE2-ND2 3.49Å; Q275-N313 PolarHBondContact NE2-OD1 2.98Å
276	N	53.4	Low	74.5	Confident	92 Å²	92	53.3 Å²	53.3	49%	0.492	28%	0.277	S	S	.	.	S	Bend	trans	-76.8	137.7	169.2	-56.1	-5.5	0	0	0	109.7	S274 D278 F279	S274-N276 PolarHBondContact O-N 3.33Å; N276-D278 WeakPolarHBondContact CB-OD2 3.38Å; N276-D278 PolarHBondContact O-N 3.39Å; N276-F279 WeakPolarHBondContact O-CE2 3.46Å; N276-F279 WeakPolarHBondContact O-CZ 2.94Å
277	Q	60.6	Low	74	Confident	152 Å²	152	57.6 Å²	57.6	71%	0.71	30%	0.3	S	S	*	.			trans	-78.1	40.7	-174.8	-62.5	177.3	-19.2	0	0	113.6	F279 M315	Q277-F279 PolarHBondContact O-N 2.61Å; Q277-M315 HydrophobicContact CG-CE 4.35Å
278	D	72.6	Confident	73.8	Confident	38 Å²	38	59.8 Å²	59.8	20%	0.203	31%	0.312	C	S	.	.			trans	-87.8	48.8	-173	-61.3	-40.1	0	0	0	111.3	N276 Q339	N276-D278 WeakPolarHBondContact CB-OD2 3.38Å; N276-D278 PolarHBondContact O-N 3.39Å; D278-Q339 PolarHBondContact O-N 2.77Å
279	F	77.9	Confident	73.7	Confident	13 Å²	13	61.3 Å²	61.3	6%	0.057	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	148.8	-178.4	-39.7	-76.4	0	0	0	112.2	S274 N276 Q277 N293 V337	S274-F279 WeakPolarHBondContact O-CE2 3.13Å; S274-F279 WeakPolarHBondContact O-CZ 3.23Å; N276-F279 WeakPolarHBondContact O-CE2 3.46Å; N276-F279 WeakPolarHBondContact O-CZ 2.94Å; Q277-F279 PolarHBondContact O-N 2.61Å; F279-N293 PolarHBondContact O-ND2 3.18Å; F279-V337 CarbonylContact C-O 3.57Å; F279-V337 WeakPolarHBondContact CA-O 3.22Å
280	V	84.1	Confident	73.7	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	138.6	170.3	174.3	0	0	0	0	107.7	I132 N191 W282 H294 V337 Q339	I132-V280 HydrophobicContact CG2-CG1 4.24Å; N191-V280 HydrophobicContact CB-CG2 4.14Å; V280-W282 HydrophobicContact CG1-CZ2 4.21Å; V280-H294 WeakPolarHBondContact CG2-NE2 3.17Å; V280-V337 HydrophobicContact CB-CB 4.24Å; V280-V337 PolarHBondContact N-O 3.28Å; V280-V337 PolarHBondContact O-N 3.15Å; V280-Q339 VanDerWaalsContact CG2-CD 3.49Å; V280-Q339 HydrophobicContact CG2-CG 3.92Å
281	V	87.6	Confident	74	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	125.8	179.9	-174.2	0	0	0	0	111.9	I270 G292 N293 F306 T317 W335 T336	I270-V281 HydrophobicContact CD1-CG2 4.21Å; V281-G292 CarbonylContact O-C 3.5Å; V281-G292 WeakPolarHBondContact O-CA 3.2Å; V281-N293 PolarHBondContact N-OD1 3.13Å; V281-N293 PolarHBondContact O-N 2.9Å; V281-N293 VanDerWaalsContact O-N 3.09Å; V281-N293 PolarHBondContact O-OD1 3.42Å; V281-N293 VanDerWaalsContact O-OD1 3.12Å; V281-F306 HydrophobicContact CB-CE1 4.42Å; V281-F306 HydrophobicContact CB-CZ 4.46Å; V281-F306 HydrophobicContact CG2-CE1 3.68Å; V281-F306 HydrophobicContact CG2-CZ 3.95Å; V281-T317 HydrophobicContact CG1-CG2 4.17Å; V281-W335 VanDerWaalsContact CA-O 3.28Å; V281-W335 WeakPolarHBondContact CA-O 3.26Å; V281-T336 HydrophobicContact CG1-CG2 4.27Å; V281-T336 HydrophobicContact CG2-CG2 3.82Å
282	W	88.4	Confident	75	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	140.1	176.8	-62.4	108.6	0	0	0	111	I132 C227 P228 L233 V280 L289 H294 L295 W335	I132-W282 HydrophobicContact CB-CZ2 3.86Å; I132-W282 HydrophobicContact CG2-CZ2 3.89Å; I132-W282 PolarHBondContact O-NE1 3.4Å; C227-W282 HydrophobicContact CB-CH2 4.39Å; C227-W282 HydrophobicContact CB-CZ3 4.35Å; P228-W282 HydrophobicContact CG-CD2 3.86Å; P228-W282 HydrophobicContact CG-CG 3.87Å; P228-W282 HydrophobicContact CG-CZ2 4.3Å; P228-W282 VanDerWaalsContact CG-NE1 3.32Å; L233-W282 HydrophobicContact CD1-CB 4.24Å; L233-W282 HydrophobicContact CD2-CG 4.49Å; V280-W282 HydrophobicContact CG1-CZ2 4.21Å; W282-L289 HydrophobicContact CB-CD1 4.01Å; W282-L289 HydrophobicContact CD2-CD1 4.47Å; W282-L289 HydrophobicContact CE3-CD1 4.06Å; W282-L289 HydrophobicContact CE3-CD2 4.19Å; W282-L289 HydrophobicContact CG-CD1 4.48Å; W282-L289 HydrophobicContact CZ3-CD2 4.44Å; W282-H294 HydrophobicContact CH2-CB 4.42Å; W282-L295 HydrophobicContact CZ3-CD1 3.88Å; W282-L295 HydrophobicContact CZ3-CG 4.23Å; W282-W335 HydrophobicContact CB-CB 4.25Å; W282-W335 PolarHBondContact N-O 3.25Å; W282-W335 PolarHBondContact O-N 2.91Å
283	W	89.4	Confident	76	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	126	176.1	-73.5	89.1	0	0	0	110.1	L266 I268 L290 T291 T317 L319 C334	L266-W283 HydrophobicContact CB-CH2 3.93Å; L266-W283 HydrophobicContact CB-CZ3 4.28Å; L266-W283 HydrophobicContact CD1-CZ3 4.06Å; I268-W283 HydrophobicContact CD1-CH2 3.32Å; I268-W283 HydrophobicContact CD1-CZ2 4.09Å; I268-W283 HydrophobicContact CD1-CZ3 3.78Å; I268-W283 HydrophobicContact CG1-CH2 3.89Å; W283-L290 PolarHBondContact O-N 3Å; W283-T291 HydrophobicContact CB-CG2 4.13Å; W283-T291 PolarHBondContact N-O 3.37Å; W283-T291 PolarHBondContact O-N 3.5Å; W283-T317 HydrophobicContact CZ2-CG2 4.08Å; W283-T317 PolarHBondContact NE1-OG1 2.81Å; W283-L319 HydrophobicContact CB-CD1 4.19Å; W283-L319 HydrophobicContact CD2-CB 3.91Å; W283-L319 HydrophobicContact CD2-CD1 4.2Å; W283-L319 HydrophobicContact CD2-CD2 4.02Å; W283-L319 HydrophobicContact CD2-CG 4.28Å; W283-L319 HydrophobicContact CE3-CB 4.13Å; W283-L319 HydrophobicContact CE3-CD2 3.74Å; W283-L319 HydrophobicContact CE3-CG 4.42Å; W283-L319 HydrophobicContact CG-CB 4.49Å; W283-L319 HydrophobicContact CG-CD1 3.95Å; W283-L319 HydrophobicContact CG-CD2 4.41Å; W283-L319 HydrophobicContact CH2-CB 3.88Å; W283-L319 HydrophobicContact CZ2-CB 3.7Å; W283-L319 HydrophobicContact CZ3-CB 4.11Å; W283-L319 HydrophobicContact CZ3-CD2 4.11Å; W283-C334 HydrophobicContact CD2-CB 3.96Å; W283-C334 HydrophobicContact CE3-CB 3.79Å; W283-C334 HydrophobicContact CH2-CB 3.95Å; W283-C334 HydrophobicContact CZ2-CB 4.05Å; W283-C334 HydrophobicContact CZ3-CB 3.79Å
284	T	87.8	Confident	77.1	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	143.3	176.5	61.6	0	0	0	0	110.4	V230 L233 E288 L289 Y332 K333 W335	V230-T284 HydrophobicContact CG2-CG2 3.65Å; L233-T284 HydrophobicContact CD1-CG2 3.95Å; T284-E288 CarbonylContact C-O 3.57Å; T284-E288 WeakPolarHBondContact CA-O 3.42Å; T284-E288 WeakPolarHBondContact CB-O 3.39Å; T284-L289 HydrophobicContact CG2-CB 4.47Å; T284-L289 HydrophobicContact CG2-CD1 3.72Å; T284-Y332 CarbonylContact O-C 3.58Å; T284-Y332 VanDerWaalsContact O-CA 3.27Å; T284-Y332 WeakPolarHBondContact O-CA 3.29Å; T284-K333 PolarHBondContact N-O 2.9Å; T284-K333 PolarHBondContact O-N 2.89Å; T284-K333 WeakPolarHBondContact OG1-CB 3.21Å; T284-K333 PolarHBondContact OG1-O 3.4Å; T284-W335 PolarHBondContact OG1-NE1 2.98Å
285	H	86.7	Confident	78.2	Confident	23 Å²	23	47.3 Å²	47.3	11%	0.106	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	130.6	173	163.7	-101.6	0	0	0	108.2	D287 E288 L290 T327 S329 I331 Y332	H285-D287 PolarHBondContact O-N 3.09Å; H285-E288 PolarHBondContact N-O 2.95Å; H285-E288 PolarHBondContact O-N 3.34Å; H285-L290 HydrophobicContact CB-CD1 3.64Å; H285-L290 HydrophobicContact CB-CD2 4.17Å; H285-L290 HydrophobicContact CB-CG 3.94Å; H285-T327 PolarHBondContact CE1-O 2.58Å; H285-S329 PolarHBondContact NE2-O 3.37Å; H285-I331 WeakPolarHBondContact CA-O 3.43Å; H285-Y332 HydrophobicContact CB-CD1 3.94Å; H285-Y332 HydrophobicContact CB-CE1 3.97Å; H285-Y332 HydrophobicContact CB-CG 4.31Å; H285-Y332 AromaticContact CD2-CD2 3.77Å; H285-Y332 AromaticContact CD2-CE2 3.4Å; H285-Y332 WeakPolarHBondContact CD2-CE2 3.26Å; H285-Y332 AromaticContact CD2-CZ 3.59Å
286	E	81.4	Confident	78.7	Confident	132 Å²	132	45 Å²	45	62%	0.617	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	44	39.5	-177.5	-52.7	-151.5	148.6	0	0	114.9	E288 G330 I331	E286-E288 VanDerWaalsContact C-N 3.35Å; E286-G330 WeakPolarHBondContact OE1-CA 3.23Å; E286-I331 PolarHBondContact N-O 3.22Å
287	D	75.1	Confident	79.1	Confident	97 Å²	97	42.9 Å²	42.9	52%	0.519	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.8	17.1	-179.7	-56.8	-33.5	0	0	0	116.7	V230 H285 K333	V230-D287 HydrophobicContact CG1-CB 4.33Å; V230-D287 WeakPolarHBondContact CG2-O 3.36Å; H285-D287 PolarHBondContact O-N 3.09Å; D287-K333 WeakPolarHBondContact OD1-CE 3.48Å; D287-K333 IonicContact OD1-NZ 3.34Å; D287-K333 PolarHBondContact OD1-NZ 3.46Å; D287-K333 IonicContact OD2-NZ 2.6Å
288	E	83.3	Confident	78.8	Confident	146 Å²	146	42.9 Å²	42.9	68%	0.682	23%	0.225	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-101.5	148.9	162.5	-176	164.8	-172	0	0	112	T284 H285 E286	T284-E288 CarbonylContact C-O 3.57Å; T284-E288 WeakPolarHBondContact CA-O 3.42Å; T284-E288 WeakPolarHBondContact CB-O 3.39Å; H285-E288 PolarHBondContact N-O 2.95Å; H285-E288 PolarHBondContact O-N 3.34Å; E286-E288 VanDerWaalsContact C-N 3.35Å
289	L	82.2	Confident	78.2	Confident	35 Å²	35	49.9 Å²	49.9	18%	0.183	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	102.5	-179.9	-176.3	78.2	0	0	0	111.9	C227 L233 W282 T284	C227-L289 HydrophobicContact CB-CD2 3.67Å; L233-L289 HydrophobicContact CD1-CD1 4.35Å; W282-L289 HydrophobicContact CB-CD1 4.01Å; W282-L289 HydrophobicContact CD2-CD1 4.47Å; W282-L289 HydrophobicContact CE3-CD1 4.06Å; W282-L289 HydrophobicContact CE3-CD2 4.19Å; W282-L289 HydrophobicContact CG-CD1 4.48Å; W282-L289 HydrophobicContact CZ3-CD2 4.44Å; T284-L289 HydrophobicContact CG2-CB 4.47Å; T284-L289 HydrophobicContact CG2-CD1 3.72Å
290	L	82.7	Confident	77.6	Confident	22 Å²	22	54.4 Å²	54.4	12%	0.115	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	-57.9	-178.7	-60.5	-178.6	0	0	0	112.7	W283 H285 R300 Y302 L319 Y332	W283-L290 PolarHBondContact O-N 3Å; H285-L290 HydrophobicContact CB-CD1 3.64Å; H285-L290 HydrophobicContact CB-CD2 4.17Å; H285-L290 HydrophobicContact CB-CG 3.94Å; L290-R300 PolarHBondContact O-NH1 3.48Å; L290-Y302 HydrophobicContact CB-CD2 4.26Å; L290-Y302 HydrophobicContact CB-CG 4.32Å; L290-Y302 HydrophobicContact CD1-CD1 3.94Å; L290-Y302 HydrophobicContact CD1-CD2 4.4Å; L290-Y302 HydrophobicContact CD1-CE1 3.9Å; L290-Y302 HydrophobicContact CD1-CE2 4.39Å; L290-Y302 HydrophobicContact CD1-CG 4.19Å; L290-Y302 HydrophobicContact CD2-CD2 4.13Å; L290-Y302 HydrophobicContact CD2-CE2 3.81Å; L290-L319 HydrophobicContact CD1-CD2 4.49Å; L290-Y332 HydrophobicContact CD1-CD1 3.84Å; L290-Y332 HydrophobicContact CD1-CE1 3.54Å
291	T	83.6	Confident	77.3	Confident	4 Å²	4	59.4 Å²	59.4	3%	0.025	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.3	173.4	-165.7	-166.5	0	0	0	0	111.8	W283 Y302 C304 L319	W283-T291 HydrophobicContact CB-CG2 4.13Å; W283-T291 PolarHBondContact N-O 3.37Å; W283-T291 PolarHBondContact O-N 3.5Å; T291-Y302 WeakPolarHBondContact CB-O 3.36Å; T291-Y302 PolarHBondContact OG1-O 3.07Å; T291-C304 HydrophobicContact CG2-CB 4Å; T291-L319 HydrophobicContact CG2-CD1 3.31Å
292	G	83.5	Confident	77.1	Confident	1 Å²	1	60.8 Å²	60.8	1%	0.01	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-173	165.6	178.3	0	0	0	0	0	111.8	V281 H294 L295	V281-G292 CarbonylContact O-C 3.5Å; V281-G292 WeakPolarHBondContact O-CA 3.2Å; G292-H294 PolarHBondContact O-N 2.94Å; G292-H294 VanDerWaalsContact O-N 3.12Å; G292-L295 PolarHBondContact O-N 3.26Å; G292-L295 VanDerWaalsContact O-N 3.12Å
293	N	81.6	Confident	76.9	Confident	38 Å²	38	63.6 Å²	63.6	20%	0.203	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-11.6	-169.9	67	-51.3	0	0	0	115.6	F279 V281 F306	F279-N293 PolarHBondContact O-ND2 3.18Å; V281-N293 PolarHBondContact N-OD1 3.13Å; V281-N293 PolarHBondContact O-N 2.9Å; V281-N293 VanDerWaalsContact O-N 3.09Å; V281-N293 PolarHBondContact O-OD1 3.42Å; V281-N293 VanDerWaalsContact O-OD1 3.12Å; N293-F306 HydrophobicContact CB-CE2 3.56Å; N293-F306 HydrophobicContact CB-CZ 3.62Å
294	H	75	Confident	76.7	Confident	27 Å²	27	64.1 Å²	64.1	13%	0.125	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-5.8	176.1	-56.4	-71.1	0	0	0	113.7	N191 V280 W282 G292	N191-H294 PolarHBondContact O-CE1 3.01Å; N191-H294 PolarHBondContact O-ND1 2.76Å; V280-H294 WeakPolarHBondContact CG2-NE2 3.17Å; W282-H294 HydrophobicContact CH2-CB 4.42Å; G292-H294 PolarHBondContact O-N 2.94Å; G292-H294 VanDerWaalsContact O-N 3.12Å
295	L	74.1	Confident	76.5	Confident	27 Å²	27	66 Å²	66	14%	0.141	33%	0.334	C	S	.	.	S	Bend	trans	-89.2	136.8	177.1	-71.8	165.2	0	0	0	110.2	P195 W282 G292 S297	P195-L295 HydrophobicContact CG-CD2 3.95Å; W282-L295 HydrophobicContact CZ3-CD1 3.88Å; W282-L295 HydrophobicContact CZ3-CG 4.23Å; G292-L295 PolarHBondContact O-N 3.26Å; G292-L295 VanDerWaalsContact O-N 3.12Å; L295-S297 PolarHBondContact O-N 2.85Å
296	T	62.8	Low	76.3	Confident	97 Å²	97	68.7 Å²	68.7	60%	0.595	35%	0.345	S	S	*	.			trans	-73.5	116.6	176	46.3	0	0	0	0	110.5	N298	T296-N298 PolarHBondContact O-N 3.46Å
297	S	61	Low	76.3	Confident	48 Å²	48	65.9 Å²	65.9	34%	0.336	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-0.3	-172.4	-42.2	0	0	0	0	117	L295 E299 N303	L295-S297 PolarHBondContact O-N 2.85Å; S297-E299 PolarHBondContact O-N 2.81Å; S297-N303 VanDerWaalsContact CB-OD1 3.23Å; S297-N303 WeakPolarHBondContact CB-OD1 3.48Å; S297-N303 PolarHBondContact OG-OD1 3.12Å
298	N	55.4	Low	76.4	Confident	152 Å²	152	65.5 Å²	65.5	81%	0.813	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-16.9	-164.6	-63.1	-2.7	0	0	0	114.4	T296	T296-N298 PolarHBondContact O-N 3.46Å
299	E	58.5	Low	76	Confident	185 Å²	185	60.4 Å²	60.4	86%	0.864	31%	0.307	S	S	*	.	S	Bend	trans	-128.7	1.4	-171.2	-61.9	-176.4	161.8	0	0	113.7	S297	S297-E299 PolarHBondContact O-N 2.81Å
300	R	65.3	Low	75.7	Confident	108 Å²	108	68.5 Å²	68.5	41%	0.408	34%	0.341	S	S	.	.			trans	-114.4	139.2	-179.6	-65	-168.4	-176.9	-146.3	0.9	111.2	L290 Y302	L290-R300 PolarHBondContact O-NH1 3.48Å; R300-Y302 PolarHBondContact O-N 2.9Å
301	E	78.4	Confident	75.3	Confident	106 Å²	106	75.2 Å²	75.2	50%	0.495	37%	0.372	S	S	.	.	S	Bend	trans	-63.2	-27	177.4	-152.4	-178.7	-170.9	0	0	112.7	K321	E301-K321 HydrophobicContact CG-CD 4.46Å; E301-K321 HydrophobicContact CG-CG 4.04Å; E301-K321 WeakPolarHBondContact OE1-CE 3.49Å; E301-K321 IonicContact OE1-NZ 3.22Å; E301-K321 WeakPolarHBondContact OE2-CE 3.41Å; E301-K321 IonicContact OE2-NZ 3.01Å; E301-K321 PolarHBondContact OE2-NZ 2.95Å
302	Y	83.1	Confident	74.7	Confident	29 Å²	29	77.6 Å²	77.6	11%	0.114	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	115.2	176.9	-54.9	-92.1	0	0	0	111.8	F264 L290 T291 R300 L319 S320 K321 D328 Y332	F264-Y302 HydrophobicContact CZ-CE1 4.22Å; L290-Y302 HydrophobicContact CB-CD2 4.26Å; L290-Y302 HydrophobicContact CB-CG 4.32Å; L290-Y302 HydrophobicContact CD1-CD1 3.94Å; L290-Y302 HydrophobicContact CD1-CD2 4.4Å; L290-Y302 HydrophobicContact CD1-CE1 3.9Å; L290-Y302 HydrophobicContact CD1-CE2 4.39Å; L290-Y302 HydrophobicContact CD1-CG 4.19Å; L290-Y302 HydrophobicContact CD2-CD2 4.13Å; L290-Y302 HydrophobicContact CD2-CE2 3.81Å; T291-Y302 WeakPolarHBondContact CB-O 3.36Å; T291-Y302 PolarHBondContact OG1-O 3.07Å; R300-Y302 PolarHBondContact O-N 2.9Å; Y302-L319 HydrophobicContact CD1-CD2 4.44Å; Y302-S320 WeakPolarHBondContact CA-O 3.43Å; Y302-K321 HydrophobicContact CD1-CB 4.15Å; Y302-K321 HydrophobicContact CD1-CD 4.16Å; Y302-K321 HydrophobicContact CD1-CG 4.11Å; Y302-K321 HydrophobicContact CE1-CB 4.35Å; Y302-K321 HydrophobicContact CE1-CD 3.59Å; Y302-K321 HydrophobicContact CE1-CG 4.07Å; Y302-K321 PolarHBondContact OH-NZ 3.5Å; Y302-D328 PolarHBondContact OH-OD1 3.42Å; Y302-Y332 HydrophobicContact CE1-CE1 4.34Å
303	N	83.9	Confident	74.1	Confident	59 Å²	59	82.1 Å²	82.1	32%	0.316	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	127	176.5	-172.5	4.3	0	0	0	111	S297 L319 S320	S297-N303 VanDerWaalsContact CB-OD1 3.23Å; S297-N303 WeakPolarHBondContact CB-OD1 3.48Å; S297-N303 PolarHBondContact OG-OD1 3.12Å; N303-L319 CarbonylContact O-C 3.57Å; N303-S320 PolarHBondContact N-O 3.12Å; N303-S320 PolarHBondContact O-N 2.98Å; N303-S320 PolarHBondContact O-OG 3.5Å
304	C	85.3	Confident	73.8	Confident	11 Å²	11	85 Å²	85	7%	0.074	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	124.7	174.1	-175.7	0	0	0	0	110.2	T291	T291-C304 HydrophobicContact CG2-CB 4Å
305	S	83.7	Confident	74	Confident	38 Å²	38	85.2 Å²	85.2	27%	0.266	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	164.1	-177.5	57.9	0	0	0	0	111.7	K318	S305-K318 PolarHBondContact N-O 3.39Å; S305-K318 PolarHBondContact O-N 3.37Å; S305-K318 PolarHBondContact OG-O 2.71Å
306	F	82.9	Confident	74.4	Confident	80 Å²	80	85.1 Å²	85.1	35%	0.351	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	139.5	175	-63	-68.9	0	0	0	111.2	I270 V281 N293 M315 M316	I270-F306 HydrophobicContact CD1-CD1 4.1Å; I270-F306 HydrophobicContact CD1-CE1 3.84Å; V281-F306 HydrophobicContact CB-CE1 4.42Å; V281-F306 HydrophobicContact CB-CZ 4.46Å; V281-F306 HydrophobicContact CG2-CE1 3.68Å; V281-F306 HydrophobicContact CG2-CZ 3.95Å; N293-F306 HydrophobicContact CB-CE2 3.56Å; N293-F306 HydrophobicContact CB-CZ 3.62Å; F306-M315 HydrophobicContact CB-CE 3.58Å; F306-M315 HydrophobicContact CB-SD 4.15Å; F306-M315 HydrophobicContact CD1-CE 4.08Å; F306-M315 HydrophobicContact CD1-CG 4.48Å; F306-M315 HydrophobicContact CD2-CE 4.37Å; F306-M315 HydrophobicContact CG-CE 3.78Å; F306-M316 WeakPolarHBondContact CA-O 3.39Å
307	E	81.2	Confident	75.5	Confident	73 Å²	73	80.5 Å²	80.5	34%	0.341	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	121	176.9	-174.9	172.1	-155.6	0	0	109.2	K267 N309 M316	K267-E307 WeakPolarHBondContact CE-OE2 3.47Å; K267-E307 IonicContact NZ-OE1 2.58Å; K267-E307 IonicContact NZ-OE2 2.68Å; K267-E307 PolarHBondContact NZ-OE2 2.64Å; E307-N309 PolarHBondContact O-N 3.46Å; E307-M316 PolarHBondContact N-O 2.98Å; E307-M316 WeakPolarHBondContact O-CA 3.34Å; E307-M316 WeakPolarHBondContact O-CB 3.5Å; E307-M316 PolarHBondContact O-N 2.88Å
308	L	76.8	Confident	76.7	Confident	89 Å²	89	80.2 Å²	80.2	47%	0.466	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	119.5	172.6	-173.1	74.9	0	0	0	108.7	K310	L308-K310 PolarHBondContact O-N 3.43Å; L308-K310 VanDerWaalsContact O-N 3.11Å
309	N	75.8	Confident	78.3	Confident	40 Å²	40	73 Å²	73	21%	0.214	35%	0.351	C	S	.	.			trans	-66.7	112.4	175.8	-172.7	-25.8	0	0	0	109.4	E307 Q311 S312 N313 E314 M316	E307-N309 PolarHBondContact O-N 3.46Å; N309-Q311 PolarHBondContact O-N 2.9Å; N309-Q311 WeakPolarHBondContact OD1-CB 3.39Å; N309-Q311 PolarHBondContact OD1-N 2.94Å; N309-S312 WeakPolarHBondContact CB-OG 3.09Å; N309-S312 PolarHBondContact ND2-OG 3.35Å; N309-S312 PolarHBondContact OD1-N 3.32Å; N309-N313 VanDerWaalsContact O-CA 3.24Å; N309-N313 WeakPolarHBondContact O-CA 3.15Å; N309-N313 PolarHBondContact O-N 3.27Å; N309-E314 PolarHBondContact N-O 2.85Å; N309-M316 HydrophobicContact CB-CE 3.93Å; N309-M316 HydrophobicContact CB-CG 4.21Å; N309-M316 HydrophobicContact CB-SD 4.07Å
310	K	75.7	Confident	79.6	Confident	204 Å²	204	65.2 Å²	65.2	89%	0.887	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-17.6	-178.1	-64	172.8	-175.1	164.2	0	113.7	L308	L308-K310 PolarHBondContact O-N 3.43Å; L308-K310 VanDerWaalsContact O-N 3.11Å
311	Q	73.5	Confident	80.6	Confident	164 Å²	164	60.7 Å²	60.7	77%	0.766	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	-49.6	-179.2	-58.4	179	7.8	0	0	111.8	N309	N309-Q311 PolarHBondContact O-N 2.9Å; N309-Q311 WeakPolarHBondContact OD1-CB 3.39Å; N309-Q311 PolarHBondContact OD1-N 2.94Å
312	S	72.1	Confident	80.8	Confident	54 Å²	54	60.9 Å²	60.9	38%	0.378	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-12.4	-178.5	65	0	0	0	0	114.8	N309 E314	N309-S312 WeakPolarHBondContact CB-OG 3.09Å; N309-S312 PolarHBondContact ND2-OG 3.35Å; N309-S312 PolarHBondContact OD1-N 3.32Å; S312-E314 WeakPolarHBondContact CB-OE2 3.43Å; S312-E314 PolarHBondContact O-N 2.86Å; S312-E314 WeakPolarHBondContact OG-CB 3.42Å; S312-E314 WeakPolarHBondContact OG-CG 3.37Å; S312-E314 PolarHBondContact OG-N 3.06Å; S312-E314 PolarHBondContact OG-OE2 3.33Å
313	N	71	Confident	80.7	Confident	95 Å²	95	61.4 Å²	61.4	51%	0.508	32%	0.317	S	S	.	.			trans	60.6	21.5	-171.9	-172.4	53.5	0	0	0	113.6	Q275 N309	Q275-N313 PolarHBondContact NE2-ND2 3.49Å; Q275-N313 PolarHBondContact NE2-OD1 2.98Å; N309-N313 VanDerWaalsContact O-CA 3.24Å; N309-N313 WeakPolarHBondContact O-CA 3.15Å; N309-N313 PolarHBondContact O-N 3.27Å
314	E	74.1	Confident	80.4	Confident	100 Å²	100	58.7 Å²	58.7	47%	0.467	30%	0.303	S	S	.	.			trans	-91.5	147.4	175.5	-62.5	166.3	136	0	0	111.3	N309 S312	N309-E314 PolarHBondContact N-O 2.85Å; S312-E314 WeakPolarHBondContact CB-OE2 3.43Å; S312-E314 PolarHBondContact O-N 2.86Å; S312-E314 WeakPolarHBondContact OG-CB 3.42Å; S312-E314 WeakPolarHBondContact OG-CG 3.37Å; S312-E314 PolarHBondContact OG-N 3.06Å; S312-E314 PolarHBondContact OG-OE2 3.33Å
315	M	79	Confident	80.1	Confident	31 Å²	31	59.1 Å²	59.1	15%	0.153	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	123.9	173.5	-169.5	66.7	145.3	0	0	109.6	I270 Q277 F306	I270-M315 WeakPolarHBondContact CB-O 3.48Å; I270-M315 HydrophobicContact CD1-CG 4.01Å; I270-M315 WeakPolarHBondContact CG1-O 3.43Å; I270-M315 PolarHBondContact N-O 3.04Å; Q277-M315 HydrophobicContact CG-CE 4.35Å; F306-M315 HydrophobicContact CB-CE 3.58Å; F306-M315 HydrophobicContact CB-SD 4.15Å; F306-M315 HydrophobicContact CD1-CE 4.08Å; F306-M315 HydrophobicContact CD1-CG 4.48Å; F306-M315 HydrophobicContact CD2-CE 4.37Å; F306-M315 HydrophobicContact CG-CE 3.78Å
316	M	82.9	Confident	79.8	Confident	25 Å²	25	60.7 Å²	60.7	12%	0.123	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	141.7	172.9	-56.5	-169.5	-62.5	0	0	110.6	K267 I268 F306 E307 N309	K267-M316 HydrophobicContact CD-CE 4.07Å; I268-M316 CarbonylContact O-C 3.59Å; I268-M316 VanDerWaalsContact O-CA 3.29Å; I268-M316 WeakPolarHBondContact O-CA 3.35Å; F306-M316 WeakPolarHBondContact CA-O 3.39Å; E307-M316 PolarHBondContact N-O 2.98Å; E307-M316 WeakPolarHBondContact O-CA 3.34Å; E307-M316 WeakPolarHBondContact O-CB 3.5Å; E307-M316 PolarHBondContact O-N 2.88Å; N309-M316 HydrophobicContact CB-CE 3.93Å; N309-M316 HydrophobicContact CB-CG 4.21Å; N309-M316 HydrophobicContact CB-SD 4.07Å
317	T	86.3	Confident	79.7	Confident	0 Å²	0	62 Å²	62	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	140.8	163.7	176.9	0	0	0	0	109.4	K267 I268 I270 V281 W283 C334	K267-T317 WeakPolarHBondContact CA-O 3.1Å; I268-T317 HydrophobicContact CB-CG2 4.03Å; I268-T317 PolarHBondContact N-O 3.02Å; I268-T317 PolarHBondContact O-N 3.27Å; I270-T317 HydrophobicContact CG1-CG2 4.17Å; V281-T317 HydrophobicContact CG1-CG2 4.17Å; W283-T317 HydrophobicContact CZ2-CG2 4.08Å; W283-T317 PolarHBondContact NE1-OG1 2.81Å; T317-C334 VanDerWaalsContact CG2-SG 3.6Å
318	K	86	Confident	79.8	Confident	41 Å²	41	58.6 Å²	58.6	18%	0.178	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	110	-174.6	170.2	177	163.1	168.2	0	109.5	L266 K267 S305	L266-K318 CarbonylContact O-C 3.57Å; L266-K318 VanDerWaalsContact O-CA 3.32Å; L266-K318 WeakPolarHBondContact O-CA 3.31Å; K267-K318 HydrophobicContact CG-CG 4.47Å; S305-K318 PolarHBondContact N-O 3.39Å; S305-K318 PolarHBondContact O-N 3.37Å; S305-K318 PolarHBondContact OG-O 2.71Å
319	L	88.1	Confident	80.2	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	139	162.9	-170.5	66.7	0	0	0	108.5	Q265 L266 W283 L290 T291 Y302 N303 Y332	Q265-L319 CarbonylContact C-O 3.6Å; Q265-L319 VanDerWaalsContact CA-O 3.28Å; Q265-L319 WeakPolarHBondContact CA-O 3.29Å; L266-L319 HydrophobicContact CB-CB 4.27Å; L266-L319 HydrophobicContact CD1-CD2 4.21Å; L266-L319 PolarHBondContact N-O 3.41Å; L266-L319 PolarHBondContact O-N 2.85Å; W283-L319 HydrophobicContact CB-CD1 4.19Å; W283-L319 HydrophobicContact CD2-CB 3.91Å; W283-L319 HydrophobicContact CD2-CD1 4.2Å; W283-L319 HydrophobicContact CD2-CD2 4.02Å; W283-L319 HydrophobicContact CD2-CG 4.28Å; W283-L319 HydrophobicContact CE3-CB 4.13Å; W283-L319 HydrophobicContact CE3-CD2 3.74Å; W283-L319 HydrophobicContact CE3-CG 4.42Å; W283-L319 HydrophobicContact CG-CB 4.49Å; W283-L319 HydrophobicContact CG-CD1 3.95Å; W283-L319 HydrophobicContact CG-CD2 4.41Å; W283-L319 HydrophobicContact CH2-CB 3.88Å; W283-L319 HydrophobicContact CZ2-CB 3.7Å; W283-L319 HydrophobicContact CZ3-CB 4.11Å; W283-L319 HydrophobicContact CZ3-CD2 4.11Å; L290-L319 HydrophobicContact CD1-CD2 4.49Å; T291-L319 HydrophobicContact CG2-CD1 3.31Å; Y302-L319 HydrophobicContact CD1-CD2 4.44Å; N303-L319 CarbonylContact O-C 3.57Å; L319-Y332 HydrophobicContact CD2-CD1 3.71Å; L319-Y332 HydrophobicContact CD2-CE1 3.88Å
320	S	86.4	Confident	80.7	Confident	23 Å²	23	55.1 Å²	55.1	16%	0.161	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	140.6	175.2	48	0	0	0	0	111.8	F264 Y302 N303	F264-S320 WeakPolarHBondContact O-CA 3.45Å; Y302-S320 WeakPolarHBondContact CA-O 3.43Å; N303-S320 PolarHBondContact N-O 3.12Å; N303-S320 PolarHBondContact O-N 2.98Å; N303-S320 PolarHBondContact O-OG 3.5Å
321	K	86.3	Confident	81.2	Confident	12 Å²	12	48.7 Å²	48.7	5%	0.052	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	146.7	177.5	-161.8	-169.8	-178.9	179	0	109.4	F264 E301 Y302 S323 D328	F264-K321 HydrophobicContact CD1-CB 3.68Å; F264-K321 HydrophobicContact CD1-CD 4.29Å; F264-K321 HydrophobicContact CE1-CB 3.45Å; F264-K321 VanDerWaalsContact CE1-CB 3.45Å; F264-K321 HydrophobicContact CE1-CD 3.57Å; F264-K321 HydrophobicContact CE1-CG 4.11Å; F264-K321 HydrophobicContact CG-CB 4.46Å; F264-K321 HydrophobicContact CZ-CB 4.02Å; F264-K321 HydrophobicContact CZ-CD 4.36Å; F264-K321 PolarHBondContact N-O 3.46Å; F264-K321 PolarHBondContact O-N 2.92Å; E301-K321 HydrophobicContact CG-CD 4.46Å; E301-K321 HydrophobicContact CG-CG 4.04Å; E301-K321 WeakPolarHBondContact OE1-CE 3.49Å; E301-K321 IonicContact OE1-NZ 3.22Å; E301-K321 WeakPolarHBondContact OE2-CE 3.41Å; E301-K321 IonicContact OE2-NZ 3.01Å; E301-K321 PolarHBondContact OE2-NZ 2.95Å; Y302-K321 HydrophobicContact CD1-CB 4.15Å; Y302-K321 HydrophobicContact CD1-CD 4.16Å; Y302-K321 HydrophobicContact CD1-CG 4.11Å; Y302-K321 HydrophobicContact CE1-CB 4.35Å; Y302-K321 HydrophobicContact CE1-CD 3.59Å; Y302-K321 HydrophobicContact CE1-CG 4.07Å; Y302-K321 PolarHBondContact OH-NZ 3.5Å; K321-S323 WeakPolarHBondContact CD-O 3.48Å; K321-S323 VanDerWaalsContact CE-O 3.25Å; K321-S323 WeakPolarHBondContact CE-O 3.45Å; K321-D328 WeakPolarHBondContact CD-OD1 3.35Å; K321-D328 IonicContact NZ-OD1 2.55Å; K321-D328 PolarHBondContact NZ-OD1 3.17Å; K321-D328 IonicContact NZ-OD2 3.83Å; K321-D328 PolarHBondContact NZ-OD2 2.81Å
322	T	83.6	Confident	81.9	Confident	110 Å²	110	40.9 Å²	40.9	68%	0.675	24%	0.242	S	C	*	.	S	Bend	trans	-82.8	-18.7	-174.2	45.1	0	0	0	0	115.6	A263	A263-T322 WeakPolarHBondContact CB-O 3.36Å
323	S	80.7	Confident	82.7	Confident	41 Å²	41	39.7 Å²	39.7	29%	0.287	23%	0.23	S	C	.	.	S	Bend	trans	-156.3	132.1	-178	-160	0	0	0	0	108.7	D261 D262 K321	D261-S323 PolarHBondContact O-OG 3.43Å; D262-S323 CarbonylContact O-C 3.51Å; K321-S323 WeakPolarHBondContact CD-O 3.48Å; K321-S323 VanDerWaalsContact CE-O 3.25Å; K321-S323 WeakPolarHBondContact CE-O 3.45Å
324	T	77.5	Confident	83.5	Confident	2 Å²	2	35.2 Å²	35.2	1%	0.012	21%	0.206	C	C	.	.			trans	-84	131.8	171.7	39.1	0	0	0	0	111.5	L258 E259 E260 D261 D262 F264 D328	L258-T324 HydrophobicContact CB-CG2 4.07Å; L258-T324 HydrophobicContact CD1-CG2 3.68Å; L258-T324 HydrophobicContact CG-CG2 4.47Å; E259-T324 WeakPolarHBondContact O-CB 3.49Å; E259-T324 PolarHBondContact O-OG1 3.18Å; E260-T324 WeakPolarHBondContact CA-OG1 3.29Å; D261-T324 WeakPolarHBondContact CA-O 3.47Å; D261-T324 PolarHBondContact N-O 2.88Å; D261-T324 PolarHBondContact N-OG1 3.27Å; D261-T324 VanDerWaalsContact N-OG1 3.1Å; D262-T324 PolarHBondContact N-OG1 2.82Å; D262-T324 PolarHBondContact O-N 2.62Å; D262-T324 PolarHBondContact O-OG1 2.87Å; F264-T324 HydrophobicContact CB-CG2 4.22Å; F264-T324 HydrophobicContact CD1-CG2 3.45Å; F264-T324 VanDerWaalsContact CD1-CG2 3.45Å; F264-T324 HydrophobicContact CE1-CG2 4.11Å; F264-T324 HydrophobicContact CG-CG2 4.21Å; T324-D328 WeakPolarHBondContact CA-OD2 3.39Å
325	G	78.7	Confident	84.2	Confident	20 Å²	20	30.8 Å²	30.8	21%	0.206	19%	0.185	C	C	.	.			trans	-109.9	164.1	160.9	0	0	0	0	0	111	T327 D328	G325-T327 PolarHBondContact O-N 2.61Å; G325-D328 PolarHBondContact N-OD2 3.01Å; G325-D328 WeakPolarHBondContact O-CB 3.31Å; G325-D328 PolarHBondContact O-N 3.44Å
326	T	78	Confident	84.5	Confident	70 Å²	70	29.6 Å²	29.6	43%	0.429	18%	0.179	S	C	.	.	G	3₁₀ helix	trans	-50.4	-29.4	170.2	30.7	0	0	0	0	114.1	E260 D328 S329 Q357	E260-T326 WeakPolarHBondContact OE1-CG2 3.29Å; T326-D328 VanDerWaalsContact C-N 3.27Å; T326-D328 PolarHBondContact O-N 3.1Å; T326-S329 PolarHBondContact O-N 2.82Å; T326-Q357 HydrophobicContact CG2-CG 3.84Å
327	T	80.9	Confident	84.5	Confident	109 Å²	109	28.5 Å²	28.5	67%	0.669	17%	0.174	S	C	*	.	G	3₁₀ helix	trans	-69.7	-15.1	175.5	53.1	0	0	0	0	114.7	H285 G325 S329	H285-T327 PolarHBondContact CE1-O 2.58Å; G325-T327 PolarHBondContact O-N 2.61Å; T327-S329 VanDerWaalsContact C-N 3.27Å
328	D	83.1	Confident	84.2	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-79	-9	176	-69.8	-60.9	0	0	0	113.2	F264 Y302 K321 T324 G325 T326 Y332 V355	F264-D328 HydrophobicContact CE1-CB 4.2Å; Y302-D328 PolarHBondContact OH-OD1 3.42Å; K321-D328 WeakPolarHBondContact CD-OD1 3.35Å; K321-D328 IonicContact NZ-OD1 2.55Å; K321-D328 PolarHBondContact NZ-OD1 3.17Å; K321-D328 IonicContact NZ-OD2 3.83Å; K321-D328 PolarHBondContact NZ-OD2 2.81Å; T324-D328 WeakPolarHBondContact CA-OD2 3.39Å; G325-D328 PolarHBondContact N-OD2 3.01Å; G325-D328 WeakPolarHBondContact O-CB 3.31Å; G325-D328 PolarHBondContact O-N 3.44Å; T326-D328 VanDerWaalsContact C-N 3.27Å; T326-D328 PolarHBondContact O-N 3.1Å; D328-Y332 VanDerWaalsContact O-CE2 3.25Å; D328-Y332 WeakPolarHBondContact O-CE2 3.48Å; D328-Y332 PolarHBondContact O-OH 3.01Å; D328-V355 HydrophobicContact CB-CG2 4.31Å
329	S	84.2	Confident	83.8	Confident	47 Å²	47	27.9 Å²	27.9	33%	0.329	17%	0.174	S	C	.	.			trans	-67.7	146.6	170.6	-163.6	0	0	0	0	110.3	H285 T326 T327 V353	H285-S329 PolarHBondContact NE2-O 3.37Å; T326-S329 PolarHBondContact O-N 2.82Å; T327-S329 VanDerWaalsContact C-N 3.27Å; S329-V353 WeakPolarHBondContact CA-O 3.32Å; S329-V353 PolarHBondContact OG-O 3.25Å
330	G	86.4	Confident	83.1	Confident	10 Å²	10	29.7 Å²	29.7	10%	0.103	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	143.3	-155.7	178.8	0	0	0	0	0	113.1	E286 R352 V353	E286-G330 WeakPolarHBondContact OE1-CA 3.23Å; G330-R352 WeakPolarHBondContact O-CA 3.49Å; G330-V353 PolarHBondContact N-O 3.14Å; G330-V353 PolarHBondContact O-N 3.43Å
331	I	87.1	Confident	82.5	Confident	68 Å²	68	29.7 Å²	29.7	35%	0.349	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	116.3	176.6	-57.4	178.1	0	0	0	110.2	H285 E286	H285-I331 WeakPolarHBondContact CA-O 3.43Å; E286-I331 PolarHBondContact N-O 3.22Å
332	Y	88.7	Confident	81.7	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	135	168.3	-63.6	-108.6	0	0	0	108.7	F264 L266 T284 H285 L290 Y302 L319 D328 N350 V351 V353	F264-Y332 HydrophobicContact CZ-CE1 4.32Å; L266-Y332 HydrophobicContact CD1-CD1 4.22Å; L266-Y332 HydrophobicContact CD1-CD2 4.34Å; L266-Y332 HydrophobicContact CD1-CG 4.05Å; T284-Y332 CarbonylContact O-C 3.58Å; T284-Y332 VanDerWaalsContact O-CA 3.27Å; T284-Y332 WeakPolarHBondContact O-CA 3.29Å; H285-Y332 HydrophobicContact CB-CD1 3.94Å; H285-Y332 HydrophobicContact CB-CE1 3.97Å; H285-Y332 HydrophobicContact CB-CG 4.31Å; H285-Y332 AromaticContact CD2-CD2 3.77Å; H285-Y332 AromaticContact CD2-CE2 3.4Å; H285-Y332 WeakPolarHBondContact CD2-CE2 3.26Å; H285-Y332 AromaticContact CD2-CZ 3.59Å; L290-Y332 HydrophobicContact CD1-CD1 3.84Å; L290-Y332 HydrophobicContact CD1-CE1 3.54Å; Y302-Y332 HydrophobicContact CE1-CE1 4.34Å; L319-Y332 HydrophobicContact CD2-CD1 3.71Å; L319-Y332 HydrophobicContact CD2-CE1 3.88Å; D328-Y332 VanDerWaalsContact O-CE2 3.25Å; D328-Y332 WeakPolarHBondContact O-CE2 3.48Å; D328-Y332 PolarHBondContact O-OH 3.01Å; Y332-N350 CarbonylContact O-C 3.6Å; Y332-N350 WeakPolarHBondContact O-CA 3.45Å; Y332-V351 PolarHBondContact N-O 3.29Å; Y332-V351 PolarHBondContact O-N 3.13Å; Y332-V353 HydrophobicContact CD2-CB 4.13Å; Y332-V353 HydrophobicContact CD2-CG2 3.56Å; Y332-V353 HydrophobicContact CE2-CB 3.74Å; Y332-V353 HydrophobicContact CE2-CG1 4.47Å; Y332-V353 HydrophobicContact CE2-CG2 3.47Å; Y332-V353 VanDerWaalsContact CE2-CG2 3.47Å
333	K	88.7	Confident	80.9	Confident	30 Å²	30	38.2 Å²	38.2	13%	0.13	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	124	168.3	-45.7	169.7	179.8	167.1	0	108	E234 T284 D287 W335 T349	E234-K333 IonicContact OE1-NZ 2.62Å; E234-K333 PolarHBondContact OE1-NZ 2.91Å; T284-K333 PolarHBondContact N-O 2.9Å; T284-K333 PolarHBondContact O-N 2.89Å; T284-K333 WeakPolarHBondContact OG1-CB 3.21Å; T284-K333 PolarHBondContact OG1-O 3.4Å; D287-K333 WeakPolarHBondContact OD1-CE 3.48Å; D287-K333 IonicContact OD1-NZ 3.34Å; D287-K333 PolarHBondContact OD1-NZ 3.46Å; D287-K333 IonicContact OD2-NZ 2.6Å; K333-W335 HydrophobicContact CB-CZ2 4.41Å; K333-W335 HydrophobicContact CD-CZ2 3.81Å; K333-T349 WeakPolarHBondContact CA-O 3.45Å
334	C	87.9	Confident	80.3	Confident	0 Å²	0	38 Å²	38	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	119.3	171.8	172.1	0	0	0	0	109.2	I268 W283 T317 C348 T349	I268-C334 HydrophobicContact CD1-CB 3.47Å; I268-C334 VanDerWaalsContact CD1-CB 3.47Å; W283-C334 HydrophobicContact CD2-CB 3.96Å; W283-C334 HydrophobicContact CE3-CB 3.79Å; W283-C334 HydrophobicContact CH2-CB 3.95Å; W283-C334 HydrophobicContact CZ2-CB 4.05Å; W283-C334 HydrophobicContact CZ3-CB 3.79Å; T317-C334 VanDerWaalsContact CG2-SG 3.6Å; C334-C348 CarbonylContact O-C 3.52Å; C334-C348 WeakPolarHBondContact O-CA 3.44Å; C334-T349 PolarHBondContact N-O 3.15Å; C334-T349 PolarHBondContact O-N 2.81Å
335	W	87	Confident	80.1	Confident	8 Å²	8	40 Å²	40	3%	0.03	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	109.5	-178.4	-59.8	88.8	0	0	0	109.7	L233 E234 V281 W282 T284 K333 V346 Q347 C348	L233-W335 HydrophobicContact CB-CD2 3.91Å; L233-W335 HydrophobicContact CB-CE3 4.07Å; L233-W335 HydrophobicContact CB-CG 4.4Å; L233-W335 HydrophobicContact CB-CH2 4.43Å; L233-W335 HydrophobicContact CB-CZ2 4.25Å; L233-W335 HydrophobicContact CB-CZ3 4.33Å; L233-W335 HydrophobicContact CD1-CD2 4.32Å; L233-W335 HydrophobicContact CD1-CG 4Å; L233-W335 HydrophobicContact CD2-CB 4.19Å; L233-W335 HydrophobicContact CD2-CD2 4.46Å; L233-W335 HydrophobicContact CD2-CG 4.23Å; L233-W335 HydrophobicContact CG-CD2 4.46Å; L233-W335 HydrophobicContact CG-CG 4.44Å; L233-W335 WeakPolarHBondContact O-CZ3 3.48Å; E234-W335 HydrophobicContact CG-CH2 3.55Å; E234-W335 HydrophobicContact CG-CZ2 3.84Å; V281-W335 VanDerWaalsContact CA-O 3.28Å; V281-W335 WeakPolarHBondContact CA-O 3.26Å; W282-W335 HydrophobicContact CB-CB 4.25Å; W282-W335 PolarHBondContact N-O 3.25Å; W282-W335 PolarHBondContact O-N 2.91Å; T284-W335 PolarHBondContact OG1-NE1 2.98Å; K333-W335 HydrophobicContact CB-CZ2 4.41Å; K333-W335 HydrophobicContact CD-CZ2 3.81Å; W335-V346 HydrophobicContact CE3-CG1 4.48Å; W335-Q347 CarbonylContact C-O 3.58Å; W335-Q347 WeakPolarHBondContact CA-O 3.38Å; W335-C348 HydrophobicContact CD2-CB 4.25Å; W335-C348 HydrophobicContact CE3-CB 3.75Å; W335-C348 HydrophobicContact CH2-CB 4.08Å; W335-C348 HydrophobicContact CZ3-CB 3.67Å
336	T	86	Confident	80	Confident	5 Å²	5	40.3 Å²	40.3	3%	0.031	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	111.1	175.9	40.2	0	0	0	0	109.4	I270 V281 V346 Q347	I270-T336 HydrophobicContact CB-CG2 4.38Å; I270-T336 HydrophobicContact CD1-CG2 4.28Å; I270-T336 HydrophobicContact CG1-CG2 3.89Å; I270-T336 HydrophobicContact CG2-CG2 3.94Å; V281-T336 HydrophobicContact CG1-CG2 4.27Å; V281-T336 HydrophobicContact CG2-CG2 3.82Å; T336-V346 WeakPolarHBondContact O-CA 3.35Å; T336-Q347 PolarHBondContact N-O 3.27Å; T336-Q347 PolarHBondContact O-N 3.34Å; T336-Q347 VanDerWaalsContact OG1-CB 3.28Å; T336-Q347 WeakPolarHBondContact OG1-CB 3.4Å; T336-Q347 WeakPolarHBondContact OG1-CG 3.28Å; T336-Q347 PolarHBondContact OG1-O 2.95Å; T336-Q347 PolarHBondContact OG1-OE1 3.38Å
337	V	83.5	Confident	80	Confident	2 Å²	2	38.8 Å²	38.8	1%	0.012	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	109.1	179	178.5	0	0	0	0	108.8	F237 F279 V280 Q339 V346	F237-V337 HydrophobicContact CD1-CG1 3.89Å; F237-V337 HydrophobicContact CD1-CG2 3.76Å; F237-V337 HydrophobicContact CE1-CG1 3.8Å; F237-V337 HydrophobicContact CE1-CG2 4.03Å; F237-V337 HydrophobicContact CG-CG2 4.34Å; F279-V337 CarbonylContact C-O 3.57Å; F279-V337 WeakPolarHBondContact CA-O 3.22Å; V280-V337 HydrophobicContact CB-CB 4.24Å; V280-V337 PolarHBondContact N-O 3.28Å; V280-V337 PolarHBondContact O-N 3.15Å; V337-Q339 HydrophobicContact CG1-CG 4.46Å; V337-V346 HydrophobicContact CG1-CG2 4.25Å; V337-V346 HydrophobicContact CG2-CG1 4.33Å; V337-V346 HydrophobicContact CG2-CG2 4.19Å
338	S	79.7	Confident	80.1	Confident	25 Å²	25	34.7 Å²	34.7	18%	0.175	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	129.8	168.3	176.7	0	0	0	0	110	N344 A345	S338-N344 WeakPolarHBondContact O-CA 3.47Å; S338-N344 PolarHBondContact O-OD1 2.6Å; S338-A345 WeakPolarHBondContact CB-O 3.47Å; S338-A345 PolarHBondContact N-O 3.4Å
339	Q	76.6	Confident	80.2	Confident	3 Å²	3	34.9 Å²	34.9	1%	0.014	19%	0.194	C	C	.	.			trans	-110.2	98.6	178.6	-67	-155.7	-31.1	0	0	111	G133 T189 T190 D278 V280 V337 N344	G133-Q339 PolarHBondContact O-NE2 3.43Å; T189-Q339 HydrophobicContact CG2-CB 3.98Å; T190-Q339 PolarHBondContact OG1-NE2 2.92Å; D278-Q339 PolarHBondContact O-N 2.77Å; V280-Q339 VanDerWaalsContact CG2-CD 3.49Å; V280-Q339 HydrophobicContact CG2-CG 3.92Å; V337-Q339 HydrophobicContact CG1-CG 4.46Å; Q339-N344 WeakPolarHBondContact CA-OD1 3.36Å
340	S	75.2	Confident	80.2	Confident	38 Å²	38	34.6 Å²	34.6	27%	0.266	19%	0.188	S	C	.	.			trans	-129.4	153	167.6	85.5	0	0	0	0	110.4	K342 D343 N344	S340-K342 PolarHBondContact O-N 2.91Å; S340-D343 VanDerWaalsContact OG-C 3.29Å; S340-D343 WeakPolarHBondContact OG-CA 3.41Å; S340-D343 PolarHBondContact OG-N 3.43Å; S340-D343 PolarHBondContact OG-O 2.92Å; S340-N344 PolarHBondContact N-OD1 3.29Å; S340-N344 PolarHBondContact O-OD1 2.88Å
341	L	73.5	Confident	80.2	Confident	24 Å²	24	34.2 Å²	34.2	13%	0.126	18%	0.184	C	C	.	.	S	Bend	trans	-65.3	1.3	179.9	-60.5	174.4	0	0	0	114	L135 S173 E176 R187 T189	L135-L341 HydrophobicContact CD1-CD2 3.86Å; S173-L341 WeakPolarHBondContact O-CD1 3.45Å; E176-L341 HydrophobicContact CB-CD1 3.89Å; E176-L341 HydrophobicContact CG-CD1 3.95Å; E176-L341 HydrophobicContact CG-CD2 4.33Å; R187-L341 HydrophobicContact CB-CD2 4.28Å; T189-L341 HydrophobicContact CG2-CD2 4.33Å
342	K	69.7	Low	80.1	Confident	178 Å²	178	36 Å²	36	77%	0.774	19%	0.187	S	C	*	.	S	Bend	trans	-130.1	-57.3	-175.4	-61.6	178.7	-177.6	177.1	0	111.7	S340	S340-K342 PolarHBondContact O-N 2.91Å
343	D	66.3	Low	80	Confident	123 Å²	123	36.1 Å²	36.1	66%	0.658	19%	0.187	S	C	*	.			trans	-120.3	96.9	-169.6	-49.3	-45.8	0	0	0	108.6	S340	S340-D343 VanDerWaalsContact OG-C 3.29Å; S340-D343 WeakPolarHBondContact OG-CA 3.41Å; S340-D343 PolarHBondContact OG-N 3.43Å; S340-D343 PolarHBondContact OG-O 2.92Å
344	N	68.5	Low	79.8	Confident	36 Å²	36	37.8 Å²	37.8	19%	0.193	19%	0.194	C	C	.	.			trans	-93.2	96.4	172.6	-72.6	-38.5	0	0	0	108.9	C240 S338 Q339 S340	C240-N344 VanDerWaalsContact CB-O 3.32Å; C240-N344 WeakPolarHBondContact CB-O 3.45Å; S338-N344 WeakPolarHBondContact O-CA 3.47Å; S338-N344 PolarHBondContact O-OD1 2.6Å; Q339-N344 WeakPolarHBondContact CA-OD1 3.36Å; S340-N344 PolarHBondContact N-OD1 3.29Å; S340-N344 PolarHBondContact O-OD1 2.88Å
345	A	71.7	Confident	79.6	Confident	43 Å²	43	38.9 Å²	38.9	36%	0.355	20%	0.201	S	C	.	.			trans	-89.7	137	176.6	0	0	0	0	0	110.8	S338	S338-A345 WeakPolarHBondContact CB-O 3.47Å; S338-A345 PolarHBondContact N-O 3.4Å
346	V	76.9	Confident	79.1	Confident	28 Å²	28	45.4 Å²	45.4	17%	0.17	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	123.2	177.9	179.1	0	0	0	0	109.1	F237 W335 T336 V337	F237-V346 HydrophobicContact CB-CB 4.5Å; F237-V346 HydrophobicContact CB-CG1 4.02Å; F237-V346 HydrophobicContact CB-CG2 3.92Å; F237-V346 HydrophobicContact CD1-CG2 4.06Å; F237-V346 HydrophobicContact CG-CG2 4.5Å; F237-V346 VanDerWaalsContact O-CG2 3.32Å; F237-V346 WeakPolarHBondContact O-CG2 3.42Å; W335-V346 HydrophobicContact CE3-CG1 4.48Å; T336-V346 WeakPolarHBondContact O-CA 3.35Å; V337-V346 HydrophobicContact CG1-CG2 4.25Å; V337-V346 HydrophobicContact CG2-CG1 4.33Å; V337-V346 HydrophobicContact CG2-CG2 4.19Å
347	Q	78.9	Confident	78.4	Confident	38 Å²	38	49.4 Å²	49.4	18%	0.178	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	139.2	172.2	164.3	-170	21.2	0	0	108.4	Q271 W335 T336 T349	Q271-Q347 VanDerWaalsContact N-OE1 3.12Å; W335-Q347 CarbonylContact C-O 3.58Å; W335-Q347 WeakPolarHBondContact CA-O 3.38Å; T336-Q347 PolarHBondContact N-O 3.27Å; T336-Q347 PolarHBondContact O-N 3.34Å; T336-Q347 VanDerWaalsContact OG1-CB 3.28Å; T336-Q347 WeakPolarHBondContact OG1-CB 3.4Å; T336-Q347 WeakPolarHBondContact OG1-CG 3.28Å; T336-Q347 PolarHBondContact OG1-O 2.95Å; T336-Q347 PolarHBondContact OG1-OE1 3.38Å; Q347-T349 PolarHBondContact NE2-OG1 2.89Å
348	C	83.1	Confident	77.4	Confident	23 Å²	23	55.5 Å²	55.5	16%	0.155	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	136.9	168	-177.4	0	0	0	0	106.8	N251 C334 W335	N251-C348 VanDerWaalsContact CG-O 3.26Å; N251-C348 PolarHBondContact ND2-O 2.9Å; N251-C348 PolarHBondContact OD1-O 3.4Å; C334-C348 CarbonylContact O-C 3.52Å; C334-C348 WeakPolarHBondContact O-CA 3.44Å; W335-C348 HydrophobicContact CD2-CB 4.25Å; W335-C348 HydrophobicContact CE3-CB 3.75Å; W335-C348 HydrophobicContact CH2-CB 4.08Å; W335-C348 HydrophobicContact CZ3-CB 3.67Å
349	T	83.8	Confident	76.4	Confident	3 Å²	3	61.4 Å²	61.4	2%	0.018	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	131.5	176.2	-56	0	0	0	0	109.5	F254 I268 K333 C334 Q347	F254-T349 HydrophobicContact CD2-CG2 4.06Å; F254-T349 HydrophobicContact CE2-CG2 3.65Å; I268-T349 HydrophobicContact CD1-CG2 4.01Å; I268-T349 HydrophobicContact CG2-CG2 3.86Å; K333-T349 WeakPolarHBondContact CA-O 3.45Å; C334-T349 PolarHBondContact N-O 3.15Å; C334-T349 PolarHBondContact O-N 2.81Å; Q347-T349 PolarHBondContact NE2-OG1 2.89Å
350	N	85.3	Confident	75.4	Confident	41 Å²	41	63.6 Å²	63.6	22%	0.219	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	133.1	-171.5	-62	1.1	0	0	0	110.4	V253 F254 Y332	V253-N350 WeakPolarHBondContact CA-O 3.24Å; V253-N350 HydrophobicContact CG2-CB 4.34Å; F254-N350 PolarHBondContact N-O 3.38Å; Y332-N350 CarbonylContact O-C 3.6Å; Y332-N350 WeakPolarHBondContact O-CA 3.45Å
351	V	85.5	Confident	74.5	Confident	3 Å²	3	65.9 Å²	65.9	2%	0.018	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	124.5	174.7	-174.4	0	0	0	0	108.5	F254 V256 L266 I268 Y332 V353	F254-V351 HydrophobicContact CB-CG1 4.19Å; F254-V351 HydrophobicContact CB-CG2 4.23Å; F254-V351 HydrophobicContact CD2-CG2 4.24Å; F254-V351 CarbonylContact O-C 3.6Å; F254-V351 WeakPolarHBondContact O-CA 3.47Å; F254-V351 WeakPolarHBondContact O-CG1 3.49Å; V256-V351 HydrophobicContact CG2-CG1 3.9Å; L266-V351 HydrophobicContact CD1-CB 4.36Å; L266-V351 HydrophobicContact CD1-CG1 4.07Å; L266-V351 HydrophobicContact CD2-CG1 4.22Å; I268-V351 HydrophobicContact CD1-CG2 3.66Å; I268-V351 HydrophobicContact CG1-CG2 4.28Å; Y332-V351 PolarHBondContact N-O 3.29Å; Y332-V351 PolarHBondContact O-N 3.13Å; V351-V353 HydrophobicContact CG1-CG2 4.31Å
352	R	85.6	Confident	73.7	Confident	106 Å²	106	70.5 Å²	70.5	40%	0.4	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	120.7	172.3	177	-178.2	-74.6	155.8	-6.8	109.1	V253 F254 E255 V256 G330	V253-R352 HydrophobicContact CG1-CB 4.29Å; F254-R352 PolarHBondContact O-N 3.27Å; E255-R352 WeakPolarHBondContact CA-O 3.3Å; E255-R352 HydrophobicContact CG-CB 4.34Å; E255-R352 VanDerWaalsContact OE1-CD 3.31Å; E255-R352 WeakPolarHBondContact OE1-CD 3.36Å; E255-R352 IonicContact OE1-CZ 2.61Å; E255-R352 IonicContact OE1-NE 3.95Å; E255-R352 IonicContact OE1-NH1 2.61Å; E255-R352 PolarHBondContact OE1-NH1 3.45Å; V256-R352 PolarHBondContact N-O 2.87Å; G330-R352 WeakPolarHBondContact O-CA 3.49Å
353	V	86.1	Confident	73.1	Confident	1 Å²	1	64.8 Å²	64.8	1%	0.006	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	132.7	176.5	176.3	0	0	0	0	109.7	V256 L258 L266 S329 G330 Y332 V351 V355	V256-V353 WeakPolarHBondContact O-CA 3.49Å; L258-V353 HydrophobicContact CD1-CG1 3.49Å; L258-V353 VanDerWaalsContact CD1-CG1 3.49Å; L258-V353 HydrophobicContact CG-CG1 4.1Å; L266-V353 HydrophobicContact CD1-CG2 4.15Å; L266-V353 HydrophobicContact CD2-CG2 4.24Å; S329-V353 WeakPolarHBondContact CA-O 3.32Å; S329-V353 PolarHBondContact OG-O 3.25Å; G330-V353 PolarHBondContact N-O 3.14Å; G330-V353 PolarHBondContact O-N 3.43Å; Y332-V353 HydrophobicContact CD2-CB 4.13Å; Y332-V353 HydrophobicContact CD2-CG2 3.56Å; Y332-V353 HydrophobicContact CE2-CB 3.74Å; Y332-V353 HydrophobicContact CE2-CG1 4.47Å; Y332-V353 HydrophobicContact CE2-CG2 3.47Å; Y332-V353 VanDerWaalsContact CE2-CG2 3.47Å; V351-V353 HydrophobicContact CG1-CG2 4.31Å; V353-V355 HydrophobicContact CG1-CG2 4.41Å
354	K	84.3	Confident	72.7	Confident	65 Å²	65	64.5 Å²	64.5	28%	0.283	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	125.9	169.5	-44.2	-169	-157.2	87	0	109.2	E255 V256 E257 L258	E255-K354 WeakPolarHBondContact OE2-CE 3.41Å; E255-K354 IonicContact OE2-NZ 3.07Å; E255-K354 PolarHBondContact OE2-NZ 3.21Å; V256-K354 PolarHBondContact O-N 3.22Å; E257-K354 WeakPolarHBondContact CA-O 3.35Å; E257-K354 HydrophobicContact CG-CB 4.3Å; E257-K354 HydrophobicContact CG-CD 4.49Å; E257-K354 IonicContact OE1-NZ 2.63Å; E257-K354 PolarHBondContact OE1-NZ 2.95Å; L258-K354 PolarHBondContact N-O 2.85Å
355	V	83.8	Confident	72.3	Confident	23 Å²	23	69.9 Å²	69.9	14%	0.139	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	127.8	174	-176.6	0	0	0	0	108.8	L258 E260 D328 V353	L258-V355 CarbonylContact O-C 3.49Å; L258-V355 WeakPolarHBondContact O-CA 3.4Å; E260-V355 HydrophobicContact CB-CG1 4.07Å; E260-V355 HydrophobicContact CG-CG1 4.45Å; D328-V355 HydrophobicContact CB-CG2 4.31Å; V353-V355 HydrophobicContact CG1-CG2 4.41Å
356	R	77.2	Confident	71.7	Confident	145 Å²	145	73.3 Å²	73.3	55%	0.547	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	113.4	176.6	-69.2	-176.1	176.3	-141.8	9.8	109.7	E257 L258 E260	E257-R356 IonicContact OE2-CZ 2.65Å; E257-R356 IonicContact OE2-NE 2.65Å; E257-R356 PolarHBondContact OE2-NE 3.16Å; E257-R356 IonicContact OE2-NH2 2.61Å; E257-R356 PolarHBondContact OE2-NH2 2.72Å; L258-R356 PolarHBondContact O-N 2.87Å; E260-R356 PolarHBondContact N-O 3.41Å
357	Q	70.6	Confident	70.8	Confident	90 Å²	90	76.6 Å²	76.6	42%	0.421	37%	0.366	S	S	.	.			trans	-72.3	143.3	174.5	-51	-164	-90.6	0	0	111.5	E260 T326 E359 A360	E260-Q357 WeakPolarHBondContact OE2-CG 3.36Å; E260-Q357 PolarHBondContact OE2-NE2 3.39Å; T326-Q357 HydrophobicContact CG2-CG 3.84Å; Q357-E359 VanDerWaalsContact C-N 3.3Å; Q357-E359 PolarHBondContact O-N 2.88Å; Q357-A360 WeakPolarHBondContact O-CB 3.25Å; Q357-A360 PolarHBondContact O-N 3.05Å
358	E	63.5	Low	70	Confident	130 Å²	130	79.5 Å²	79.5	61%	0.607	38%	0.383	S	S	*	.	H	α-helix	trans	-67.3	-29.6	-179.5	-168.6	175.2	-155.9	0	0	112.8	A360 R361	E358-A360 PolarHBondContact O-N 3.35Å; E358-R361 WeakPolarHBondContact O-CB 3.3Å; E358-R361 PolarHBondContact O-N 3.21Å
359	E	58.8	Low	68.8	Low	149 Å²	149	84.6 Å²	84.6	70%	0.696	40%	0.403	S	S	*	.	H	α-helix	trans	-57	-33.8	177.9	-61.6	-164	151.5	0	0	112.8	Q357 R361 Q362 S363	Q357-E359 VanDerWaalsContact C-N 3.3Å; Q357-E359 PolarHBondContact O-N 2.88Å; E359-R361 VanDerWaalsContact C-N 3.29Å; E359-R361 PolarHBondContact O-N 3.47Å; E359-Q362 WeakPolarHBondContact O-CB 3.42Å; E359-Q362 PolarHBondContact O-N 2.81Å; E359-S363 PolarHBondContact O-N 2.94Å
360	A	55.3	Low	67.7	Low	48 Å²	48	91.2 Å²	91.2	40%	0.397	43%	0.434	S	S	.	.	H	α-helix	trans	-58.2	-42.3	176.1	0	0	0	0	0	111.6	Q357 E358 Q362 S363 E364	Q357-A360 WeakPolarHBondContact O-CB 3.25Å; Q357-A360 PolarHBondContact O-N 3.05Å; E358-A360 PolarHBondContact O-N 3.35Å; A360-Q362 PolarHBondContact O-N 2.89Å; A360-S363 PolarHBondContact O-N 3.04Å; A360-S363 PolarHBondContact O-OG 2.61Å; A360-E364 PolarHBondContact O-N 2.62Å
361	R	55.6	Low	66.4	Low	86 Å²	86	94.6 Å²	94.6	33%	0.325	45%	0.446	S	S	.	.	H	α-helix	trans	-63	-24.6	177.1	-64.9	173.7	157.6	160.1	-0.8	113	E259 E358 E359 K365	E259-R361 IonicContact OE1-CZ 2.64Å; E259-R361 IonicContact OE1-NH1 3.62Å; E259-R361 IonicContact OE1-NH2 2.66Å; E259-R361 PolarHBondContact OE1-NH2 2.6Å; E259-R361 IonicContact OE2-CZ 2.63Å; E259-R361 VanDerWaalsContact OE2-CZ 3.22Å; E259-R361 IonicContact OE2-NH1 2.68Å; E259-R361 PolarHBondContact OE2-NH1 2.96Å; E259-R361 IonicContact OE2-NH2 2.57Å; E259-R361 PolarHBondContact OE2-NH2 3.18Å; E358-R361 WeakPolarHBondContact O-CB 3.3Å; E358-R361 PolarHBondContact O-N 3.21Å; E359-R361 VanDerWaalsContact C-N 3.29Å; E359-R361 PolarHBondContact O-N 3.47Å; R361-K365 WeakPolarHBondContact O-CB 3.2Å; R361-K365 WeakPolarHBondContact O-CD 3.41Å; R361-K365 WeakPolarHBondContact O-CG 3.3Å
362	Q	57.2	Low	65.1	Low	122 Å²	122	100.2 Å²	100.2	57%	0.57	47%	0.473	S	S	*	.	H	α-helix	trans	-78.9	-39.2	174.5	-56.1	-167.4	28	0	0	110.7	E359 A360 L366	E359-Q362 WeakPolarHBondContact O-CB 3.42Å; E359-Q362 PolarHBondContact O-N 2.81Å; A360-Q362 PolarHBondContact O-N 2.89Å; Q362-L366 WeakPolarHBondContact O-CG 3.19Å; Q362-L366 PolarHBondContact O-N 3.48Å
363	S	58.1	Low	63.7	Low	58 Å²	58	101.1 Å²	101.1	41%	0.406	48%	0.481	S	S	.	.	H	α-helix	trans	-66.3	-40.5	177.5	76.7	0	0	0	0	113.4	E359 A360 L366 N367	E359-S363 PolarHBondContact O-N 2.94Å; A360-S363 PolarHBondContact O-N 3.04Å; A360-S363 PolarHBondContact O-OG 2.61Å; S363-L366 PolarHBondContact O-N 3.33Å; S363-N367 PolarHBondContact O-N 2.83Å; S363-N367 PolarHBondContact O-ND2 3.08Å; S363-N367 VanDerWaalsContact O-ND2 3.07Å
364	E	57.8	Low	62.3	Low	116 Å²	116	102.8 Å²	102.8	54%	0.542	50%	0.498	S	S	.	.	H	α-helix	trans	-65.4	-45.9	177	-68.4	-179.6	140.2	0	0	111.1	A360 L366 N367 D368	A360-E364 PolarHBondContact O-N 2.62Å; E364-L366 PolarHBondContact O-N 2.96Å; E364-L366 VanDerWaalsContact O-N 3.15Å; E364-N367 PolarHBondContact O-N 2.83Å; E364-N367 VanDerWaalsContact O-N 3.1Å; E364-D368 PolarHBondContact O-N 3.11Å
365	K	59.5	Low	61	Low	149 Å²	149	105.9 Å²	105.9	65%	0.648	51%	0.514	S	S	*	.	H	α-helix	trans	-61.7	-21.1	175.5	-71.5	172.1	-168.5	168.5	0	114.4	R361	R361-K365 WeakPolarHBondContact O-CB 3.2Å; R361-K365 WeakPolarHBondContact O-CD 3.41Å; R361-K365 WeakPolarHBondContact O-CG 3.3Å
366	L	59.8	Low	59.7	Low	115 Å²	115	109.9 Å²	109.9	60%	0.602	53%	0.529	S	S	*	.	H	α-helix	trans	-82.6	-47	171.3	-72	168.1	0	0	0	111.1	Q362 S363 E364 D368 K369 E370	Q362-L366 WeakPolarHBondContact O-CG 3.19Å; Q362-L366 PolarHBondContact O-N 3.48Å; S363-L366 PolarHBondContact O-N 3.33Å; E364-L366 PolarHBondContact O-N 2.96Å; E364-L366 VanDerWaalsContact O-N 3.15Å; L366-D368 PolarHBondContact O-N 3.34Å; L366-K369 WeakPolarHBondContact O-CB 3.49Å; L366-K369 PolarHBondContact O-N 2.81Å; L366-K369 VanDerWaalsContact O-N 3.13Å; L366-E370 PolarHBondContact O-N 3.33Å; L366-E370 VanDerWaalsContact O-N 3.07Å
367	N	58	Low	58.5	Low	97 Å²	97	108.4 Å²	108.4	52%	0.519	53%	0.532	S	S	.	.	H	α-helix	trans	-59.7	-43.7	179.9	-75.6	-46.4	0	0	0	113	S363 E364 K369 E370 K371	S363-N367 PolarHBondContact O-N 2.83Å; S363-N367 PolarHBondContact O-ND2 3.08Å; S363-N367 VanDerWaalsContact O-ND2 3.07Å; E364-N367 PolarHBondContact O-N 2.83Å; E364-N367 VanDerWaalsContact O-N 3.1Å; N367-K369 PolarHBondContact O-N 3.09Å; N367-E370 PolarHBondContact O-N 2.78Å; N367-K371 WeakPolarHBondContact O-CB 3.35Å; N367-K371 PolarHBondContact O-N 2.73Å; N367-K371 VanDerWaalsContact O-N 3.14Å
368	D	60.4	Low	57.5	Low	100 Å²	100	110.7 Å²	110.7	54%	0.535	54%	0.542	S	S	.	.	H	α-helix	trans	-66.9	-27.9	178.7	-72.1	-39.4	0	0	0	112.3	E364 L366 K371 E372	E364-D368 PolarHBondContact O-N 3.11Å; L366-D368 PolarHBondContact O-N 3.34Å; D368-K371 WeakPolarHBondContact O-CB 3.39Å; D368-K371 PolarHBondContact O-N 2.89Å; D368-E372 PolarHBondContact O-N 2.82Å
369	K	58.9	Low	56.9	Low	129 Å²	129	111.5 Å²	111.5	56%	0.561	55%	0.546	S	S	*	.	H	α-helix	trans	-74.7	-42.2	176.8	-166.1	177.4	-179.2	-176.2	0	112.6	L366 N367 K371 E372 E373	L366-K369 WeakPolarHBondContact O-CB 3.49Å; L366-K369 PolarHBondContact O-N 2.81Å; L366-K369 VanDerWaalsContact O-N 3.13Å; N367-K369 PolarHBondContact O-N 3.09Å; K369-K371 PolarHBondContact O-N 3.34Å; K369-E372 PolarHBondContact O-N 3.44Å; K369-E373 PolarHBondContact O-N 2.88Å
370	E	60.2	Low	56.6	Low	143 Å²	143	111 Å²	111	67%	0.668	55%	0.548	S	S	*	.	H	α-helix	trans	-61.4	-31.3	171.7	-67.9	-167.1	162.4	0	0	111.8	L366 N367 E373 G374	L366-E370 PolarHBondContact O-N 3.33Å; L366-E370 VanDerWaalsContact O-N 3.07Å; N367-E370 PolarHBondContact O-N 2.78Å; E370-E373 PolarHBondContact O-N 2.7Å; E370-G374 PolarHBondContact O-N 2.86Å
371	K	57.9	Low	56.4	Low	112 Å²	112	116.3 Å²	116.3	49%	0.487	56%	0.562	S	S	.	*	H	α-helix	trans	-71.5	-42.8	177.6	-154.7	176.5	-168.7	171.2	0	112.7	N367 D368 K369 E373 G374 E375	N367-K371 WeakPolarHBondContact O-CB 3.35Å; N367-K371 PolarHBondContact O-N 2.73Å; N367-K371 VanDerWaalsContact O-N 3.14Å; D368-K371 WeakPolarHBondContact O-CB 3.39Å; D368-K371 PolarHBondContact O-N 2.89Å; K369-K371 PolarHBondContact O-N 3.34Å; K371-E373 VanDerWaalsContact C-N 3.26Å; K371-E373 PolarHBondContact O-N 2.84Å; K371-G374 PolarHBondContact O-N 3.07Å; K371-E375 PolarHBondContact O-N 3.35Å
372	E	58	Low	55.9	Low	121 Å²	121	118.7 Å²	118.7	57%	0.565	58%	0.58	S	S	*	*	H	α-helix	trans	-60.5	-32.7	172.3	-110.7	-140.5	107.2	0	0	113	D368 K369 K376	D368-E372 PolarHBondContact O-N 2.82Å; K369-E372 PolarHBondContact O-N 3.44Å; E372-K376 VanDerWaalsContact CD-NZ 3.35Å; E372-K376 WeakPolarHBondContact O-CG 3.42Å; E372-K376 PolarHBondContact O-NZ 3.28Å; E372-K376 IonicContact OE1-NZ 2.59Å; E372-K376 PolarHBondContact OE1-NZ 2.68Å
373	E	57.3	Low	55.3	Low	125 Å²	125	117.8 Å²	117.8	58%	0.584	59%	0.587	S	S	*	*	H	α-helix	trans	-79.1	-33.8	174.5	-69.1	-174.4	-176.7	0	0	111.7	K369 E370 K371 L377	K369-E373 PolarHBondContact O-N 2.88Å; E370-E373 PolarHBondContact O-N 2.7Å; K371-E373 VanDerWaalsContact C-N 3.26Å; K371-E373 PolarHBondContact O-N 2.84Å; E373-L377 PolarHBondContact O-N 3.4Å
374	G	57.2	Low	54.7	Low	35 Å²	35	122.7 Å²	122.7	36%	0.361	61%	0.606	S	S	.	*	H	α-helix	trans	-66.2	-42.7	175.8	0	0	0	0	0	114.6	E370 K371 L377	E370-G374 PolarHBondContact O-N 2.86Å; K371-G374 PolarHBondContact O-N 3.07Å; G374-L377 PolarHBondContact O-N 3.36Å
375	E	56.2	Low	54.1	Low	130 Å²	130	125.6 Å²	125.6	61%	0.607	62%	0.623	S	S	*	*	H	α-helix	trans	-72	-39.4	-178.2	-70.9	-176.7	167.1	0	0	112.1	K371 L377 Q378 E379	K371-E375 PolarHBondContact O-N 3.35Å; E375-L377 PolarHBondContact O-N 2.8Å; E375-Q378 PolarHBondContact O-N 3.18Å; E375-E379 PolarHBondContact O-N 3.19Å
376	K	55.8	Low	53	Low	107 Å²	107	126.9 Å²	126.9	47%	0.465	64%	0.637	S	S	.	*	H	α-helix	trans	-59	-32.4	174.1	-69	-177.2	-169.9	82.3	0	112.9	E372 Q378	E372-K376 VanDerWaalsContact CD-NZ 3.35Å; E372-K376 WeakPolarHBondContact O-CG 3.42Å; E372-K376 PolarHBondContact O-NZ 3.28Å; E372-K376 IonicContact OE1-NZ 2.59Å; E372-K376 PolarHBondContact OE1-NZ 2.68Å; K376-Q378 VanDerWaalsContact C-N 3.25Å; K376-Q378 PolarHBondContact O-N 2.84Å
377	L	53.4	Low	51.9	Low	114 Å²	114	124.4 Å²	124.4	60%	0.597	64%	0.639	S	S	*	*	H	α-helix	trans	-76.1	-4.4	175.9	-79.4	168.4	0	0	0	114.8	E373 G374 E375 K381	E373-L377 PolarHBondContact O-N 3.4Å; G374-L377 PolarHBondContact O-N 3.36Å; E375-L377 PolarHBondContact O-N 2.8Å; L377-K381 PolarHBondContact O-NZ 3.43Å
378	Q	49.4	Very low	51.1	Low	138 Å²	138	125.9 Å²	125.9	65%	0.645	65%	0.652	S	S	*	*	H	α-helix	trans	-102.5	-39.2	172.7	-64	-165	8.3	0	0	113.1	E375 K376 D380 K381	E375-Q378 PolarHBondContact O-N 3.18Å; K376-Q378 VanDerWaalsContact C-N 3.25Å; K376-Q378 PolarHBondContact O-N 2.84Å; Q378-D380 VanDerWaalsContact C-N 3.32Å; Q378-D380 PolarHBondContact O-N 3.42Å; Q378-K381 PolarHBondContact O-N 3.47Å; Q378-K381 VanDerWaalsContact O-N 3.09Å
379	E	50.6	Low	50.1	Low	147 Å²	147	129.2 Å²	129.2	69%	0.687	66%	0.664	S	S	*	*	H	α-helix	trans	-61.5	-39.4	179.4	-64.8	-164.6	124.2	0	0	112.5	E375 K381 I382	E375-E379 PolarHBondContact O-N 3.19Å; E379-K381 PolarHBondContact O-N 2.79Å; E379-I382 PolarHBondContact O-N 2.87Å
380	D	51.3	Low	49.1	Very low	139 Å²	139	128 Å²	128	74%	0.743	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60	-6.6	175.1	-93.3	-5.5	0	0	0	114.7	Q378	Q378-D380 VanDerWaalsContact C-N 3.32Å; Q378-D380 PolarHBondContact O-N 3.42Å
381	K	52.5	Low	48.1	Very low	160 Å²	160	127.5 Å²	127.5	70%	0.696	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.8	-1.5	177.1	-60.5	-168.4	-177.7	89.3	0	114.6	L377 Q378 E379	L377-K381 PolarHBondContact O-NZ 3.43Å; Q378-K381 PolarHBondContact O-N 3.47Å; Q378-K381 VanDerWaalsContact O-N 3.09Å; E379-K381 PolarHBondContact O-N 2.79Å
382	I	45.1	Very low	47.3	Very low	135 Å²	135	130.2 Å²	130.2	69%	0.692	68%	0.684	S	S	*	*	S	Bend	trans	-102.3	-6	-172.5	-62.3	172.8	0	0	0	112.1	E379 M384	E379-I382 PolarHBondContact O-N 2.87Å; I382-M384 VanDerWaalsContact C-N 3.27Å; I382-M384 PolarHBondContact O-N 2.75Å; I382-M384 VanDerWaalsContact O-N 3.15Å
383	S	44	Very low	46.4	Very low	104 Å²	104	132.5 Å²	132.5	73%	0.727	70%	0.699	S	S	*	*	S	Bend	trans	-79.3	14.5	-176.8	65.9	0	0	0	0	116.4
384	M	44.9	Very low	45.6	Very low	161 Å²	161	131.5 Å²	131.5	79%	0.793	71%	0.706	S	S	*	*			trans	-138.7	101.6	176.2	-68.6	-168.1	-174.4	0	0	112.5	I382	I382-M384 VanDerWaalsContact C-N 3.27Å; I382-M384 PolarHBondContact O-N 2.75Å; I382-M384 VanDerWaalsContact O-N 3.15Å
385	I	45.8	Very low	44.8	Very low	177 Å²	177	139.3 Å²	139.3	91%	0.908	73%	0.73	S	S	*	*			trans	168	103.7	138.5	-86	152.5	0	0	0	106.9
386	D	35.9	Very low	44	Very low	175 Å²	175	141.4 Å²	141.4	94%	0.936	74%	0.737	S	S	*	*			trans	-102.9	138.1	170.1	-117.6	-36.6	0	0	0	108.6
387	G	37.5	Very low	43.3	Very low	63 Å²	63	142.4 Å²	142.4	65%	0.649	75%	0.747	S	S	*	*			trans	144.7	134.1	161.3	0	0	0	0	0	118.8
388	V	40.4	Very low	42.5	Very low	129 Å²	129	143.3 Å²	143.3	78%	0.782	76%	0.757	S	S	*	*			trans	76.7	95.4	152	-166.5	0	0	0	0	118.2
389	E	39.8	Very low	42.3	Very low	169 Å²	169	144.8 Å²	144.8	79%	0.79	76%	0.764	S	S	*	*				38.7	143.1	117.9	-56.5	-174.4	156.3	0	0	121.3
390	T	37.8	Very low	41.9	Very low	105 Å²	105	144.4 Å²	144.4	64%	0.644	77%	0.765	S	S	*	*			cis	-163.5	148.4	-4.1	20.7	0	0	0	0	113
391	N	38.9	Very low	41.4	Very low	132 Å²	132	144.2 Å²	144.2	71%	0.706	77%	0.765	S	S	*	*			trans	56.3	147	138.3	-66.8	-26.2	0	0	0	126.2
392	H	41.2	Very low	40.8	Very low	168 Å²	168	143.7 Å²	143.7	78%	0.778	76%	0.762	S	S	*	*			trans	75.1	108.9	141.2	-75.3	-39.7	0	0	0	122.3
393	L	39.6	Very low	40.5	Very low	170 Å²	170	144.5 Å²	144.5	89%	0.89	76%	0.763	S	S	*	*				-169.4	-174.7	90.5	-105.6	160.6	0	0	0	113
394	S	41	Very low	40.2	Very low	104 Å²	104	146.1 Å²	146.1	73%	0.727	77%	0.768	S	S	*	*			trans	-126.9	164	-147.8	60.7	0	0	0	0	118.6
395	K	39	Very low	40.2	Very low	198 Å²	198	143.9 Å²	143.9	86%	0.861	77%	0.766	S	S	*	*			trans	-49.2	153.4	172	-56.7	175.2	177.7	179.6	0	115.1
396	K	39.3	Very low	39.8	Very low	175 Å²	175	140.2 Å²	140.2	76%	0.761	76%	0.756	S	S	*	*			trans	171.4	160.5	142.8	-97.3	170.9	153.7	-77.1	0	109.3
397	D	42	Very low	40.1	Very low	128 Å²	128	140.3 Å²	140.3	68%	0.684	75%	0.753	S	S	*	*			cis	-144.3	-178.6	-0.9	-107.7	-42.3	0	0	0	109.5
398	V	37.2	Very low	40	Very low	133 Å²	133	146.4 Å²	146.4	81%	0.806	76%	0.762	S	S	*	*			trans	-113.7	143.6	178.8	166.5	0	0	0	0	110.2
399	E	44	Very low	39.7	Very low	169 Å²	169	148.2 Å²	148.2	79%	0.79	76%	0.759	S	S	*	*			trans	-172.7	157.1	143.8	-115.4	-175.6	155.4	0	0	118
400	I	43.2	Very low	39.4	Very low	138 Å²	138	147.2 Å²	147.2	71%	0.708	75%	0.754	S	S	*	*			trans	72	147	148.4	-72.4	160.4	0	0	0	120.8
401	N	40.1	Very low	39.3	Very low	136 Å²	136	151.8 Å²	151.8	73%	0.727	77%	0.768	S	S	*	*			cis	-176.2	161.8	-42.1	-135.3	-36.8	0	0	0	111.2
402	K	40.9	Very low	39	Very low	148 Å²	148	154.2 Å²	154.2	64%	0.643	78%	0.775	S	S	*	*			trans	98.2	121.6	149.7	-75.6	161.7	155.1	-79.9	0	125
403	E	37.7	Very low	38.6	Very low	152 Å²	152	154.6 Å²	154.6	71%	0.71	78%	0.777	S	S	*	*				98.2	131.6	123.5	-75.9	160.9	178.3	0	0	123.8
404	V	37.1	Very low	38.5	Very low	138 Å²	138	154.1 Å²	154.1	84%	0.836	78%	0.776	S	S	*	*			trans	-166.8	-174.8	-171.7	-65.8	0	0	0	0	107.1
405	P	45.2	Very low	38.7	Very low	114 Å²	114	157 Å²	157	74%	0.74	78%	0.782	S	S	*	*			cis	-135.6	-134.2	-3.3	43.5	-21.8	0	0	0	112.5
406	S	37.2	Very low	38.5	Very low	101 Å²	101	156.9 Å²	156.9	71%	0.706	78%	0.782	S	S	*	*			trans	79.9	147.4	168.9	-74.7	0	0	0	0	117.6
407	M	42.1	Very low	38.4	Very low	176 Å²	176	157.7 Å²	157.7	87%	0.867	79%	0.785	S	S	*	*			cis	-150.8	173.9	2.7	-131.5	162.2	69.5	0	0	112.7
408	K	35.8	Very low	38.2	Very low	192 Å²	192	163.6 Å²	163.6	84%	0.835	80%	0.798	S	S	*	*			trans	-117.4	144.6	174.2	-55.9	177.6	-179.9	-177.6	0	111.2
409	K	33.9	Very low	37.9	Very low	167 Å²	167	160.8 Å²	160.8	73%	0.726	80%	0.796	S	S	*	*			trans	170.2	152.9	130.9	-103.7	167	147.2	-110.9	0	115
410	E	34.7	Very low	37.5	Very low	147 Å²	147	158.6 Å²	158.6	69%	0.687	80%	0.799	S	S	*	*			trans	47.9	121.1	142.9	-68	155.2	163.5	0	0	121.3
411	E	35.9	Very low	37.2	Very low	202 Å²	202	159.3 Å²	159.3	94%	0.944	81%	0.805	S	S	*	*				-160.6	141.5	100.6	-104	177.2	176	0	0	111.6
412	E	31.6	Very low	37.1	Very low	182 Å²	182	159.4 Å²	159.4	85%	0.85	81%	0.81	S	S	*	*			trans	-146.1	146.7	-178.3	179.9	177.2	-176.6	0	0	108.8
413	E	33.6	Very low	36.8	Very low	177 Å²	177	160.9 Å²	160.9	83%	0.827	82%	0.821	S	S	*	*			trans	25.6	113.4	176.4	-69.8	-150.9	136.5	0	0	120.5
414	D	37.7	Very low	37.1	Very low	160 Å²	160	162.6 Å²	162.6	86%	0.856	83%	0.826	S	S	*	*			trans	-153.4	173.7	134.3	-149.9	-12.8	0	0	0	112.7
415	L	44.3	Very low	37.3	Very low	165 Å²	165	167.2 Å²	167.2	86%	0.864	83%	0.829	S	S	*	*			trans	92.6	46.5	177.9	-60.6	178.4	0	0	0	118.4
416	K	34.6	Very low	36.7	Very low	195 Å²	195	171.3 Å²	171.3	85%	0.848	84%	0.835	S	S	*	*			trans	-94.1	83.9	162.7	-162.9	175.8	-162	162.3	0	111.8
417	K	38.4	Very low	36.7	Very low	192 Å²	192	175.8 Å²	175.8	84%	0.835	85%	0.845	S	S	*	*			trans	-162	137.6	174.1	-113.5	147.2	-168.3	162.6	0	117.4
418	R	36.9	Very low	36.6	Very low	251 Å²	251	175.6 Å²	175.6	95%	0.947	84%	0.842	S	S	*	*			trans	70.4	136.6	169.1	-50.2	176.8	-168.9	-127.7	3.7	115.9
419	G	31.3	Very low	36.7	Very low	75 Å²	75	173.5 Å²	173.5	77%	0.773	84%	0.838	S	S	*	*			cis	162.5	109.4	-10.7	0	0	0	0	0	114.8
420	S	35.3	Very low	36.9	Very low	122 Å²	122	171.4 Å²	171.4	85%	0.853	84%	0.839	S	S	*	*			trans	10.6	118.5	153.5	169.4	0	0	0	0	119.2
421	D	36.7	Very low	37.3	Very low	154 Å²	154	173.9 Å²	173.9	82%	0.824	84%	0.842	S	S	*	*			trans	-157.3	176.5	131.7	-140.2	-31.8	0	0	0	113
422	V	37.8	Very low	37.5	Very low	138 Å²	138	172 Å²	172	84%	0.836	84%	0.837	S	S	*	*			trans	71.3	71.6	172	-158.5	0	0	0	0	116.7
423	M	35.4	Very low	37.9	Very low	179 Å²	179	173 Å²	173	88%	0.882	84%	0.839	S	S	*	*			trans	-132.2	102.7	155.3	-146.6	-77.4	-90.2	0	0	109.2
424	K	42.6	Very low	38.3	Very low	187 Å²	187	173 Å²	173	81%	0.813	84%	0.839	S	S	*	*			trans	-164.8	142.1	179	-115.8	154.6	-170.3	164.5	0	115.7
425	R	42.8	Very low	38.6	Very low	235 Å²	235	171.6 Å²	171.6	89%	0.887	83%	0.831	S	S	*	*			trans	75.2	97	160.5	-66.1	-179.9	173.3	151.4	-1.9	119.3
426	K	31.8	Very low	38.8	Very low	201 Å²	201	173.3 Å²	173.3	87%	0.874	84%	0.835	S	S	*	*			trans	-91.8	-179.5	138.3	-68.4	-178.5	175	-179.3	0	109.5
427	E	37.9	Very low	39.9	Very low	195 Å²	195	173.8 Å²	173.8	91%	0.911	84%	0.84	S	S	*	*			trans	81.3	119.9	163.3	-53	-175	130.9	0	0	120
428	E	39	Very low	40.5	Very low	172 Å²	172	172.6 Å²	172.6	80%	0.804	84%	0.838	S	S	*	*			trans	-171	146.2	131.3	-170.9	158.8	-160	0	0	112.3
429	I	39.1	Very low	41	Very low	148 Å²	148	165.6 Å²	165.6	76%	0.759	82%	0.823	S	S	*	*			trans	-151.9	147	-169.9	-68.5	-173.2	0	0	0	115.1
430	V	38.4	Very low	41.7	Very low	122 Å²	122	167.7 Å²	167.7	74%	0.739	82%	0.823	S	S	*	*			trans	84.3	0	155	148.4	0	0	0	0	126.5
431	R	41.3	Very low	42.2	Very low	200 Å²	200	171 Å²	171	76%	0.755	82%	0.822	S	S	*	*				0	0	0	-87	155.4	-75.7	-136.6	-15.5	114.7
432	L	41.2	Very low	41.9	Very low	162 Å²	162	173.8 Å²	173.8	85%	0.848	83%	0.827	S	S	*	*				0	0	0	-94.1	176.2	0	0	0	115.2
433	K	39.8	Very low	41.8	Very low	204 Å²	204	175.4 Å²	175.4	89%	0.887	83%	0.825	S	S	*	*				0	0	0	-63.3	-167.5	173.5	-174.7	0	121.5
434	Q	41.6	Very low	41.6	Very low	177 Å²	177	173.8 Å²	173.8	83%	0.827	83%	0.825	S	S	*	*				0	0	0	-63.7	-174.5	-107.9	0	0	127.1
435	D	44.8	Very low	41.3	Very low	130 Å²	130	174 Å²	174	70%	0.695	83%	0.829	S	S	*	*				0	0	0	-62.8	-22.5	0	0	0	115.5
436	E	48.7	Very low	40.6	Very low	201 Å²	201	171.2 Å²	171.2	94%	0.939	83%	0.826	S	S	*	*				0	0	0	-105.5	-173.5	156.8	0	0	120.5
437	E	58.2	Low	40.7	Very low	204 Å²	204	170.9 Å²	170.9	95%	0.953	82%	0.824	S	S	*	*				0	0	0	-145.4	-173.7	64.8	0	0	125.9
438	E	50.1	Low	40.4	Very low	168 Å²	168	164.7 Å²	164.7	79%	0.785	81%	0.813	S	S	*	*				0	0	0	-136.9	-69.2	98.6	0	0	124.4
439	T	46.7	Very low	40.1	Very low	104 Å²	104	164.6 Å²	164.6	64%	0.638	81%	0.81	S	S	*	*				0	0	0	73	0	0	0	0	126.6
440	P	45.8	Very low	40.6	Very low	118 Å²	118	164.8 Å²	164.8	77%	0.766	81%	0.813	S	S	*	*				0	0	0	45	-30.6	0	0	0	125.5
441	K	46	Very low	41.4	Very low	193 Å²	193	164 Å²	164	84%	0.839	80%	0.796	S	S	*	*				0	0	0	-51.6	-178.4	173.1	43.6	0	122.9
442	K	31	Very low	42	Very low	212 Å²	212	163 Å²	163	92%	0.922	80%	0.8	S	S	*	*				0	0	0	-125	176.2	-175.7	176.5	0	124.8
443	Q	35.7	Very low	42.6	Very low	171 Å²	171	164 Å²	164	80%	0.799	80%	0.801	S	S	*	*				0	0	0	49	41.5	-97.7	0	0	123
444	V	31.9	Very low	43.4	Very low	145 Å²	145	155 Å²	155	88%	0.879	76%	0.762	S	S	*	*				0	0	0	66.9	0	0	0	0	122.1
445	E	35.7	Very low	44.2	Very low	192 Å²	192	153.3 Å²	153.3	90%	0.897	75%	0.754	S	S	*	*				0	0	0	-156.9	160.9	-120.6	0	0	121.8
446	E	28	Very low	44.7	Very low	177 Å²	177	153.4 Å²	153.4	83%	0.827	75%	0.75	S	S	*	*				0	0	0	-120.8	-59.3	98.1	0	0	124.4
447	K	33.5	Very low	45.2	Very low	193 Å²	193	145.2 Å²	145.2	84%	0.839	72%	0.717	S	S	*	*				0	0	0	-145.1	-151.7	171	-175.4	0	125.1
448	G	32.7	Very low	45.4	Very low	66 Å²	66	139 Å²	139	68%	0.68	69%	0.688	S	S	*	*				0	0	0	0	0	0	0	0	124.8
449	K	33	Very low	46	Very low	170 Å²	170	137.6 Å²	137.6	74%	0.739	68%	0.683	S	S	*	*				0	164.6	0	168.3	166.4	164.6	57.4	0	118	E454	K449-E454 IonicContact NZ-OE1 2.92Å; K449-E454 PolarHBondContact NZ-OE1 3.44Å; K449-E454 IonicContact NZ-OE2 3.77Å
450	D	48	Very low	47	Very low	151 Å²	151	138.4 Å²	138.4	81%	0.807	68%	0.678	S	S	*	*			trans	-146	176.1	167.9	-158.4	1.2	0	0	0	118.9
451	R	55.5	Low	47.9	Very low	105 Å²	105	137.9 Å²	137.9	40%	0.396	66%	0.66	S	S	.	*			trans	-72.8	-120	-168.4	170.3	-174.6	-90.8	-121.9	-1	125.1	E454 E458	R451-E454 VanDerWaalsContact CB-OE2 3.23Å; R451-E454 WeakPolarHBondContact CB-OE2 3.2Å; R451-E454 WeakPolarHBondContact CD-OE2 3.46Å; R451-E454 HydrophobicContact CG-CB 4.09Å; R451-E454 HydrophobicContact CG-CG 4.47Å; R451-E454 WeakPolarHBondContact CG-OE2 3.33Å; R451-E454 IonicContact CZ-OE2 2.72Å; R451-E454 IonicContact NE-OE2 3.44Å; R451-E454 PolarHBondContact NE-OE2 2.8Å; R451-E454 IonicContact NH2-OE2 2.59Å; R451-E454 PolarHBondContact NH2-OE2 3.31Å; R451-E454 VanDerWaalsContact O-CG 3.26Å; R451-E454 WeakPolarHBondContact O-CG 3.25Å; R451-E458 IonicContact NH2-OE1 2.6Å; R451-E458 PolarHBondContact NH2-OE1 3.39Å; R451-E458 IonicContact NH2-OE2 2.6Å; R451-E458 PolarHBondContact NH2-OE2 2.91Å
452	E	53.9	Low	49.2	Very low	179 Å²	179	132.1 Å²	132.1	84%	0.836	64%	0.639	S	S	*	*	S	Bend		-106.8	-35.9	-75.5	-156.8	162.2	-93.3	0	0	128.3	E454	E452-E454 PolarHBondContact O-N 2.86Å
453	E	54.8	Low	51.2	Low	184 Å²	184	129.3 Å²	129.3	86%	0.86	63%	0.629	S	S	*	*	S	Bend	trans	-62.8	23.5	167.5	-86.5	167.4	122.9	0	0	113.1	E455 A457	E453-E455 PolarHBondContact O-N 3.32Å; E453-E455 VanDerWaalsContact O-N 3.13Å; E453-A457 WeakPolarHBondContact O-CB 3.34Å; E453-A457 PolarHBondContact O-N 3.12Å
454	E	55.3	Low	52.9	Low	15 Å²	15	127.5 Å²	127.5	7%	0.07	62%	0.62	C	S	.	*	T	Hydrogen-bonded Turn	trans	-77.7	2	-156.2	-126	-171.5	-171.8	0	0	112.6	K449 R451 E452 E458 R461	K449-E454 IonicContact NZ-OE1 2.92Å; K449-E454 PolarHBondContact NZ-OE1 3.44Å; K449-E454 IonicContact NZ-OE2 3.77Å; R451-E454 VanDerWaalsContact CB-OE2 3.23Å; R451-E454 WeakPolarHBondContact CB-OE2 3.2Å; R451-E454 WeakPolarHBondContact CD-OE2 3.46Å; R451-E454 HydrophobicContact CG-CB 4.09Å; R451-E454 HydrophobicContact CG-CG 4.47Å; R451-E454 WeakPolarHBondContact CG-OE2 3.33Å; R451-E454 IonicContact CZ-OE2 2.72Å; R451-E454 IonicContact NE-OE2 3.44Å; R451-E454 PolarHBondContact NE-OE2 2.8Å; R451-E454 IonicContact NH2-OE2 2.59Å; R451-E454 PolarHBondContact NH2-OE2 3.31Å; R451-E454 VanDerWaalsContact O-CG 3.26Å; R451-E454 WeakPolarHBondContact O-CG 3.25Å; E452-E454 PolarHBondContact O-N 2.86Å; E454-E458 VanDerWaalsContact C-N 3.33Å; E454-E458 WeakPolarHBondContact O-CA 3.24Å; E454-E458 WeakPolarHBondContact O-CB 3.23Å; E454-E458 WeakPolarHBondContact O-CG 3.41Å; E454-E458 PolarHBondContact O-N 2.86Å; E454-R461 IonicContact OE1-NH1 2.88Å; E454-R461 PolarHBondContact OE1-NH1 3.45Å
455	E	58.4	Low	54.6	Low	141 Å²	141	126.5 Å²	126.5	66%	0.659	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.6	-54.5	-176.4	-110	-175	-132.1	0	0	114.8	E453 A457 E458 M459	E453-E455 PolarHBondContact O-N 3.32Å; E453-E455 VanDerWaalsContact O-N 3.13Å; E455-A457 VanDerWaalsContact C-N 3.26Å; E455-E458 CarbonylContact O-C 3.57Å; E455-E458 WeakPolarHBondContact O-CA 3.47Å; E455-E458 WeakPolarHBondContact O-CB 3.39Å; E455-E458 PolarHBondContact O-N 2.87Å; E455-M459 PolarHBondContact O-N 3.05Å
456	E	56.8	Low	56.3	Low	132 Å²	132	124 Å²	124	62%	0.617	59%	0.592	S	S	*	*	H	α-helix	trans	-69.3	-34.1	166.7	-160.2	-160.6	135	0	0	109.9	E458 M459 K460	E456-E458 VanDerWaalsContact C-N 3.31Å; E456-M459 PolarHBondContact O-N 2.81Å; E456-M459 VanDerWaalsContact O-N 3.15Å; E456-K460 PolarHBondContact O-N 2.79Å; E456-K460 IonicContact OE1-NZ 2.75Å; E456-K460 PolarHBondContact OE1-NZ 3.26Å
457	A	59.4	Low	58.3	Low	29 Å²	29	118.3 Å²	118.3	24%	0.24	58%	0.576	C	S	.	*	H	α-helix	trans	-68.7	-25	165.6	0	0	0	0	0	112.1	E453 E455 M459 R461	E453-A457 WeakPolarHBondContact O-CB 3.34Å; E453-A457 PolarHBondContact O-N 3.12Å; E455-A457 VanDerWaalsContact C-N 3.26Å; A457-M459 VanDerWaalsContact C-N 3.33Å; A457-R461 WeakPolarHBondContact O-CA 3.3Å; A457-R461 WeakPolarHBondContact O-CB 3.35Å; A457-R461 WeakPolarHBondContact O-CD 3.32Å; A457-R461 WeakPolarHBondContact O-CG 3.12Å; A457-R461 PolarHBondContact O-N 2.93Å
458	E	61.2	Low	60	Low	73 Å²	73	116.1 Å²	116.1	34%	0.341	57%	0.568	S	S	.	*	H	α-helix	trans	-67.6	-36.1	166.3	-105.2	162.2	167.1	0	0	109.9	R451 E454 E455 E456 R461 N462	R451-E458 IonicContact NH2-OE1 2.6Å; R451-E458 PolarHBondContact NH2-OE1 3.39Å; R451-E458 IonicContact NH2-OE2 2.6Å; R451-E458 PolarHBondContact NH2-OE2 2.91Å; E454-E458 VanDerWaalsContact C-N 3.33Å; E454-E458 WeakPolarHBondContact O-CA 3.24Å; E454-E458 WeakPolarHBondContact O-CB 3.23Å; E454-E458 WeakPolarHBondContact O-CG 3.41Å; E454-E458 PolarHBondContact O-N 2.86Å; E455-E458 CarbonylContact O-C 3.57Å; E455-E458 WeakPolarHBondContact O-CA 3.47Å; E455-E458 WeakPolarHBondContact O-CB 3.39Å; E455-E458 PolarHBondContact O-N 2.87Å; E456-E458 VanDerWaalsContact C-N 3.31Å; E458-R461 CarbonylContact O-C 3.59Å; E458-N462 WeakPolarHBondContact O-CA 3.38Å; E458-N462 WeakPolarHBondContact O-CB 3.31Å; E458-N462 PolarHBondContact O-N 3.17Å; E458-N462 PolarHBondContact O-ND2 3.04Å
459	M	62.8	Low	61.6	Low	140 Å²	140	116.2 Å²	116.2	69%	0.69	56%	0.559	S	S	*	*	H	α-helix	trans	-68.4	-45.8	179.7	-126.2	-175.8	-58.2	0	0	111.5	E455 E456 A457 N462 E463	E455-M459 PolarHBondContact O-N 3.05Å; E456-M459 PolarHBondContact O-N 2.81Å; E456-M459 VanDerWaalsContact O-N 3.15Å; A457-M459 VanDerWaalsContact C-N 3.33Å; M459-N462 PolarHBondContact O-N 2.81Å; M459-E463 PolarHBondContact O-N 3.33Å; M459-E463 VanDerWaalsContact O-N 3.13Å
460	K	68.6	Low	63.3	Low	121 Å²	121	112.1 Å²	112.1	53%	0.526	55%	0.548	S	S	.	.	H	α-helix	trans	-67.9	-43.3	173.3	-79.5	173.5	-179.1	132	0	112.4	E456 N462 E463 E464	E456-K460 PolarHBondContact O-N 2.79Å; E456-K460 IonicContact OE1-NZ 2.75Å; E456-K460 PolarHBondContact OE1-NZ 3.26Å; K460-N462 VanDerWaalsContact C-N 3.27Å; K460-N462 PolarHBondContact O-N 2.9Å; K460-E463 PolarHBondContact O-N 3.45Å; K460-E464 WeakPolarHBondContact O-CB 3.3Å; K460-E464 WeakPolarHBondContact O-CG 3.15Å; K460-E464 PolarHBondContact O-N 3.5Å
461	R	64.4	Low	64.3	Low	106 Å²	106	114 Å²	114	40%	0.4	54%	0.544	S	S	.	.	H	α-helix	trans	-62.9	-30.6	171.1	-68.4	169.3	-147.5	-178.8	10.2	111.3	E454 A457 E458 E464 E465	E454-R461 IonicContact OE1-NH1 2.88Å; E454-R461 PolarHBondContact OE1-NH1 3.45Å; A457-R461 WeakPolarHBondContact O-CA 3.3Å; A457-R461 WeakPolarHBondContact O-CB 3.35Å; A457-R461 WeakPolarHBondContact O-CD 3.32Å; A457-R461 WeakPolarHBondContact O-CG 3.12Å; A457-R461 PolarHBondContact O-N 2.93Å; E458-R461 CarbonylContact O-C 3.59Å; R461-E464 PolarHBondContact O-N 3.01Å; R461-E465 VanDerWaalsContact O-CA 3.26Å; R461-E465 WeakPolarHBondContact O-CA 3.4Å; R461-E465 WeakPolarHBondContact O-CB 3.41Å; R461-E465 PolarHBondContact O-N 3.17Å
462	N	73	Confident	64.9	Low	72 Å²	72	110.5 Å²	110.5	39%	0.385	54%	0.541	S	S	.	.	H	α-helix	trans	-74	-28.8	176.5	-92.9	-87.8	0	0	0	111.8	E458 M459 K460 K466	E458-N462 WeakPolarHBondContact O-CA 3.38Å; E458-N462 WeakPolarHBondContact O-CB 3.31Å; E458-N462 PolarHBondContact O-N 3.17Å; E458-N462 PolarHBondContact O-ND2 3.04Å; M459-N462 PolarHBondContact O-N 2.81Å; K460-N462 VanDerWaalsContact C-N 3.27Å; K460-N462 PolarHBondContact O-N 2.9Å; N462-K466 WeakPolarHBondContact O-CB 3.48Å; N462-K466 WeakPolarHBondContact O-CD 3.4Å; N462-K466 WeakPolarHBondContact O-CG 3.42Å; N462-K466 PolarHBondContact O-N 3.02Å
463	E	72.7	Confident	65.7	Low	153 Å²	153	108.3 Å²	108.3	72%	0.715	53%	0.53	S	S	*	.	H	α-helix	trans	-76.3	-44.6	168.4	-74.6	-159.5	126	0	0	111.7	M459 K460 K466 A467	M459-E463 PolarHBondContact O-N 3.33Å; M459-E463 VanDerWaalsContact O-N 3.13Å; K460-E463 PolarHBondContact O-N 3.45Å; E463-K466 PolarHBondContact O-N 2.61Å; E463-A467 WeakPolarHBondContact O-CB 3.07Å; E463-A467 PolarHBondContact O-N 2.65Å
464	E	71	Confident	66.3	Low	133 Å²	133	106.5 Å²	106.5	62%	0.621	52%	0.52	S	S	*	.	H	α-helix	trans	-67.9	-35.9	177.1	-70.9	-172.2	128.5	0	0	112.4	K460 R461 A467 E468	K460-E464 WeakPolarHBondContact O-CB 3.3Å; K460-E464 WeakPolarHBondContact O-CG 3.15Å; K460-E464 PolarHBondContact O-N 3.5Å; R461-E464 PolarHBondContact O-N 3.01Å; E464-A467 CarbonylContact O-C 3.5Å; E464-A467 PolarHBondContact O-N 3.04Å; E464-E468 WeakPolarHBondContact O-CA 3.33Å; E464-E468 WeakPolarHBondContact O-CB 3.45Å; E464-E468 PolarHBondContact O-N 3.11Å
465	E	68.5	Low	67.2	Low	124 Å²	124	109 Å²	109	58%	0.579	54%	0.536	S	S	*	.	H	α-helix	trans	-78.2	-23.5	173.9	-173	176.2	-156.3	0	0	110.9	R461 S469	R461-E465 VanDerWaalsContact O-CA 3.26Å; R461-E465 WeakPolarHBondContact O-CA 3.4Å; R461-E465 WeakPolarHBondContact O-CB 3.41Å; R461-E465 PolarHBondContact O-N 3.17Å; E465-S469 VanDerWaalsContact O-CA 3.3Å; E465-S469 WeakPolarHBondContact O-CA 3.27Å; E465-S469 WeakPolarHBondContact O-CB 3.35Å; E465-S469 PolarHBondContact O-N 3.32Å
466	K	70.4	Confident	67.8	Low	140 Å²	140	107.2 Å²	107.2	61%	0.609	53%	0.527	S	S	*	.	H	α-helix	trans	-74.2	-37.6	163	-83	172.9	-178.6	168.5	0	111.8	N462 E463 T470	N462-K466 WeakPolarHBondContact O-CB 3.48Å; N462-K466 WeakPolarHBondContact O-CD 3.4Å; N462-K466 WeakPolarHBondContact O-CG 3.42Å; N462-K466 PolarHBondContact O-N 3.02Å; E463-K466 PolarHBondContact O-N 2.61Å; K466-T470 WeakPolarHBondContact O-CB 3.4Å; K466-T470 WeakPolarHBondContact O-CG2 3.3Å; K466-T470 PolarHBondContact O-N 3.39Å; K466-T470 PolarHBondContact O-OG1 2.89Å
467	A	69.7	Low	68.4	Low	58 Å²	58	103.8 Å²	103.8	48%	0.479	52%	0.518	S	S	.	.	H	α-helix	trans	-68.9	-36.3	173.9	0	0	0	0	0	111.6	E463 E464 T470 R471	E463-A467 WeakPolarHBondContact O-CB 3.07Å; E463-A467 PolarHBondContact O-N 2.65Å; E464-A467 CarbonylContact O-C 3.5Å; E464-A467 PolarHBondContact O-N 3.04Å; A467-T470 PolarHBondContact O-OG1 3.1Å; A467-R471 WeakPolarHBondContact O-CB 3.5Å; A467-R471 PolarHBondContact O-N 2.77Å
468	E	69.3	Low	69.2	Low	146 Å²	146	108.2 Å²	108.2	68%	0.682	53%	0.532	S	S	*	.	H	α-helix	trans	-85.2	-27.7	178.5	-173.2	160.1	-131.5	0	0	112.2	E464 G472	E464-E468 WeakPolarHBondContact O-CA 3.33Å; E464-E468 WeakPolarHBondContact O-CB 3.45Å; E464-E468 PolarHBondContact O-N 3.11Å; E468-G472 WeakPolarHBondContact O-CA 3.5Å; E468-G472 PolarHBondContact O-N 3.35Å
469	S	67.8	Low	70	Confident	69 Å²	69	113 Å²	113	48%	0.483	55%	0.547	S	S	.	.	H	α-helix	trans	-66.6	-52.5	164.8	173	0	0	0	0	110	E465 R471 G472 E473	E465-S469 VanDerWaalsContact O-CA 3.3Å; E465-S469 WeakPolarHBondContact O-CA 3.27Å; E465-S469 WeakPolarHBondContact O-CB 3.35Å; E465-S469 PolarHBondContact O-N 3.32Å; S469-R471 VanDerWaalsContact C-N 3.32Å; S469-R471 PolarHBondContact O-N 2.81Å; S469-G472 CarbonylContact O-C 3.41Å; S469-G472 PolarHBondContact O-N 3.23Å; S469-G472 VanDerWaalsContact O-N 3.15Å; S469-E473 WeakPolarHBondContact O-CB 3.14Å; S469-E473 PolarHBondContact O-N 3.21Å
470	T	67	Low	70.5	Confident	84 Å²	84	111.9 Å²	111.9	52%	0.515	54%	0.538	S	S	.	.	H	α-helix	trans	-67.3	-31.4	178.5	54	0	0	0	0	112.8	K466 A467 K474	K466-T470 WeakPolarHBondContact O-CB 3.4Å; K466-T470 WeakPolarHBondContact O-CG2 3.3Å; K466-T470 PolarHBondContact O-N 3.39Å; K466-T470 PolarHBondContact O-OG1 2.89Å; A467-T470 PolarHBondContact O-OG1 3.1Å; T470-K474 WeakPolarHBondContact O-CB 3.29Å; T470-K474 PolarHBondContact O-N 3.5Å; T470-K474 VanDerWaalsContact O-N 3.1Å
471	R	70.7	Confident	70.9	Confident	190 Å²	190	111.9 Å²	111.9	72%	0.717	54%	0.54	S	S	*	.	H	α-helix	trans	-73.3	-37	170.4	-174.8	178.3	-172.6	170.7	0.7	112.2	A467 S469 K474 V475	A467-R471 WeakPolarHBondContact O-CB 3.5Å; A467-R471 PolarHBondContact O-N 2.77Å; S469-R471 VanDerWaalsContact C-N 3.32Å; S469-R471 PolarHBondContact O-N 2.81Å; R471-K474 CarbonylContact O-C 3.49Å; R471-K474 PolarHBondContact O-N 3.15Å; R471-V475 WeakPolarHBondContact O-CB 3.44Å; R471-V475 VanDerWaalsContact O-CG2 3.27Å; R471-V475 WeakPolarHBondContact O-CG2 3.43Å; R471-V475 PolarHBondContact O-N 3.07Å
472	G	68	Low	71.4	Confident	32 Å²	32	112 Å²	112	33%	0.33	55%	0.545	S	S	.	.	H	α-helix	trans	-69.3	-50.5	179.2	0	0	0	0	0	111.2	E468 S469 K474 V475 E476	E468-G472 WeakPolarHBondContact O-CA 3.5Å; E468-G472 PolarHBondContact O-N 3.35Å; S469-G472 CarbonylContact O-C 3.41Å; S469-G472 PolarHBondContact O-N 3.23Å; S469-G472 VanDerWaalsContact O-N 3.15Å; G472-K474 VanDerWaalsContact C-N 3.27Å; G472-K474 PolarHBondContact O-N 3.44Å; G472-V475 CarbonylContact O-C 3.58Å; G472-V475 WeakPolarHBondContact O-CA 3.39Å; G472-V475 PolarHBondContact O-N 2.97Å; G472-E476 VanDerWaalsContact O-CB 3.32Å; G472-E476 WeakPolarHBondContact O-CB 3.37Å; G472-E476 PolarHBondContact O-N 3.21Å
473	E	70.1	Confident	71.7	Confident	133 Å²	133	113.2 Å²	113.2	62%	0.621	55%	0.548	S	S	*	.	H	α-helix	trans	-57.1	-38.3	169.5	-173.7	177.8	-135.8	0	0	111.2	S469 V475 E476 S477	S469-E473 WeakPolarHBondContact O-CB 3.14Å; S469-E473 PolarHBondContact O-N 3.21Å; E473-V475 VanDerWaalsContact C-N 3.35Å; E473-E476 PolarHBondContact O-N 3.01Å; E473-S477 WeakPolarHBondContact O-CB 3.21Å; E473-S477 PolarHBondContact O-N 2.9Å; E473-S477 PolarHBondContact O-OG 2.9Å
474	K	68.3	Low	71.7	Confident	146 Å²	146	109.6 Å²	109.6	64%	0.635	54%	0.537	S	S	*	.	H	α-helix	trans	-73.2	-20.7	173.3	-168.8	165.7	-172.3	168.7	0	114.5	T470 R471 G472 S477 K478	T470-K474 WeakPolarHBondContact O-CB 3.29Å; T470-K474 PolarHBondContact O-N 3.5Å; T470-K474 VanDerWaalsContact O-N 3.1Å; R471-K474 CarbonylContact O-C 3.49Å; R471-K474 PolarHBondContact O-N 3.15Å; G472-K474 VanDerWaalsContact C-N 3.27Å; G472-K474 PolarHBondContact O-N 3.44Å; K474-S477 WeakPolarHBondContact CA-OG 3.21Å; K474-S477 PolarHBondContact O-OG 2.93Å; K474-K478 WeakPolarHBondContact O-CB 3.24Å; K474-K478 WeakPolarHBondContact O-CG 3.5Å
475	V	73.7	Confident	72.2	Confident	67 Å²	67	106.5 Å²	106.5	41%	0.406	53%	0.527	S	S	.	.	H	α-helix	trans	-88.1	-33.8	171.3	164.3	0	0	0	0	111	R471 G472 E473 R479	R471-V475 WeakPolarHBondContact O-CB 3.44Å; R471-V475 VanDerWaalsContact O-CG2 3.27Å; R471-V475 WeakPolarHBondContact O-CG2 3.43Å; R471-V475 PolarHBondContact O-N 3.07Å; G472-V475 CarbonylContact O-C 3.58Å; G472-V475 WeakPolarHBondContact O-CA 3.39Å; G472-V475 PolarHBondContact O-N 2.97Å; E473-V475 VanDerWaalsContact C-N 3.35Å; V475-R479 WeakPolarHBondContact O-CB 3.45Å; V475-R479 VanDerWaalsContact O-CG 3.3Å; V475-R479 WeakPolarHBondContact O-CG 3.43Å; V475-R479 PolarHBondContact O-N 3.34Å
476	E	69.6	Low	72.8	Confident	103 Å²	103	105.9 Å²	105.9	48%	0.481	52%	0.522	S	S	.	.	H	α-helix	trans	-79.5	-39.1	-179.2	-163.1	-174.6	135.7	0	0	111.4	G472 E473 R479 K480	G472-E476 VanDerWaalsContact O-CB 3.32Å; G472-E476 WeakPolarHBondContact O-CB 3.37Å; G472-E476 PolarHBondContact O-N 3.21Å; E473-E476 PolarHBondContact O-N 3.01Å; E476-R479 PolarHBondContact O-N 3.38Å; E476-K480 HydrophobicContact CG-CD 4.33Å; E476-K480 WeakPolarHBondContact O-CB 3.36Å; E476-K480 VanDerWaalsContact O-CG 3.28Å; E476-K480 WeakPolarHBondContact O-CG 3.41Å; E476-K480 PolarHBondContact O-N 3.29Å; E476-K480 VanDerWaalsContact OE1-CE 3.22Å; E476-K480 WeakPolarHBondContact OE1-CE 3.42Å; E476-K480 IonicContact OE1-NZ 2.94Å; E476-K480 PolarHBondContact OE1-NZ 2.66Å
477	S	71.2	Confident	73.3	Confident	60 Å²	60	104.7 Å²	104.7	42%	0.42	52%	0.517	S	S	.	.	H	α-helix	trans	-58.3	-47.8	166	51.3	0	0	0	0	110.7	E473 K474 R479 K480 E481	E473-S477 WeakPolarHBondContact O-CB 3.21Å; E473-S477 PolarHBondContact O-N 2.9Å; E473-S477 PolarHBondContact O-OG 2.9Å; K474-S477 WeakPolarHBondContact CA-OG 3.21Å; K474-S477 PolarHBondContact O-OG 2.93Å; S477-R479 VanDerWaalsContact C-N 3.35Å; S477-R479 PolarHBondContact O-N 2.89Å; S477-K480 CarbonylContact O-C 3.57Å; S477-K480 PolarHBondContact O-N 3.3Å; S477-E481 VanDerWaalsContact O-CB 3.28Å; S477-E481 WeakPolarHBondContact O-CB 3.3Å; S477-E481 PolarHBondContact O-N 3.02Å
478	K	75	Confident	73.7	Confident	122 Å²	122	108.5 Å²	108.5	53%	0.53	53%	0.525	S	S	.	.	H	α-helix	trans	-61	-37.1	172.9	-83.5	-171	166.6	-134.9	0	114.1	K474 E481 E482	K474-K478 WeakPolarHBondContact O-CB 3.24Å; K474-K478 WeakPolarHBondContact O-CG 3.5Å; K478-E481 PolarHBondContact O-N 3.4Å; K478-E482 WeakPolarHBondContact O-CB 3.36Å; K478-E482 PolarHBondContact O-N 3.12Å
479	R	77.8	Confident	74.4	Confident	175 Å²	175	107.1 Å²	107.1	66%	0.66	52%	0.519	S	S	*	.	H	α-helix	trans	-67.6	-41	174.1	-81.8	175	172	-179.4	-2	111.6	V475 E476 S477 E482 E483	V475-R479 WeakPolarHBondContact O-CB 3.45Å; V475-R479 VanDerWaalsContact O-CG 3.3Å; V475-R479 WeakPolarHBondContact O-CG 3.43Å; V475-R479 PolarHBondContact O-N 3.34Å; E476-R479 PolarHBondContact O-N 3.38Å; S477-R479 VanDerWaalsContact C-N 3.35Å; S477-R479 PolarHBondContact O-N 2.89Å; R479-E482 PolarHBondContact O-N 3.3Å; R479-E483 WeakPolarHBondContact O-CB 3.3Å; R479-E483 PolarHBondContact O-N 3.31Å
480	K	74.1	Confident	75	Confident	115 Å²	115	107.9 Å²	107.9	50%	0.5	52%	0.515	S	S	.	.	H	α-helix	trans	-66.8	-36.9	174.8	-74.3	164.4	172.1	168.5	0	111.6	E476 S477 E483 T484	E476-K480 HydrophobicContact CG-CD 4.33Å; E476-K480 WeakPolarHBondContact O-CB 3.36Å; E476-K480 VanDerWaalsContact O-CG 3.28Å; E476-K480 WeakPolarHBondContact O-CG 3.41Å; E476-K480 PolarHBondContact O-N 3.29Å; E476-K480 VanDerWaalsContact OE1-CE 3.22Å; E476-K480 WeakPolarHBondContact OE1-CE 3.42Å; E476-K480 IonicContact OE1-NZ 2.94Å; E476-K480 PolarHBondContact OE1-NZ 2.66Å; S477-K480 CarbonylContact O-C 3.57Å; S477-K480 PolarHBondContact O-N 3.3Å; K480-E483 PolarHBondContact O-N 3.34Å; K480-T484 WeakPolarHBondContact O-CB 3.33Å; K480-T484 WeakPolarHBondContact O-CG2 3.26Å; K480-T484 PolarHBondContact O-N 3.22Å; K480-T484 PolarHBondContact O-OG1 2.85Å
481	E	75.7	Confident	75.7	Confident	121 Å²	121	107.3 Å²	107.3	57%	0.565	51%	0.511	S	S	*	.	H	α-helix	trans	-65.1	-49.6	172.4	-169.9	175	-152	0	0	110.7	S477 K478 E483 T484 V485	S477-E481 VanDerWaalsContact O-CB 3.28Å; S477-E481 WeakPolarHBondContact O-CB 3.3Å; S477-E481 PolarHBondContact O-N 3.02Å; K478-E481 PolarHBondContact O-N 3.4Å; E481-E483 VanDerWaalsContact C-N 3.34Å; E481-E483 PolarHBondContact O-N 2.88Å; E481-T484 WeakPolarHBondContact CA-OG1 3.1Å; E481-T484 PolarHBondContact O-N 3.29Å; E481-T484 PolarHBondContact O-OG1 3.08Å; E481-V485 WeakPolarHBondContact O-CB 3.34Å; E481-V485 VanDerWaalsContact O-CG2 3.3Å; E481-V485 WeakPolarHBondContact O-CG2 3.28Å; E481-V485 PolarHBondContact O-N 3.27Å
482	E	76.9	Confident	76.2	Confident	108 Å²	108	103.1 Å²	103.1	51%	0.505	50%	0.499	S	S	.	.	H	α-helix	trans	-61.9	-36.8	172.6	-83	-169.2	-143.7	0	0	113.4	K478 R479 K486	K478-E482 WeakPolarHBondContact O-CB 3.36Å; K478-E482 PolarHBondContact O-N 3.12Å; R479-E482 PolarHBondContact O-N 3.3Å; E482-K486 WeakPolarHBondContact O-CB 3.3Å; E482-K486 VanDerWaalsContact O-CD 3.28Å; E482-K486 WeakPolarHBondContact O-CD 3.39Å; E482-K486 WeakPolarHBondContact O-CG 3.3Å; E482-K486 PolarHBondContact O-N 3.01Å; E482-K486 IonicContact OE2-NZ 2.71Å; E482-K486 PolarHBondContact OE2-NZ 3.15Å
483	E	77.9	Confident	77	Confident	98 Å²	98	107.5 Å²	107.5	46%	0.458	51%	0.506	S	S	.	.	H	α-helix	trans	-74.3	-36.4	179.7	-167.7	-171.2	145.1	0	0	111.7	R479 K480 E481 K487	R479-E483 WeakPolarHBondContact O-CB 3.3Å; R479-E483 PolarHBondContact O-N 3.31Å; K480-E483 PolarHBondContact O-N 3.34Å; E481-E483 VanDerWaalsContact C-N 3.34Å; E481-E483 PolarHBondContact O-N 2.88Å; E483-K487 HydrophobicContact CG-CD 4.44Å; E483-K487 WeakPolarHBondContact O-CB 3.28Å; E483-K487 VanDerWaalsContact O-CG 3.27Å; E483-K487 WeakPolarHBondContact O-CG 3.33Å; E483-K487 PolarHBondContact O-N 3.39Å; E483-K487 VanDerWaalsContact OE1-CE 3.26Å; E483-K487 WeakPolarHBondContact OE1-CE 3.31Å; E483-K487 IonicContact OE1-NZ 3.37Å; E483-K487 PolarHBondContact OE1-NZ 2.88Å
484	T	73.6	Confident	77.6	Confident	77 Å²	77	106.6 Å²	106.6	47%	0.472	50%	0.5	S	S	.	.	H	α-helix	trans	-67.9	-45.8	172.4	43.3	0	0	0	0	111	K480 E481 K486 K487 E488	K480-T484 WeakPolarHBondContact O-CB 3.33Å; K480-T484 WeakPolarHBondContact O-CG2 3.26Å; K480-T484 PolarHBondContact O-N 3.22Å; K480-T484 PolarHBondContact O-OG1 2.85Å; E481-T484 WeakPolarHBondContact CA-OG1 3.1Å; E481-T484 PolarHBondContact O-N 3.29Å; E481-T484 PolarHBondContact O-OG1 3.08Å; T484-K486 PolarHBondContact O-N 3.42Å; T484-K487 PolarHBondContact O-N 3.1Å; T484-K487 VanDerWaalsContact O-N 3.13Å; T484-E488 WeakPolarHBondContact O-CG 3.3Å; T484-E488 PolarHBondContact O-N 3.32Å
485	V	81	Confident	78.3	Confident	69 Å²	69	107.5 Å²	107.5	42%	0.418	50%	0.499	S	S	.	.	H	α-helix	trans	-57.5	-45.8	172.7	170.8	0	0	0	0	111.5	E481 K487 E488 E489	E481-V485 WeakPolarHBondContact O-CB 3.34Å; E481-V485 VanDerWaalsContact O-CG2 3.3Å; E481-V485 WeakPolarHBondContact O-CG2 3.28Å; E481-V485 PolarHBondContact O-N 3.27Å; V485-K487 VanDerWaalsContact C-N 3.32Å; V485-K487 PolarHBondContact O-N 3.48Å; V485-E488 PolarHBondContact O-N 2.89Å; V485-E489 HydrophobicContact CG1-CG 4.47Å; V485-E489 WeakPolarHBondContact O-CB 3.32Å; V485-E489 WeakPolarHBondContact O-CG 3.42Å; V485-E489 PolarHBondContact O-N 3.22Å
486	K	81.9	Confident	78.7	Confident	110 Å²	110	109 Å²	109	48%	0.478	50%	0.5	S	S	.	.	H	α-helix	trans	-63.5	-34.9	176.8	-74.3	161.9	-165.6	158.6	0	112.8	E482 T484 E490	E482-K486 WeakPolarHBondContact O-CB 3.3Å; E482-K486 VanDerWaalsContact O-CD 3.28Å; E482-K486 WeakPolarHBondContact O-CD 3.39Å; E482-K486 WeakPolarHBondContact O-CG 3.3Å; E482-K486 PolarHBondContact O-N 3.01Å; E482-K486 IonicContact OE2-NZ 2.71Å; E482-K486 PolarHBondContact OE2-NZ 3.15Å; T484-K486 PolarHBondContact O-N 3.42Å; K486-E490 WeakPolarHBondContact O-CB 3.47Å; K486-E490 PolarHBondContact O-N 3.41Å
487	K	79.7	Confident	79.3	Confident	116 Å²	116	109.7 Å²	109.7	50%	0.504	50%	0.504	S	S	.	.	H	α-helix	trans	-71	-39.8	174.2	-77.6	171.7	-178.1	171.5	0	112.2	E483 T484 V485 E490 V491	E483-K487 HydrophobicContact CG-CD 4.44Å; E483-K487 WeakPolarHBondContact O-CB 3.28Å; E483-K487 VanDerWaalsContact O-CG 3.27Å; E483-K487 WeakPolarHBondContact O-CG 3.33Å; E483-K487 PolarHBondContact O-N 3.39Å; E483-K487 VanDerWaalsContact OE1-CE 3.26Å; E483-K487 WeakPolarHBondContact OE1-CE 3.31Å; E483-K487 IonicContact OE1-NZ 3.37Å; E483-K487 PolarHBondContact OE1-NZ 2.88Å; T484-K487 PolarHBondContact O-N 3.1Å; T484-K487 VanDerWaalsContact O-N 3.13Å; V485-K487 VanDerWaalsContact C-N 3.32Å; V485-K487 PolarHBondContact O-N 3.48Å; K487-E490 PolarHBondContact O-N 3.05Å; K487-V491 WeakPolarHBondContact O-CB 3Å; K487-V491 VanDerWaalsContact O-CG2 3.29Å; K487-V491 WeakPolarHBondContact O-CG2 3.47Å; K487-V491 PolarHBondContact O-N 3.24Å
488	E	78.8	Confident	79.6	Confident	138 Å²	138	113.4 Å²	113.4	65%	0.645	51%	0.514	S	S	*	.	H	α-helix	trans	-66.1	-43.6	174.3	-71.8	-174.8	155.2	0	0	111.3	T484 V485 E490 V491 E492	T484-E488 WeakPolarHBondContact O-CG 3.3Å; T484-E488 PolarHBondContact O-N 3.32Å; V485-E488 PolarHBondContact O-N 2.89Å; E488-E490 VanDerWaalsContact C-N 3.32Å; E488-E490 PolarHBondContact O-N 3.34Å; E488-V491 PolarHBondContact O-N 3.21Å; E488-E492 WeakPolarHBondContact O-CB 3.35Å; E488-E492 PolarHBondContact O-N 3.41Å
489	E	82.8	Confident	79.8	Confident	117 Å²	117	113.9 Å²	113.9	55%	0.547	52%	0.518	S	S	.	.	H	α-helix	trans	-59.9	-38.1	171.8	-76.5	-171.8	164.1	0	0	112.6	V485 R493	V485-E489 HydrophobicContact CG1-CG 4.47Å; V485-E489 WeakPolarHBondContact O-CB 3.32Å; V485-E489 WeakPolarHBondContact O-CG 3.42Å; V485-E489 PolarHBondContact O-N 3.22Å; E489-R493 WeakPolarHBondContact O-CB 3.3Å; E489-R493 PolarHBondContact O-N 2.84Å
490	E	81.9	Confident	80	Confident	85 Å²	85	112.4 Å²	112.4	40%	0.397	52%	0.517	S	S	.	.	H	α-helix	trans	-71.3	-40.8	176.1	-166.3	-172.3	130.6	0	0	112.2	K486 K487 E488 R493 K494	K486-E490 WeakPolarHBondContact O-CB 3.47Å; K486-E490 PolarHBondContact O-N 3.41Å; K487-E490 PolarHBondContact O-N 3.05Å; E488-E490 VanDerWaalsContact C-N 3.32Å; E488-E490 PolarHBondContact O-N 3.34Å; E490-R493 PolarHBondContact O-N 3.22Å; E490-K494 HydrophobicContact CG-CD 4.37Å; E490-K494 WeakPolarHBondContact O-CB 3.36Å; E490-K494 WeakPolarHBondContact O-CG 3.46Å; E490-K494 PolarHBondContact O-N 3.3Å; E490-K494 WeakPolarHBondContact OE1-CE 3.04Å; E490-K494 IonicContact OE1-NZ 3.92Å; E490-K494 PolarHBondContact OE1-NZ 2.64Å
491	V	81.4	Confident	80.2	Confident	72 Å²	72	109.7 Å²	109.7	44%	0.436	52%	0.516	S	S	.	.	H	α-helix	trans	-65.1	-41.9	175.3	167.1	0	0	0	0	111.1	K487 E488 K494 R495	K487-V491 WeakPolarHBondContact O-CB 3Å; K487-V491 VanDerWaalsContact O-CG2 3.29Å; K487-V491 WeakPolarHBondContact O-CG2 3.47Å; K487-V491 PolarHBondContact O-N 3.24Å; E488-V491 PolarHBondContact O-N 3.21Å; V491-K494 PolarHBondContact O-N 2.84Å; V491-R495 WeakPolarHBondContact O-CB 3.47Å; V491-R495 WeakPolarHBondContact O-CG 3.27Å; V491-R495 PolarHBondContact O-N 2.9Å
492	E	80.6	Confident	80.3	Confident	101 Å²	101	110.9 Å²	110.9	47%	0.472	52%	0.521	S	S	.	.	H	α-helix	trans	-70.8	-34.2	176.9	-169.8	169.1	133.7	0	0	112.1	E488 R495 K496	E488-E492 WeakPolarHBondContact O-CB 3.35Å; E488-E492 PolarHBondContact O-N 3.41Å; E492-R495 PolarHBondContact O-N 3.23Å; E492-K496 HydrophobicContact CG-CD 4.23Å; E492-K496 WeakPolarHBondContact O-CB 3.48Å; E492-K496 WeakPolarHBondContact O-CG 3.42Å; E492-K496 PolarHBondContact O-N 3.22Å; E492-K496 VanDerWaalsContact OE1-CE 3.26Å; E492-K496 WeakPolarHBondContact OE1-CE 3.29Å; E492-K496 IonicContact OE1-NZ 2.57Å; E492-K496 PolarHBondContact OE1-NZ 3.29Å
493	R	84.8	Confident	80.2	Confident	125 Å²	125	109.4 Å²	109.4	47%	0.472	52%	0.523	S	S	.	.	H	α-helix	trans	-62.7	-47.5	171	-166.2	-172	-43.3	123.4	14.2	111.2	E489 E490 K496 E497	E489-R493 WeakPolarHBondContact O-CB 3.3Å; E489-R493 PolarHBondContact O-N 2.84Å; E490-R493 PolarHBondContact O-N 3.22Å; R493-K496 CarbonylContact O-C 3.48Å; R493-K496 PolarHBondContact O-N 2.59Å; R493-E497 WeakPolarHBondContact O-CG 3.32Å; R493-E497 PolarHBondContact O-N 2.72Å
494	K	83.8	Confident	80	Confident	114 Å²	114	108.6 Å²	108.6	50%	0.496	53%	0.525	S	S	.	.	H	α-helix	trans	-60.6	-44.4	175.7	-78.4	170.5	170.9	170.1	0	112.1	E490 V491 K496 E497 E498	E490-K494 HydrophobicContact CG-CD 4.37Å; E490-K494 WeakPolarHBondContact O-CB 3.36Å; E490-K494 WeakPolarHBondContact O-CG 3.46Å; E490-K494 PolarHBondContact O-N 3.3Å; E490-K494 WeakPolarHBondContact OE1-CE 3.04Å; E490-K494 IonicContact OE1-NZ 3.92Å; E490-K494 PolarHBondContact OE1-NZ 2.64Å; V491-K494 PolarHBondContact O-N 2.84Å; K494-K496 PolarHBondContact O-N 2.74Å; K494-E497 PolarHBondContact O-N 2.72Å; K494-E497 VanDerWaalsContact O-N 3.17Å; K494-E498 WeakPolarHBondContact O-CB 3.31Å; K494-E498 PolarHBondContact O-N 3.4Å
495	R	81.7	Confident	80.1	Confident	165 Å²	165	114.2 Å²	114.2	62%	0.623	54%	0.537	S	S	*	.	H	α-helix	trans	-57.8	-44.3	172.8	-77.4	174.5	173.7	166.6	-1.1	112.3	V491 E492 E497 E498 E499	V491-R495 WeakPolarHBondContact O-CB 3.47Å; V491-R495 WeakPolarHBondContact O-CG 3.27Å; V491-R495 PolarHBondContact O-N 2.9Å; E492-R495 PolarHBondContact O-N 3.23Å; R495-E497 VanDerWaalsContact C-N 3.3Å; R495-E497 PolarHBondContact O-N 2.8Å; R495-E498 PolarHBondContact O-N 2.9Å; R495-E499 VanDerWaalsContact O-CB 3.23Å; R495-E499 WeakPolarHBondContact O-CB 3.27Å; R495-E499 PolarHBondContact O-N 2.84Å
496	K	82.7	Confident	79.7	Confident	97 Å²	97	112.7 Å²	112.7	42%	0.422	54%	0.536	S	S	.	.	H	α-helix	trans	-72.5	-19.3	178	-72.3	172.2	-176	170.8	0	114	E492 R493 K494 K500	E492-K496 HydrophobicContact CG-CD 4.23Å; E492-K496 WeakPolarHBondContact O-CB 3.48Å; E492-K496 WeakPolarHBondContact O-CG 3.42Å; E492-K496 PolarHBondContact O-N 3.22Å; E492-K496 VanDerWaalsContact OE1-CE 3.26Å; E492-K496 WeakPolarHBondContact OE1-CE 3.29Å; E492-K496 IonicContact OE1-NZ 2.57Å; E492-K496 PolarHBondContact OE1-NZ 3.29Å; R493-K496 CarbonylContact O-C 3.48Å; R493-K496 PolarHBondContact O-N 2.59Å; K494-K496 PolarHBondContact O-N 2.74Å; K496-K500 VanDerWaalsContact O-CD 3.26Å; K496-K500 WeakPolarHBondContact O-CD 3.22Å; K496-K500 WeakPolarHBondContact O-CG 3.3Å
497	E	81.8	Confident	79.4	Confident	119 Å²	119	113.5 Å²	113.5	56%	0.556	54%	0.541	S	S	*	.	H	α-helix	trans	-81.8	-41.5	169.9	-74.8	170.5	179.5	0	0	110.9	R493 K494 R495 K500 A501	R493-E497 WeakPolarHBondContact O-CG 3.32Å; R493-E497 PolarHBondContact O-N 2.72Å; K494-E497 PolarHBondContact O-N 2.72Å; K494-E497 VanDerWaalsContact O-N 3.17Å; R495-E497 VanDerWaalsContact C-N 3.3Å; R495-E497 PolarHBondContact O-N 2.8Å; E497-K500 PolarHBondContact O-N 2.74Å; E497-A501 WeakPolarHBondContact O-CB 3.43Å; E497-A501 PolarHBondContact O-N 3.48Å
498	E	78.5	Confident	79.1	Confident	137 Å²	137	114.8 Å²	114.8	64%	0.64	55%	0.547	S	S	*	.	H	α-helix	trans	-65.9	-45.2	176.1	-170.8	164.8	-143.6	0	0	112	K494 R495 K500 A501 E502	K494-E498 WeakPolarHBondContact O-CB 3.31Å; K494-E498 PolarHBondContact O-N 3.4Å; R495-E498 PolarHBondContact O-N 2.9Å; E498-K500 VanDerWaalsContact C-N 3.29Å; E498-K500 PolarHBondContact O-N 3.34Å; E498-A501 CarbonylContact O-C 3.53Å; E498-A501 WeakPolarHBondContact O-CB 3.37Å; E498-A501 PolarHBondContact O-N 3.45Å; E498-A501 VanDerWaalsContact O-N 3.1Å; E498-E502 WeakPolarHBondContact O-CB 3.39Å; E498-E502 PolarHBondContact O-N 3.4Å
499	E	79.1	Confident	78.9	Confident	133 Å²	133	111.5 Å²	111.5	62%	0.621	54%	0.536	S	S	*	.	H	α-helix	trans	-58.9	-38.2	173.4	-176.8	-177.6	-165.1	0	0	112	R495 S503	R495-E499 VanDerWaalsContact O-CB 3.23Å; R495-E499 WeakPolarHBondContact O-CB 3.27Å; R495-E499 PolarHBondContact O-N 2.84Å; E499-S503 WeakPolarHBondContact O-CB 3.48Å; E499-S503 PolarHBondContact O-N 2.85Å
500	K	81.5	Confident	78.4	Confident	143 Å²	143	111 Å²	111	62%	0.622	53%	0.534	S	S	*	.	H	α-helix	trans	-72.5	-36.8	173.8	-75.1	174.2	-172.3	173.2	0	112.6	K496 E497 E498 T504	K496-K500 VanDerWaalsContact O-CD 3.26Å; K496-K500 WeakPolarHBondContact O-CD 3.22Å; K496-K500 WeakPolarHBondContact O-CG 3.3Å; E497-K500 PolarHBondContact O-N 2.74Å; E498-K500 VanDerWaalsContact C-N 3.29Å; E498-K500 PolarHBondContact O-N 3.34Å; K500-T504 WeakPolarHBondContact O-CB 3.24Å; K500-T504 WeakPolarHBondContact O-CG2 3.5Å; K500-T504 PolarHBondContact O-N 2.71Å; K500-T504 PolarHBondContact O-OG1 2.87Å
501	A	78.7	Confident	78	Confident	58 Å²	58	109.7 Å²	109.7	48%	0.479	53%	0.532	S	S	.	.	H	α-helix	trans	-67.1	-38.4	175	0	0	0	0	0	111.3	E497 E498 T504 R505	E497-A501 WeakPolarHBondContact O-CB 3.43Å; E497-A501 PolarHBondContact O-N 3.48Å; E498-A501 CarbonylContact O-C 3.53Å; E498-A501 WeakPolarHBondContact O-CB 3.37Å; E498-A501 PolarHBondContact O-N 3.45Å; E498-A501 VanDerWaalsContact O-N 3.1Å; A501-T504 PolarHBondContact O-OG1 2.62Å; A501-R505 WeakPolarHBondContact O-CB 3.39Å; A501-R505 PolarHBondContact O-N 2.75Å
502	E	76.7	Confident	77.8	Confident	147 Å²	147	112 Å²	112	69%	0.687	54%	0.536	S	S	*	.	H	α-helix	trans	-70.6	-44.8	174.2	-174.1	164.4	-141.9	0	0	111.6	E498 T504 R505 G506	E498-E502 WeakPolarHBondContact O-CB 3.39Å; E498-E502 PolarHBondContact O-N 3.4Å; E502-T504 PolarHBondContact O-N 2.66Å; E502-R505 PolarHBondContact O-N 2.97Å; E502-G506 PolarHBondContact O-N 2.86Å
503	S	75.4	Confident	77.8	Confident	77 Å²	77	115.6 Å²	115.6	54%	0.538	55%	0.545	S	S	.	.	H	α-helix	trans	-54.9	-53.2	173.8	170.3	0	0	0	0	112.1	E499 R505 G506 E507	E499-S503 WeakPolarHBondContact O-CB 3.48Å; E499-S503 PolarHBondContact O-N 2.85Å; S503-R505 VanDerWaalsContact C-N 3.33Å; S503-R505 PolarHBondContact O-N 3.26Å; S503-G506 PolarHBondContact O-N 3.4Å; S503-E507 PolarHBondContact O-N 2.66Å
504	T	74.6	Confident	77.4	Confident	80 Å²	80	115 Å²	115	49%	0.491	55%	0.546	S	S	.	.	H	α-helix	trans	-69.8	-27.7	179.7	53.4	0	0	0	0	113	K500 A501 E502 K508	K500-T504 WeakPolarHBondContact O-CB 3.24Å; K500-T504 WeakPolarHBondContact O-CG2 3.5Å; K500-T504 PolarHBondContact O-N 2.71Å; K500-T504 PolarHBondContact O-OG1 2.87Å; A501-T504 PolarHBondContact O-OG1 2.62Å; E502-T504 PolarHBondContact O-N 2.66Å; T504-K508 WeakPolarHBondContact O-CB 3.19Å; T504-K508 PolarHBondContact O-N 3.17Å
505	R	75.4	Confident	77.1	Confident	195 Å²	195	114.8 Å²	114.8	74%	0.736	55%	0.547	S	S	*	.	H	α-helix	trans	-71.2	-39.2	170.8	-175.2	176.7	-173.9	171.3	1.4	111.8	A501 E502 S503 V509	A501-R505 WeakPolarHBondContact O-CB 3.39Å; A501-R505 PolarHBondContact O-N 2.75Å; E502-R505 PolarHBondContact O-N 2.97Å; S503-R505 VanDerWaalsContact C-N 3.33Å; S503-R505 PolarHBondContact O-N 3.26Å; R505-V509 WeakPolarHBondContact O-CB 3.49Å; R505-V509 VanDerWaalsContact O-CG2 3.29Å; R505-V509 WeakPolarHBondContact O-CG2 3.5Å; R505-V509 PolarHBondContact O-N 3.4Å
506	G	72.3	Confident	76.8	Confident	38 Å²	38	112 Å²	112	39%	0.392	54%	0.541	S	S	.	.	H	α-helix	trans	-62	-53.6	174	0	0	0	0	0	111.2	E502 S503 K508 V509 E510	E502-G506 PolarHBondContact O-N 2.86Å; S503-G506 PolarHBondContact O-N 3.4Å; G506-K508 VanDerWaalsContact C-N 3.33Å; G506-K508 PolarHBondContact O-N 3.34Å; G506-V509 PolarHBondContact O-N 3.25Å; G506-V509 VanDerWaalsContact O-N 3.08Å; G506-E510 PolarHBondContact O-N 2.97Å
507	E	75.7	Confident	76.5	Confident	126 Å²	126	112.2 Å²	112.2	59%	0.589	54%	0.543	S	S	*	.	H	α-helix	trans	-54.7	-47	175.6	-173.8	176.8	-158.2	0	0	111.4	S503 V509 E510 T511	S503-E507 PolarHBondContact O-N 2.66Å; E507-V509 VanDerWaalsContact C-N 3.3Å; E507-V509 PolarHBondContact O-N 3.41Å; E507-E510 PolarHBondContact O-N 3.32Å; E507-E510 VanDerWaalsContact O-N 3.1Å; E507-T511 WeakPolarHBondContact O-CG2 3.47Å; E507-T511 PolarHBondContact O-N 2.94Å; E507-T511 PolarHBondContact O-OG1 2.96Å
508	K	73.1	Confident	76.2	Confident	144 Å²	144	110.1 Å²	110.1	63%	0.626	54%	0.539	S	S	*	.	H	α-helix	trans	-69.7	-20.9	179.2	-169.9	168.5	-174.7	171.4	0	114.6	T504 G506 T511 K512	T504-K508 WeakPolarHBondContact O-CB 3.19Å; T504-K508 PolarHBondContact O-N 3.17Å; G506-K508 VanDerWaalsContact C-N 3.33Å; G506-K508 PolarHBondContact O-N 3.34Å; K508-T511 PolarHBondContact O-OG1 3.41Å; K508-K512 WeakPolarHBondContact O-CB 3.35Å; K508-K512 WeakPolarHBondContact O-CG 3.21Å; K508-K512 PolarHBondContact O-N 2.86Å
509	V	74.3	Confident	76.3	Confident	69 Å²	69	107.1 Å²	107.1	42%	0.418	53%	0.529	S	S	.	.	H	α-helix	trans	-81.9	-35.3	169.2	166.9	0	0	0	0	110.5	R505 G506 E507 R513	R505-V509 WeakPolarHBondContact O-CB 3.49Å; R505-V509 VanDerWaalsContact O-CG2 3.29Å; R505-V509 WeakPolarHBondContact O-CG2 3.5Å; R505-V509 PolarHBondContact O-N 3.4Å; G506-V509 PolarHBondContact O-N 3.25Å; G506-V509 VanDerWaalsContact O-N 3.08Å; E507-V509 VanDerWaalsContact C-N 3.3Å; E507-V509 PolarHBondContact O-N 3.41Å; V509-R513 WeakPolarHBondContact O-CB 3.27Å; V509-R513 WeakPolarHBondContact O-CG 3.32Å; V509-R513 PolarHBondContact O-N 2.84Å
510	E	72.2	Confident	76.3	Confident	106 Å²	106	106.2 Å²	106.2	50%	0.495	52%	0.524	S	S	.	.	H	α-helix	trans	-72.4	-39.1	177.8	-156.9	-174.4	138.1	0	0	112.3	G506 E507 R513 K514	G506-E510 PolarHBondContact O-N 2.97Å; E507-E510 PolarHBondContact O-N 3.32Å; E507-E510 VanDerWaalsContact O-N 3.1Å; E510-R513 PolarHBondContact O-N 3.3Å; E510-K514 WeakPolarHBondContact O-CG 3.2Å; E510-K514 PolarHBondContact O-N 3.39Å; E510-K514 WeakPolarHBondContact OE1-CE 3.23Å; E510-K514 IonicContact OE1-NZ 2.6Å; E510-K514 PolarHBondContact OE1-NZ 2.91Å
511	T	74.8	Confident	76.2	Confident	58 Å²	58	104.9 Å²	104.9	36%	0.356	52%	0.518	S	S	.	.	H	α-helix	trans	-62.1	-47.8	171.2	60.3	0	0	0	0	110.8	E507 K508 R513 K514 E515	E507-T511 WeakPolarHBondContact O-CG2 3.47Å; E507-T511 PolarHBondContact O-N 2.94Å; E507-T511 PolarHBondContact O-OG1 2.96Å; K508-T511 PolarHBondContact O-OG1 3.41Å; T511-R513 VanDerWaalsContact C-N 3.31Å; T511-R513 PolarHBondContact O-N 3.02Å; T511-K514 WeakPolarHBondContact O-CB 3.37Å; T511-K514 PolarHBondContact O-N 3.04Å; T511-K514 VanDerWaalsContact O-N 3.09Å; T511-E515 WeakPolarHBondContact O-CB 3.33Å; T511-E515 VanDerWaalsContact O-CG 3.32Å; T511-E515 WeakPolarHBondContact O-CG 3.19Å; T511-E515 PolarHBondContact O-N 3.32Å
512	K	77.2	Confident	76.2	Confident	121 Å²	121	108.6 Å²	108.6	53%	0.526	53%	0.525	S	S	.	.	H	α-helix	trans	-58.6	-39.3	175.6	-86.1	-169.3	163.2	-131.6	0	113.5	K508 E515 E516	K508-K512 WeakPolarHBondContact O-CB 3.35Å; K508-K512 WeakPolarHBondContact O-CG 3.21Å; K508-K512 PolarHBondContact O-N 2.86Å; K512-E515 PolarHBondContact O-N 2.83Å; K512-E516 WeakPolarHBondContact O-CB 3.45Å; K512-E516 PolarHBondContact O-N 3.49Å
513	R	78.5	Confident	76.3	Confident	176 Å²	176	107 Å²	107	66%	0.664	52%	0.518	S	S	*	.	H	α-helix	trans	-64.6	-41.9	174.5	-81.2	176.5	170.2	177.6	-2.8	111.8	V509 E510 T511 E517	V509-R513 WeakPolarHBondContact O-CB 3.27Å; V509-R513 WeakPolarHBondContact O-CG 3.32Å; V509-R513 PolarHBondContact O-N 2.84Å; E510-R513 PolarHBondContact O-N 3.3Å; T511-R513 VanDerWaalsContact C-N 3.31Å; T511-R513 PolarHBondContact O-N 3.02Å; R513-E517 VanDerWaalsContact O-CB 3.29Å; R513-E517 WeakPolarHBondContact O-CB 3.05Å; R513-E517 PolarHBondContact O-N 2.91Å
514	K	77	Confident	76.5	Confident	112 Å²	112	107.6 Å²	107.6	49%	0.487	51%	0.512	S	S	.	.	H	α-helix	trans	-65.1	-42.9	175.4	-71.3	166.9	-175.7	167.9	0	111.6	E510 T511 E517 T518	E510-K514 WeakPolarHBondContact O-CG 3.2Å; E510-K514 PolarHBondContact O-N 3.39Å; E510-K514 WeakPolarHBondContact OE1-CE 3.23Å; E510-K514 IonicContact OE1-NZ 2.6Å; E510-K514 PolarHBondContact OE1-NZ 2.91Å; T511-K514 WeakPolarHBondContact O-CB 3.37Å; T511-K514 PolarHBondContact O-N 3.04Å; T511-K514 VanDerWaalsContact O-N 3.09Å; K514-E517 PolarHBondContact O-N 2.91Å; K514-T518 PolarHBondContact O-N 2.91Å; K514-T518 PolarHBondContact O-OG1 3.34Å
515	E	77.3	Confident	76.8	Confident	109 Å²	109	107.1 Å²	107.1	51%	0.509	51%	0.509	S	S	.	.	H	α-helix	trans	-58.1	-51.9	173.9	-72.5	163.3	-172.8	0	0	111.3	T511 K512 E517 T518 V519	T511-E515 WeakPolarHBondContact O-CB 3.33Å; T511-E515 VanDerWaalsContact O-CG 3.32Å; T511-E515 WeakPolarHBondContact O-CG 3.19Å; T511-E515 PolarHBondContact O-N 3.32Å; K512-E515 PolarHBondContact O-N 2.83Å; E515-E517 VanDerWaalsContact C-N 3.32Å; E515-E517 PolarHBondContact O-N 3.27Å; E515-T518 WeakPolarHBondContact CA-OG1 3.25Å; E515-T518 PolarHBondContact O-N 3.42Å; E515-T518 PolarHBondContact O-OG1 2.62Å; E515-V519 WeakPolarHBondContact O-CG2 3.19Å; E515-V519 PolarHBondContact O-N 3.46Å
516	E	75.9	Confident	77	Confident	107 Å²	107	102.8 Å²	102.8	50%	0.5	50%	0.497	S	S	.	.	H	α-helix	trans	-61.1	-36.5	175.5	-80.7	-171.3	-144.5	0	0	113.2	K512 K520	K512-E516 WeakPolarHBondContact O-CB 3.45Å; K512-E516 PolarHBondContact O-N 3.49Å; E516-K520 WeakPolarHBondContact O-CB 3.37Å; E516-K520 WeakPolarHBondContact O-CD 3.5Å; E516-K520 VanDerWaalsContact O-CG 3.24Å; E516-K520 WeakPolarHBondContact O-CG 3.18Å; E516-K520 PolarHBondContact O-N 3.29Å; E516-K520 IonicContact OE2-NZ 2.76Å; E516-K520 PolarHBondContact OE2-NZ 3.44Å
517	E	77.3	Confident	77.5	Confident	102 Å²	102	107.6 Å²	107.6	48%	0.477	50%	0.503	S	S	.	.	H	α-helix	trans	-71.3	-36.7	177.3	-165.5	-173	150.2	0	0	111.7	R513 K514 E515 K521	R513-E517 VanDerWaalsContact O-CB 3.29Å; R513-E517 WeakPolarHBondContact O-CB 3.05Å; R513-E517 PolarHBondContact O-N 2.91Å; K514-E517 PolarHBondContact O-N 2.91Å; E515-E517 VanDerWaalsContact C-N 3.32Å; E515-E517 PolarHBondContact O-N 3.27Å; E517-K521 VanDerWaalsContact O-CG 3.29Å; E517-K521 WeakPolarHBondContact O-CG 3.44Å; E517-K521 PolarHBondContact O-N 3.01Å; E517-K521 VanDerWaalsContact O-N 3.12Å; E517-K521 VanDerWaalsContact OE1-CE 3.31Å; E517-K521 WeakPolarHBondContact OE1-CE 3.3Å; E517-K521 IonicContact OE1-NZ 2.59Å; E517-K521 PolarHBondContact OE1-NZ 2.86Å
518	T	74.7	Confident	77.8	Confident	75 Å²	75	106.9 Å²	106.9	46%	0.46	50%	0.498	S	S	.	.	H	α-helix	trans	-65.8	-46.3	172.1	42.8	0	0	0	0	111.8	K514 E515 K520 K521 E522	K514-T518 PolarHBondContact O-N 2.91Å; K514-T518 PolarHBondContact O-OG1 3.34Å; E515-T518 WeakPolarHBondContact CA-OG1 3.25Å; E515-T518 PolarHBondContact O-N 3.42Å; E515-T518 PolarHBondContact O-OG1 2.62Å; T518-K520 PolarHBondContact O-N 3.17Å; T518-K521 PolarHBondContact O-N 2.88Å; T518-K521 VanDerWaalsContact O-N 3.13Å; T518-E522 WeakPolarHBondContact O-CG 3.49Å; T518-E522 PolarHBondContact O-N 2.73Å
519	V	80.8	Confident	78.3	Confident	73 Å²	73	107.9 Å²	107.9	44%	0.442	50%	0.498	S	S	.	.	H	α-helix	trans	-60.1	-45.3	177.8	171.5	0	0	0	0	111	E515 K521 E522 E523	E515-V519 WeakPolarHBondContact O-CG2 3.19Å; E515-V519 PolarHBondContact O-N 3.46Å; V519-K521 VanDerWaalsContact C-N 3.29Å; V519-K521 PolarHBondContact O-N 2.78Å; V519-E522 PolarHBondContact O-N 3.23Å; V519-E523 HydrophobicContact CG1-CG 4.41Å; V519-E523 WeakPolarHBondContact O-CG 3.13Å; V519-E523 PolarHBondContact O-N 2.87Å
520	K	78.7	Confident	78.6	Confident	115 Å²	115	109.4 Å²	109.4	50%	0.5	50%	0.499	S	S	.	.	H	α-helix	trans	-63.1	-33.3	177.5	-72.9	163.5	-168.4	156.7	0	112.7	E516 T518 E524	E516-K520 WeakPolarHBondContact O-CB 3.37Å; E516-K520 WeakPolarHBondContact O-CD 3.5Å; E516-K520 VanDerWaalsContact O-CG 3.24Å; E516-K520 WeakPolarHBondContact O-CG 3.18Å; E516-K520 PolarHBondContact O-N 3.29Å; E516-K520 IonicContact OE2-NZ 2.76Å; E516-K520 PolarHBondContact OE2-NZ 3.44Å; T518-K520 PolarHBondContact O-N 3.17Å; K520-E524 WeakPolarHBondContact O-CB 3.27Å; K520-E524 PolarHBondContact O-N 2.95Å
521	K	79.2	Confident	78.9	Confident	114 Å²	114	110.5 Å²	110.5	50%	0.496	50%	0.504	S	S	.	.	H	α-helix	trans	-71.9	-39.4	173.9	-74.8	170.5	-174.6	170.3	0	112	E517 T518 V519 E524 V525	E517-K521 VanDerWaalsContact O-CG 3.29Å; E517-K521 WeakPolarHBondContact O-CG 3.44Å; E517-K521 PolarHBondContact O-N 3.01Å; E517-K521 VanDerWaalsContact O-N 3.12Å; E517-K521 VanDerWaalsContact OE1-CE 3.31Å; E517-K521 WeakPolarHBondContact OE1-CE 3.3Å; E517-K521 IonicContact OE1-NZ 2.59Å; E517-K521 PolarHBondContact OE1-NZ 2.86Å; T518-K521 PolarHBondContact O-N 2.88Å; T518-K521 VanDerWaalsContact O-N 3.13Å; V519-K521 VanDerWaalsContact C-N 3.29Å; V519-K521 PolarHBondContact O-N 2.78Å; K521-E524 PolarHBondContact O-N 2.94Å; K521-V525 WeakPolarHBondContact O-CB 3.37Å; K521-V525 VanDerWaalsContact O-CG2 3.31Å; K521-V525 WeakPolarHBondContact O-CG2 3.37Å; K521-V525 PolarHBondContact O-N 3.31Å
522	E	79.2	Confident	79	Confident	136 Å²	136	113.7 Å²	113.7	64%	0.636	52%	0.515	S	S	*	.	H	α-helix	trans	-65	-44.1	174.2	-70.6	179.9	155.5	0	0	111.3	T518 V519 E524 V525 E526	T518-E522 WeakPolarHBondContact O-CG 3.49Å; T518-E522 PolarHBondContact O-N 2.73Å; V519-E522 PolarHBondContact O-N 3.23Å; E522-E524 VanDerWaalsContact C-N 3.3Å; E522-E524 PolarHBondContact O-N 3.47Å; E522-V525 PolarHBondContact O-N 2.73Å; E522-E526 WeakPolarHBondContact O-CB 3.46Å; E522-E526 PolarHBondContact O-N 3.43Å
523	E	79.5	Confident	79	Confident	115 Å²	115	114.1 Å²	114.1	54%	0.537	52%	0.519	S	S	.	.	H	α-helix	trans	-62.4	-30.6	172.8	-73.2	-176.3	155.2	0	0	113.6	V519 R527	V519-E523 HydrophobicContact CG1-CG 4.41Å; V519-E523 WeakPolarHBondContact O-CG 3.13Å; V519-E523 PolarHBondContact O-N 2.87Å; E523-R527 WeakPolarHBondContact O-CB 3.29Å; E523-R527 VanDerWaalsContact O-CG 3.3Å; E523-R527 WeakPolarHBondContact O-CG 3.24Å; E523-R527 PolarHBondContact O-N 2.84Å; E523-R527 PolarHBondContact O-NE 2.73Å
524	E	78.8	Confident	79	Confident	88 Å²	88	112.4 Å²	112.4	41%	0.411	52%	0.516	S	S	.	.	H	α-helix	trans	-76.4	-41.7	173.8	-164.4	-172.9	127.6	0	0	112.1	K520 K521 E522 R527 K528	K520-E524 WeakPolarHBondContact O-CB 3.27Å; K520-E524 PolarHBondContact O-N 2.95Å; K521-E524 PolarHBondContact O-N 2.94Å; E522-E524 VanDerWaalsContact C-N 3.3Å; E522-E524 PolarHBondContact O-N 3.47Å; E524-R527 PolarHBondContact O-N 2.72Å; E524-K528 HydrophobicContact CG-CD 4.37Å; E524-K528 WeakPolarHBondContact O-CB 3.36Å; E524-K528 WeakPolarHBondContact O-CG 3.36Å; E524-K528 PolarHBondContact O-N 3.41Å; E524-K528 WeakPolarHBondContact OE1-CE 3.25Å; E524-K528 IonicContact OE1-NZ 3.24Å; E524-K528 PolarHBondContact OE1-NZ 2.55Å
525	V	81.8	Confident	79	Confident	70 Å²	70	109.4 Å²	109.4	42%	0.424	51%	0.512	S	S	.	.	H	α-helix	trans	-64.4	-40	175	168.2	0	0	0	0	111.1	K521 E522 K528 R529	K521-V525 WeakPolarHBondContact O-CB 3.37Å; K521-V525 VanDerWaalsContact O-CG2 3.31Å; K521-V525 WeakPolarHBondContact O-CG2 3.37Å; K521-V525 PolarHBondContact O-N 3.31Å; E522-V525 PolarHBondContact O-N 2.73Å; V525-K528 PolarHBondContact O-N 3.3Å; V525-R529 WeakPolarHBondContact O-CB 3.49Å; V525-R529 WeakPolarHBondContact O-CG 3.46Å; V525-R529 PolarHBondContact O-N 2.67Å
526	E	79.5	Confident	79.1	Confident	104 Å²	104	110.7 Å²	110.7	49%	0.486	52%	0.518	S	S	.	.	H	α-helix	trans	-71.2	-36.9	177.8	-163.3	-179.3	123	0	0	112.2	E522 R529 K530	E522-E526 WeakPolarHBondContact O-CB 3.46Å; E522-E526 PolarHBondContact O-N 3.43Å; E526-R529 PolarHBondContact O-N 2.64Å; E526-K530 HydrophobicContact CG-CD 4.24Å; E526-K530 WeakPolarHBondContact O-CB 3.43Å; E526-K530 WeakPolarHBondContact O-CG 3.22Å; E526-K530 PolarHBondContact O-N 2.91Å; E526-K530 WeakPolarHBondContact OE1-CE 3.36Å; E526-K530 IonicContact OE1-NZ 2.59Å; E526-K530 PolarHBondContact OE1-NZ 3.12Å
527	R	82.4	Confident	79.1	Confident	139 Å²	139	109.2 Å²	109.2	53%	0.525	52%	0.52	S	S	.	.	H	α-helix	trans	-61.4	-47.5	170	-81.2	179.8	-66.7	137.5	-2.9	111.7	E523 E524 R529 K530 E531	E523-R527 WeakPolarHBondContact O-CB 3.29Å; E523-R527 VanDerWaalsContact O-CG 3.3Å; E523-R527 WeakPolarHBondContact O-CG 3.24Å; E523-R527 PolarHBondContact O-N 2.84Å; E523-R527 PolarHBondContact O-NE 2.73Å; E524-R527 PolarHBondContact O-N 2.72Å; R527-R529 PolarHBondContact O-N 2.86Å; R527-K530 CarbonylContact O-C 3.59Å; R527-K530 PolarHBondContact O-N 3.5Å; R527-K530 VanDerWaalsContact O-N 3.12Å; R527-E531 WeakPolarHBondContact O-CG 3.36Å; R527-E531 PolarHBondContact O-N 2.95Å
528	K	82.3	Confident	79	Confident	111 Å²	111	109.4 Å²	109.4	48%	0.483	52%	0.523	S	S	.	.	H	α-helix	trans	-59.3	-45.2	177.4	-78.5	171	171.1	170.3	0	112	E524 V525 K530 E531 E532	E524-K528 HydrophobicContact CG-CD 4.37Å; E524-K528 WeakPolarHBondContact O-CB 3.36Å; E524-K528 WeakPolarHBondContact O-CG 3.36Å; E524-K528 PolarHBondContact O-N 3.41Å; E524-K528 WeakPolarHBondContact OE1-CE 3.25Å; E524-K528 IonicContact OE1-NZ 3.24Å; E524-K528 PolarHBondContact OE1-NZ 2.55Å; V525-K528 PolarHBondContact O-N 3.3Å; K528-K530 VanDerWaalsContact C-N 3.34Å; K528-K530 PolarHBondContact O-N 3.31Å; K528-E531 PolarHBondContact O-N 2.78Å; K528-E532 VanDerWaalsContact O-CB 3.3Å; K528-E532 WeakPolarHBondContact O-CB 3.5Å; K528-E532 PolarHBondContact O-N 3.06Å
529	R	82.4	Confident	78.8	Confident	166 Å²	166	112.4 Å²	112.4	63%	0.626	53%	0.532	S	S	*	.	H	α-helix	trans	-57.9	-42.8	172.6	-76.5	174.4	175.2	166	-0.7	112.7	V525 E526 R527 E531 E532 E533	V525-R529 WeakPolarHBondContact O-CB 3.49Å; V525-R529 WeakPolarHBondContact O-CG 3.46Å; V525-R529 PolarHBondContact O-N 2.67Å; E526-R529 PolarHBondContact O-N 2.64Å; R527-R529 PolarHBondContact O-N 2.86Å; R529-E531 VanDerWaalsContact C-N 3.31Å; R529-E531 PolarHBondContact O-N 3.27Å; R529-E532 PolarHBondContact O-N 3.06Å; R529-E533 WeakPolarHBondContact O-CB 2.74Å; R529-E533 PolarHBondContact O-N 2.96Å
530	K	80.6	Confident	78.4	Confident	100 Å²	100	110.7 Å²	110.7	44%	0.435	53%	0.529	S	S	.	.	H	α-helix	trans	-73.6	-17.8	178.5	-74.9	171.2	172.8	172.7	0	114.1	E526 R527 K528 K534	E526-K530 HydrophobicContact CG-CD 4.24Å; E526-K530 WeakPolarHBondContact O-CB 3.43Å; E526-K530 WeakPolarHBondContact O-CG 3.22Å; E526-K530 PolarHBondContact O-N 2.91Å; E526-K530 WeakPolarHBondContact OE1-CE 3.36Å; E526-K530 IonicContact OE1-NZ 2.59Å; E526-K530 PolarHBondContact OE1-NZ 3.12Å; R527-K530 CarbonylContact O-C 3.59Å; R527-K530 PolarHBondContact O-N 3.5Å; R527-K530 VanDerWaalsContact O-N 3.12Å; K528-K530 VanDerWaalsContact C-N 3.34Å; K528-K530 PolarHBondContact O-N 3.31Å; K530-K534 VanDerWaalsContact O-CD 3.25Å; K530-K534 WeakPolarHBondContact O-CD 3.49Å; K530-K534 WeakPolarHBondContact O-CG 3.5Å
531	E	78.7	Confident	78.1	Confident	130 Å²	130	111.9 Å²	111.9	61%	0.607	54%	0.536	S	S	*	.	H	α-helix	trans	-84.6	-40.1	169.7	-73.4	173.1	170	0	0	110.8	R527 K528 R529 K534 A535	R527-E531 WeakPolarHBondContact O-CG 3.36Å; R527-E531 PolarHBondContact O-N 2.95Å; K528-E531 PolarHBondContact O-N 2.78Å; R529-E531 VanDerWaalsContact C-N 3.31Å; R529-E531 PolarHBondContact O-N 3.27Å; E531-K534 PolarHBondContact O-N 3.05Å; E531-A535 WeakPolarHBondContact O-CB 3.23Å; E531-A535 PolarHBondContact O-N 3.11Å
532	E	76.9	Confident	77.7	Confident	125 Å²	125	112.9 Å²	112.9	58%	0.584	54%	0.541	S	S	*	.	H	α-helix	trans	-64.8	-49.7	175.5	-168	164	-137.4	0	0	111.6	K528 R529 K534 A535 E536	K528-E532 VanDerWaalsContact O-CB 3.3Å; K528-E532 WeakPolarHBondContact O-CB 3.5Å; K528-E532 PolarHBondContact O-N 3.06Å; R529-E532 PolarHBondContact O-N 3.06Å; E532-K534 VanDerWaalsContact C-N 3.27Å; E532-K534 PolarHBondContact O-N 3.31Å; E532-A535 CarbonylContact O-C 3.5Å; E532-A535 WeakPolarHBondContact O-CA 3.25Å; E532-A535 WeakPolarHBondContact O-CB 3.34Å; E532-A535 PolarHBondContact O-N 2.81Å; E532-E536 PolarHBondContact O-N 3.45Å
533	E	78.3	Confident	77.4	Confident	130 Å²	130	110 Å²	110	61%	0.607	53%	0.532	S	S	*	.	H	α-helix	trans	-56.6	-37.5	173.9	-178.7	-178.3	-161.4	0	0	112.3	R529 S537	R529-E533 WeakPolarHBondContact O-CB 2.74Å; R529-E533 PolarHBondContact O-N 2.96Å; E533-S537 VanDerWaalsContact O-CB 3.24Å; E533-S537 WeakPolarHBondContact O-CB 3.36Å; E533-S537 PolarHBondContact O-N 2.85Å
534	K	78.7	Confident	77	Confident	140 Å²	140	109.4 Å²	109.4	61%	0.609	53%	0.53	S	S	*	.	H	α-helix	trans	-72.4	-38.4	173.9	-75.9	175.4	-171.7	175.1	0	112.4	K530 E531 E532 S537 I538	K530-K534 VanDerWaalsContact O-CD 3.25Å; K530-K534 WeakPolarHBondContact O-CD 3.49Å; K530-K534 WeakPolarHBondContact O-CG 3.5Å; E531-K534 PolarHBondContact O-N 3.05Å; E532-K534 VanDerWaalsContact C-N 3.27Å; E532-K534 PolarHBondContact O-N 3.31Å; K534-S537 PolarHBondContact O-N 2.86Å; K534-I538 WeakPolarHBondContact O-CB 3.36Å; K534-I538 WeakPolarHBondContact O-CD1 3.09Å; K534-I538 VanDerWaalsContact O-CG1 3.23Å; K534-I538 WeakPolarHBondContact O-CG1 3.43Å; K534-I538 PolarHBondContact O-N 2.84Å
535	A	76.9	Confident	76.6	Confident	48 Å²	48	108.1 Å²	108.1	40%	0.397	53%	0.53	S	S	.	.	H	α-helix	trans	-66.3	-41.2	176.1	0	0	0	0	0	111.3	E531 E532 Q539	E531-A535 WeakPolarHBondContact O-CB 3.23Å; E531-A535 PolarHBondContact O-N 3.11Å; E532-A535 CarbonylContact O-C 3.5Å; E532-A535 WeakPolarHBondContact O-CA 3.25Å; E532-A535 WeakPolarHBondContact O-CB 3.34Å; E532-A535 PolarHBondContact O-N 2.81Å; A535-Q539 WeakPolarHBondContact O-CB 3.25Å; A535-Q539 WeakPolarHBondContact O-CG 3.37Å; A535-Q539 PolarHBondContact O-N 2.86Å
536	E	78.8	Confident	76.1	Confident	136 Å²	136	110.8 Å²	110.8	64%	0.636	54%	0.536	S	S	*	.	H	α-helix	trans	-64.2	-43.4	172.4	-71.3	-168.1	150.7	0	0	111.7	E532 Q539 G540	E532-E536 PolarHBondContact O-N 3.45Å; E536-Q539 PolarHBondContact O-N 3.15Å; E536-G540 PolarHBondContact O-N 2.86Å
537	S	75.1	Confident	75.9	Confident	77 Å²	77	114.2 Å²	114.2	54%	0.538	54%	0.544	S	S	.	.	H	α-helix	trans	-60.5	-48.1	175.5	-178	0	0	0	0	112.3	E533 K534 Q539 G540 E541	E533-S537 VanDerWaalsContact O-CB 3.24Å; E533-S537 WeakPolarHBondContact O-CB 3.36Å; E533-S537 PolarHBondContact O-N 2.85Å; K534-S537 PolarHBondContact O-N 2.86Å; S537-Q539 VanDerWaalsContact C-N 3.33Å; S537-Q539 PolarHBondContact O-N 3.02Å; S537-G540 PolarHBondContact O-N 3.4Å; S537-G540 VanDerWaalsContact O-N 3.15Å; S537-E541 PolarHBondContact O-N 2.82Å
538	I	75.4	Confident	75.3	Confident	106 Å²	106	113.4 Å²	113.4	54%	0.544	55%	0.545	S	S	.	.	H	α-helix	trans	-65.2	-35.6	176.5	-68.1	165.2	0	0	0	111.3	K534 K542	K534-I538 WeakPolarHBondContact O-CB 3.36Å; K534-I538 WeakPolarHBondContact O-CD1 3.09Å; K534-I538 VanDerWaalsContact O-CG1 3.23Å; K534-I538 WeakPolarHBondContact O-CG1 3.43Å; K534-I538 PolarHBondContact O-N 2.84Å; I538-K542 WeakPolarHBondContact O-CB 3.38Å; I538-K542 PolarHBondContact O-N 2.9Å
539	Q	71.5	Confident	74.7	Confident	137 Å²	137	113.9 Å²	113.9	64%	0.64	55%	0.549	S	S	*	.	H	α-helix	trans	-68.2	-39.5	171.9	-77.7	-168.3	33.6	0	0	112.1	A535 E536 S537 K542 V543	A535-Q539 WeakPolarHBondContact O-CB 3.25Å; A535-Q539 WeakPolarHBondContact O-CG 3.37Å; A535-Q539 PolarHBondContact O-N 2.86Å; E536-Q539 PolarHBondContact O-N 3.15Å; S537-Q539 VanDerWaalsContact C-N 3.33Å; S537-Q539 PolarHBondContact O-N 3.02Å; Q539-K542 PolarHBondContact O-N 2.98Å; Q539-V543 WeakPolarHBondContact O-CB 3.38Å; Q539-V543 VanDerWaalsContact O-CG2 3.25Å; Q539-V543 WeakPolarHBondContact O-CG2 3.48Å; Q539-V543 PolarHBondContact O-N 2.86Å
540	G	72.8	Confident	74.2	Confident	38 Å²	38	111.3 Å²	111.3	39%	0.392	54%	0.544	S	S	.	.	H	α-helix	trans	-59.3	-53.2	174.6	0	0	0	0	0	111.6	E536 S537 K542 V543 E544	E536-G540 PolarHBondContact O-N 2.86Å; S537-G540 PolarHBondContact O-N 3.4Å; S537-G540 VanDerWaalsContact O-N 3.15Å; G540-K542 VanDerWaalsContact C-N 3.31Å; G540-K542 PolarHBondContact O-N 3.3Å; G540-V543 PolarHBondContact O-N 3.42Å; G540-V543 VanDerWaalsContact O-N 3.15Å; G540-E544 WeakPolarHBondContact O-CB 3.08Å; G540-E544 PolarHBondContact O-N 3.2Å
541	E	72.3	Confident	73.8	Confident	140 Å²	140	111.6 Å²	111.6	65%	0.654	55%	0.547	S	S	*	.	H	α-helix	trans	-60.4	-38.6	176.2	-171.6	176.4	-152.2	0	0	111.9	S537 E544 S545	S537-E541 PolarHBondContact O-N 2.82Å; E541-E544 PolarHBondContact O-N 3.48Å; E541-S545 WeakPolarHBondContact O-CB 3.29Å; E541-S545 PolarHBondContact O-N 3.45Å; E541-S545 PolarHBondContact O-OG 2.86Å
542	K	69.9	Low	73.1	Confident	134 Å²	134	109 Å²	109	58%	0.583	54%	0.54	S	S	*	.	H	α-helix	trans	-72	-28.1	176	-168.7	166.2	-174.2	171.2	0	113.8	I538 Q539 G540 S545 K546	I538-K542 WeakPolarHBondContact O-CB 3.38Å; I538-K542 PolarHBondContact O-N 2.9Å; Q539-K542 PolarHBondContact O-N 2.98Å; G540-K542 VanDerWaalsContact C-N 3.31Å; G540-K542 PolarHBondContact O-N 3.3Å; K542-S545 VanDerWaalsContact CA-OG 3.32Å; K542-S545 WeakPolarHBondContact CA-OG 3.37Å; K542-S545 PolarHBondContact O-OG 3.22Å; K542-K546 WeakPolarHBondContact O-CB 3.28Å; K542-K546 WeakPolarHBondContact O-CG 3.24Å; K542-K546 PolarHBondContact O-N 2.61Å
543	V	73	Confident	72.9	Confident	75 Å²	75	106.3 Å²	106.3	46%	0.455	53%	0.532	S	S	.	.	H	α-helix	trans	-79.6	-36.7	172.9	166.7	0	0	0	0	110.8	Q539 G540 R547	Q539-V543 WeakPolarHBondContact O-CB 3.38Å; Q539-V543 VanDerWaalsContact O-CG2 3.25Å; Q539-V543 WeakPolarHBondContact O-CG2 3.48Å; Q539-V543 PolarHBondContact O-N 2.86Å; G540-V543 PolarHBondContact O-N 3.42Å; G540-V543 VanDerWaalsContact O-N 3.15Å; V543-R547 WeakPolarHBondContact O-CB 3.12Å; V543-R547 VanDerWaalsContact O-CG 3.3Å; V543-R547 WeakPolarHBondContact O-CG 3.39Å; V543-R547 PolarHBondContact O-N 2.74Å
544	E	71.7	Confident	72.7	Confident	104 Å²	104	105.5 Å²	105.5	49%	0.486	53%	0.526	S	S	.	.	H	α-helix	trans	-72.7	-42.1	178.4	-162.6	-176.1	125.4	0	0	112	G540 E541 R547 K548	G540-E544 WeakPolarHBondContact O-CB 3.08Å; G540-E544 PolarHBondContact O-N 3.2Å; E541-E544 PolarHBondContact O-N 3.48Å; E544-R547 PolarHBondContact O-N 3.27Å; E544-K548 HydrophobicContact CG-CD 4.37Å; E544-K548 WeakPolarHBondContact O-CB 3.31Å; E544-K548 WeakPolarHBondContact O-CG 3.48Å; E544-K548 PolarHBondContact O-N 3.4Å; E544-K548 WeakPolarHBondContact OE1-CE 3.32Å; E544-K548 IonicContact OE1-NZ 3.22Å; E544-K548 PolarHBondContact OE1-NZ 2.8Å
545	S	70.2	Confident	72.3	Confident	60 Å²	60	104.2 Å²	104.2	42%	0.42	52%	0.521	S	S	.	.	H	α-helix	trans	-60	-47.1	170.4	49	0	0	0	0	111.4	E541 K542 R547 K548 E549	E541-S545 WeakPolarHBondContact O-CB 3.29Å; E541-S545 PolarHBondContact O-N 3.45Å; E541-S545 PolarHBondContact O-OG 2.86Å; K542-S545 VanDerWaalsContact CA-OG 3.32Å; K542-S545 WeakPolarHBondContact CA-OG 3.37Å; K542-S545 PolarHBondContact O-OG 3.22Å; S545-R547 VanDerWaalsContact C-N 3.31Å; S545-R547 PolarHBondContact O-N 2.77Å; S545-K548 PolarHBondContact O-N 3.44Å; S545-E549 VanDerWaalsContact O-CB 3.28Å; S545-E549 WeakPolarHBondContact O-CB 3.44Å; S545-E549 PolarHBondContact O-N 2.87Å
546	K	70.8	Confident	72	Confident	126 Å²	126	108.3 Å²	108.3	55%	0.548	53%	0.532	S	S	.	.	H	α-helix	trans	-60.4	-34.4	172.8	-83.2	-167.2	167.1	-149.8	0	114.2	K542 E550	K542-K546 WeakPolarHBondContact O-CB 3.28Å; K542-K546 WeakPolarHBondContact O-CG 3.24Å; K542-K546 PolarHBondContact O-N 2.61Å; K546-E550 WeakPolarHBondContact O-CB 3.5Å; K546-E550 PolarHBondContact O-N 3.02Å
547	R	75.7	Confident	71.7	Confident	176 Å²	176	106.9 Å²	106.9	66%	0.664	53%	0.525	S	S	*	.	H	α-helix	trans	-69	-43.1	174.3	-82.2	175.3	173.6	-179.9	-0.6	111.8	V543 E544 S545 E549 E550 E551	V543-R547 WeakPolarHBondContact O-CB 3.12Å; V543-R547 VanDerWaalsContact O-CG 3.3Å; V543-R547 WeakPolarHBondContact O-CG 3.39Å; V543-R547 PolarHBondContact O-N 2.74Å; E544-R547 PolarHBondContact O-N 3.27Å; S545-R547 VanDerWaalsContact C-N 3.31Å; S545-R547 PolarHBondContact O-N 2.77Å; R547-E549 VanDerWaalsContact C-N 3.34Å; R547-E550 PolarHBondContact O-N 3.35Å; R547-E551 VanDerWaalsContact O-CB 3.31Å; R547-E551 WeakPolarHBondContact O-CB 3.31Å; R547-E551 PolarHBondContact O-N 2.88Å
548	K	70.1	Confident	71.7	Confident	122 Å²	122	107.4 Å²	107.4	53%	0.53	52%	0.519	S	S	.	.	H	α-helix	trans	-62.8	-41.9	174.9	-75.1	167	170.4	170.4	0	110.9	E544 S545 E551 T552	E544-K548 HydrophobicContact CG-CD 4.37Å; E544-K548 WeakPolarHBondContact O-CB 3.31Å; E544-K548 WeakPolarHBondContact O-CG 3.48Å; E544-K548 PolarHBondContact O-N 3.4Å; E544-K548 WeakPolarHBondContact OE1-CE 3.32Å; E544-K548 IonicContact OE1-NZ 3.22Å; E544-K548 PolarHBondContact OE1-NZ 2.8Å; S545-K548 PolarHBondContact O-N 3.44Å; K548-E551 PolarHBondContact O-N 2.76Å; K548-T552 PolarHBondContact O-N 3.39Å; K548-T552 PolarHBondContact O-OG1 3.11Å; K548-T552 VanDerWaalsContact O-OG1 3.07Å
549	E	69.4	Low	71.6	Confident	122 Å²	122	105.8 Å²	105.8	57%	0.57	51%	0.514	S	S	*	.	H	α-helix	trans	-64.1	-47.6	174.7	-171.3	174.8	-147	0	0	112	S545 R547 E551 T552 V553	S545-E549 VanDerWaalsContact O-CB 3.28Å; S545-E549 WeakPolarHBondContact O-CB 3.44Å; S545-E549 PolarHBondContact O-N 2.87Å; R547-E549 VanDerWaalsContact C-N 3.34Å; E549-E551 VanDerWaalsContact C-N 3.29Å; E549-E551 PolarHBondContact O-N 3.01Å; E549-T552 WeakPolarHBondContact CA-OG1 3.38Å; E549-T552 PolarHBondContact O-N 2.79Å; E549-T552 PolarHBondContact O-OG1 3.5Å; E549-V553 WeakPolarHBondContact O-CB 3.48Å; E549-V553 VanDerWaalsContact O-CG2 3.3Å; E549-V553 WeakPolarHBondContact O-CG2 3.27Å; E549-V553 PolarHBondContact O-N 2.98Å
550	E	71.2	Confident	71.5	Confident	112 Å²	112	104 Å²	104	52%	0.523	51%	0.506	S	S	.	.	H	α-helix	trans	-60.2	-36.1	171.3	-90.3	-164.9	-165.7	0	0	112.6	K546 R547 K554	K546-E550 WeakPolarHBondContact O-CB 3.5Å; K546-E550 PolarHBondContact O-N 3.02Å; R547-E550 PolarHBondContact O-N 3.35Å; E550-K554 VanDerWaalsContact O-CB 3.3Å; E550-K554 WeakPolarHBondContact O-CB 3.42Å; E550-K554 VanDerWaalsContact O-CD 3.3Å; E550-K554 WeakPolarHBondContact O-CD 3.49Å; E550-K554 WeakPolarHBondContact O-CG 3.34Å; E550-K554 PolarHBondContact O-N 2.9Å; E550-K554 IonicContact OE2-NZ 3.64Å; E550-K554 PolarHBondContact OE2-NZ 2.74Å
551	E	72.6	Confident	71.7	Confident	105 Å²	105	108.1 Å²	108.1	49%	0.491	51%	0.509	S	S	.	.	H	α-helix	trans	-73.9	-37.2	179.4	-163.5	-173.4	146.8	0	0	111.7	R547 K548 E549 K555	R547-E551 VanDerWaalsContact O-CB 3.31Å; R547-E551 WeakPolarHBondContact O-CB 3.31Å; R547-E551 PolarHBondContact O-N 2.88Å; K548-E551 PolarHBondContact O-N 2.76Å; E549-E551 VanDerWaalsContact C-N 3.29Å; E549-E551 PolarHBondContact O-N 3.01Å; E551-K555 WeakPolarHBondContact O-CB 3.27Å; E551-K555 VanDerWaalsContact O-CG 3.27Å; E551-K555 WeakPolarHBondContact O-CG 3.42Å; E551-K555 PolarHBondContact O-N 2.85Å; E551-K555 VanDerWaalsContact OE1-CE 3.29Å; E551-K555 WeakPolarHBondContact OE1-CE 3.47Å; E551-K555 IonicContact OE1-NZ 3.88Å; E551-K555 PolarHBondContact OE1-NZ 2.8Å
552	T	64.7	Low	71.8	Confident	77 Å²	77	106.8 Å²	106.8	47%	0.472	50%	0.501	S	S	.	.	H	α-helix	trans	-66.1	-45.9	170.3	45	0	0	0	0	111.3	K548 E549 K554 K555 E556	K548-T552 PolarHBondContact O-N 3.39Å; K548-T552 PolarHBondContact O-OG1 3.11Å; K548-T552 VanDerWaalsContact O-OG1 3.07Å; E549-T552 WeakPolarHBondContact CA-OG1 3.38Å; E549-T552 PolarHBondContact O-N 2.79Å; E549-T552 PolarHBondContact O-OG1 3.5Å; T552-K554 VanDerWaalsContact C-N 3.35Å; T552-K554 PolarHBondContact O-N 3.23Å; T552-K555 PolarHBondContact O-N 3.14Å; T552-K555 VanDerWaalsContact O-N 3.12Å; T552-E556 WeakPolarHBondContact O-CG 3.45Å; T552-E556 PolarHBondContact O-N 2.83Å
553	V	71.5	Confident	72	Confident	68 Å²	68	108.2 Å²	108.2	41%	0.412	50%	0.503	S	S	.	.	H	α-helix	trans	-61.5	-41.4	177	169.9	0	0	0	0	111.1	E549 K555 E556 E557	E549-V553 WeakPolarHBondContact O-CB 3.48Å; E549-V553 VanDerWaalsContact O-CG2 3.3Å; E549-V553 WeakPolarHBondContact O-CG2 3.27Å; E549-V553 PolarHBondContact O-N 2.98Å; V553-K555 VanDerWaalsContact C-N 3.34Å; V553-K555 PolarHBondContact O-N 3.38Å; V553-E556 PolarHBondContact O-N 2.61Å; V553-E557 HydrophobicContact CG1-CG 4.44Å; V553-E557 WeakPolarHBondContact O-CB 3.2Å; V553-E557 WeakPolarHBondContact O-CG 3.2Å; V553-E557 PolarHBondContact O-N 3.17Å
554	K	74	Confident	71.9	Confident	112 Å²	112	109.3 Å²	109.3	49%	0.487	50%	0.501	S	S	.	.	H	α-helix	trans	-66	-33.7	175.5	-73.8	162.7	-164.1	164.6	0	112.9	E550 T552 E558	E550-K554 VanDerWaalsContact O-CB 3.3Å; E550-K554 WeakPolarHBondContact O-CB 3.42Å; E550-K554 VanDerWaalsContact O-CD 3.3Å; E550-K554 WeakPolarHBondContact O-CD 3.49Å; E550-K554 WeakPolarHBondContact O-CG 3.34Å; E550-K554 PolarHBondContact O-N 2.9Å; E550-K554 IonicContact OE2-NZ 3.64Å; E550-K554 PolarHBondContact OE2-NZ 2.74Å; T552-K554 VanDerWaalsContact C-N 3.35Å; T552-K554 PolarHBondContact O-N 3.23Å; K554-E558 WeakPolarHBondContact O-CB 3.27Å; K554-E558 PolarHBondContact O-N 2.84Å
555	K	71.1	Confident	72	Confident	113 Å²	113	110.2 Å²	110.2	49%	0.491	51%	0.506	S	S	.	.	H	α-helix	trans	-72	-40.4	173.8	-74.9	169.1	-173.6	168.2	0	112	E551 T552 V553 E558 V559	E551-K555 WeakPolarHBondContact O-CB 3.27Å; E551-K555 VanDerWaalsContact O-CG 3.27Å; E551-K555 WeakPolarHBondContact O-CG 3.42Å; E551-K555 PolarHBondContact O-N 2.85Å; E551-K555 VanDerWaalsContact OE1-CE 3.29Å; E551-K555 WeakPolarHBondContact OE1-CE 3.47Å; E551-K555 IonicContact OE1-NZ 3.88Å; E551-K555 PolarHBondContact OE1-NZ 2.8Å; T552-K555 PolarHBondContact O-N 3.14Å; T552-K555 VanDerWaalsContact O-N 3.12Å; V553-K555 VanDerWaalsContact C-N 3.34Å; V553-K555 PolarHBondContact O-N 3.38Å; K555-E558 PolarHBondContact O-N 2.79Å; K555-V559 WeakPolarHBondContact O-CB 3.03Å; K555-V559 VanDerWaalsContact O-CG2 3.3Å; K555-V559 WeakPolarHBondContact O-CG2 3.4Å; K555-V559 PolarHBondContact O-N 2.91Å
556	E	70.9	Confident	72	Confident	135 Å²	135	113.4 Å²	113.4	63%	0.631	51%	0.514	S	S	*	.	H	α-helix	trans	-66.8	-42.9	174.5	-72.2	-175.4	152.8	0	0	111.2	T552 V553 E558 V559 E560	T552-E556 WeakPolarHBondContact O-CG 3.45Å; T552-E556 PolarHBondContact O-N 2.83Å; V553-E556 PolarHBondContact O-N 2.61Å; E556-E558 VanDerWaalsContact C-N 3.34Å; E556-E558 PolarHBondContact O-N 3.47Å; E556-V559 PolarHBondContact O-N 2.82Å; E556-E560 VanDerWaalsContact O-CB 3.3Å; E556-E560 WeakPolarHBondContact O-CB 3.33Å; E556-E560 PolarHBondContact O-N 2.87Å
557	E	72.6	Confident	71.8	Confident	106 Å²	106	113.7 Å²	113.7	50%	0.495	52%	0.517	S	S	.	.	H	α-helix	trans	-60.2	-39.7	170.1	-81	-167.4	-178.8	0	0	112.4	V553 R561	V553-E557 HydrophobicContact CG1-CG 4.44Å; V553-E557 WeakPolarHBondContact O-CB 3.2Å; V553-E557 WeakPolarHBondContact O-CG 3.2Å; V553-E557 PolarHBondContact O-N 3.17Å; E557-R561 WeakPolarHBondContact O-CB 3.28Å; E557-R561 PolarHBondContact O-N 2.85Å; E557-R561 IonicContact OE2-NH2 2.61Å; E557-R561 PolarHBondContact OE2-NH2 2.91Å
558	E	73.4	Confident	71.4	Confident	88 Å²	88	112.4 Å²	112.4	41%	0.411	52%	0.516	S	S	.	.	H	α-helix	trans	-69.7	-39.7	177.5	-164.5	-170.2	129.9	0	0	111.5	K554 K555 E556 K562	K554-E558 WeakPolarHBondContact O-CB 3.27Å; K554-E558 PolarHBondContact O-N 2.84Å; K555-E558 PolarHBondContact O-N 2.79Å; E556-E558 VanDerWaalsContact C-N 3.34Å; E556-E558 PolarHBondContact O-N 3.47Å; E558-K562 HydrophobicContact CG-CD 4.4Å; E558-K562 VanDerWaalsContact O-CB 3.32Å; E558-K562 WeakPolarHBondContact O-CB 3.26Å; E558-K562 VanDerWaalsContact O-CG 3.3Å; E558-K562 WeakPolarHBondContact O-CG 3.27Å; E558-K562 PolarHBondContact O-N 2.63Å; E558-K562 WeakPolarHBondContact OE1-CE 3.2Å; E558-K562 IonicContact OE1-NZ 2.63Å; E558-K562 PolarHBondContact OE1-NZ 3.07Å
559	V	73.9	Confident	71.3	Confident	71 Å²	71	109.2 Å²	109.2	43%	0.43	51%	0.513	S	S	.	.	H	α-helix	trans	-66.1	-40.8	173.6	167.4	0	0	0	0	111.1	K555 E556 K562 R563	K555-V559 WeakPolarHBondContact O-CB 3.03Å; K555-V559 VanDerWaalsContact O-CG2 3.3Å; K555-V559 WeakPolarHBondContact O-CG2 3.4Å; K555-V559 PolarHBondContact O-N 2.91Å; E556-V559 PolarHBondContact O-N 2.82Å; V559-K562 PolarHBondContact O-N 3.38Å; V559-R563 WeakPolarHBondContact O-CB 3.49Å; V559-R563 VanDerWaalsContact O-CG 3.31Å; V559-R563 WeakPolarHBondContact O-CG 3.25Å; V559-R563 PolarHBondContact O-N 2.82Å
560	E	70.1	Confident	71	Confident	101 Å²	101	109.8 Å²	109.8	47%	0.472	52%	0.516	S	S	.	.	H	α-helix	trans	-73.4	-33.8	177.5	-166	176.3	125.4	0	0	111.8	E556 R563 K564	E556-E560 VanDerWaalsContact O-CB 3.3Å; E556-E560 WeakPolarHBondContact O-CB 3.33Å; E556-E560 PolarHBondContact O-N 2.87Å; E560-R563 PolarHBondContact O-N 2.95Å; E560-K564 HydrophobicContact CG-CD 4.18Å; E560-K564 VanDerWaalsContact O-CB 3.3Å; E560-K564 WeakPolarHBondContact O-CB 3.19Å; E560-K564 VanDerWaalsContact O-CG 3.3Å; E560-K564 WeakPolarHBondContact O-CG 3.06Å; E560-K564 PolarHBondContact O-N 2.89Å; E560-K564 WeakPolarHBondContact OE1-CE 3.44Å; E560-K564 IonicContact OE1-NZ 2.85Å; E560-K564 PolarHBondContact OE1-NZ 3.4Å
561	R	76	Confident	70.3	Confident	124 Å²	124	106.2 Å²	106.2	47%	0.468	51%	0.509	S	S	.	.	H	α-helix	trans	-65.8	-43.4	171.4	-167.5	-176.2	-49.8	124.4	8.4	110.9	E557 K564 E565	E557-R561 WeakPolarHBondContact O-CB 3.28Å; E557-R561 PolarHBondContact O-N 2.85Å; E557-R561 IonicContact OE2-NH2 2.61Å; E557-R561 PolarHBondContact OE2-NH2 2.91Å; R561-K564 CarbonylContact O-C 3.58Å; R561-K564 PolarHBondContact O-N 2.84Å; R561-E565 WeakPolarHBondContact O-CB 3.2Å; R561-E565 WeakPolarHBondContact O-CG 3.32Å; R561-E565 PolarHBondContact O-N 2.86Å
562	K	75.3	Confident	69.7	Low	111 Å²	111	105.2 Å²	105.2	48%	0.483	51%	0.51	S	S	.	.	H	α-helix	trans	-62.4	-45.2	171.9	-78.9	168.6	171.9	169.3	0	111.9	E558 V559 K564 E565 E566	E558-K562 HydrophobicContact CG-CD 4.4Å; E558-K562 VanDerWaalsContact O-CB 3.32Å; E558-K562 WeakPolarHBondContact O-CB 3.26Å; E558-K562 VanDerWaalsContact O-CG 3.3Å; E558-K562 WeakPolarHBondContact O-CG 3.27Å; E558-K562 PolarHBondContact O-N 2.63Å; E558-K562 WeakPolarHBondContact OE1-CE 3.2Å; E558-K562 IonicContact OE1-NZ 2.63Å; E558-K562 PolarHBondContact OE1-NZ 3.07Å; V559-K562 PolarHBondContact O-N 3.38Å; K562-K564 VanDerWaalsContact C-N 3.33Å; K562-K564 PolarHBondContact O-N 2.88Å; K562-E565 PolarHBondContact O-N 2.64Å; K562-E566 VanDerWaalsContact O-CB 3.29Å; K562-E566 WeakPolarHBondContact O-CB 3.16Å; K562-E566 PolarHBondContact O-N 2.73Å
563	R	73	Confident	69.5	Low	164 Å²	164	110.1 Å²	110.1	62%	0.619	52%	0.52	S	S	*	.	H	α-helix	trans	-59.2	-41.2	172.6	-78	174.2	176.4	164.1	-0.3	111.9	V559 E560 E566 E567	V559-R563 WeakPolarHBondContact O-CB 3.49Å; V559-R563 VanDerWaalsContact O-CG 3.31Å; V559-R563 WeakPolarHBondContact O-CG 3.25Å; V559-R563 PolarHBondContact O-N 2.82Å; E560-R563 PolarHBondContact O-N 2.95Å; R563-E566 PolarHBondContact O-N 3.34Å; R563-E567 WeakPolarHBondContact O-CA 3.39Å; R563-E567 WeakPolarHBondContact O-CB 3.41Å; R563-E567 PolarHBondContact O-N 2.92Å
564	K	71.4	Confident	68.5	Low	98 Å²	98	108.3 Å²	108.3	43%	0.426	52%	0.515	S	S	.	.	H	α-helix	trans	-74.1	-23	176.9	-75.7	170.3	174.9	171.1	0	113.6	E560 R561 K562 K568	E560-K564 HydrophobicContact CG-CD 4.18Å; E560-K564 VanDerWaalsContact O-CB 3.3Å; E560-K564 WeakPolarHBondContact O-CB 3.19Å; E560-K564 VanDerWaalsContact O-CG 3.3Å; E560-K564 WeakPolarHBondContact O-CG 3.06Å; E560-K564 PolarHBondContact O-N 2.89Å; E560-K564 WeakPolarHBondContact OE1-CE 3.44Å; E560-K564 IonicContact OE1-NZ 2.85Å; E560-K564 PolarHBondContact OE1-NZ 3.4Å; R561-K564 CarbonylContact O-C 3.58Å; R561-K564 PolarHBondContact O-N 2.84Å; K562-K564 VanDerWaalsContact C-N 3.33Å; K562-K564 PolarHBondContact O-N 2.88Å; K564-K568 VanDerWaalsContact O-CB 3.28Å; K564-K568 WeakPolarHBondContact O-CB 3.31Å; K564-K568 VanDerWaalsContact O-CD 3.26Å; K564-K568 WeakPolarHBondContact O-CD 3.29Å; K564-K568 WeakPolarHBondContact O-CG 3.12Å; K564-K568 PolarHBondContact O-N 3.42Å
565	E	73.8	Confident	67.7	Low	123 Å²	123	109.3 Å²	109.3	58%	0.575	52%	0.522	S	S	*	.	H	α-helix	trans	-78.9	-38.8	169.3	-77	175.8	177.9	0	0	111.3	R561 K562 K568 A569	R561-E565 WeakPolarHBondContact O-CB 3.2Å; R561-E565 WeakPolarHBondContact O-CG 3.32Å; R561-E565 PolarHBondContact O-N 2.86Å; K562-E565 PolarHBondContact O-N 2.64Å; E565-K568 CarbonylContact O-C 3.56Å; E565-K568 PolarHBondContact O-N 3.43Å; E565-A569 WeakPolarHBondContact O-CB 3.43Å; E565-A569 PolarHBondContact O-N 2.7Å
566	E	69.8	Low	67.2	Low	127 Å²	127	110.8 Å²	110.8	59%	0.593	53%	0.528	S	S	*	.	H	α-helix	trans	-69.6	-43.4	174.8	-170.4	161.9	-138	0	0	111.3	K562 R563 K568 A569 E570	K562-E566 VanDerWaalsContact O-CB 3.29Å; K562-E566 WeakPolarHBondContact O-CB 3.16Å; K562-E566 PolarHBondContact O-N 2.73Å; R563-E566 PolarHBondContact O-N 3.34Å; E566-K568 VanDerWaalsContact C-N 3.29Å; E566-K568 PolarHBondContact O-N 3.31Å; E566-A569 CarbonylContact O-C 3.57Å; E566-A569 WeakPolarHBondContact O-CA 3.27Å; E566-A569 WeakPolarHBondContact O-CB 3.33Å; E566-A569 PolarHBondContact O-N 3.47Å; E566-E570 WeakPolarHBondContact O-CB 3.46Å; E566-E570 WeakPolarHBondContact O-CG 3.33Å; E566-E570 PolarHBondContact O-N 2.74Å
567	E	67.2	Low	66.9	Low	133 Å²	133	107.8 Å²	107.8	62%	0.621	52%	0.519	S	S	*	.	H	α-helix	trans	-64.6	-29.3	171.1	-177.9	-178.5	-152.1	0	0	112	R563 G571	R563-E567 WeakPolarHBondContact O-CA 3.39Å; R563-E567 WeakPolarHBondContact O-CB 3.41Å; R563-E567 PolarHBondContact O-N 2.92Å; E567-G571 WeakPolarHBondContact O-CA 3.39Å; E567-G571 PolarHBondContact O-N 2.8Å
568	K	68.3	Low	66.3	Low	148 Å²	148	107.6 Å²	107.6	64%	0.643	52%	0.518	S	S	*	.	H	α-helix	trans	-78.5	-29	168.5	-77.9	171.3	-172.9	177.5	0	112.8	K564 E565 E566 T572	K564-K568 VanDerWaalsContact O-CB 3.28Å; K564-K568 WeakPolarHBondContact O-CB 3.31Å; K564-K568 VanDerWaalsContact O-CD 3.26Å; K564-K568 WeakPolarHBondContact O-CD 3.29Å; K564-K568 WeakPolarHBondContact O-CG 3.12Å; K564-K568 PolarHBondContact O-N 3.42Å; E565-K568 CarbonylContact O-C 3.56Å; E565-K568 PolarHBondContact O-N 3.43Å; E566-K568 VanDerWaalsContact C-N 3.29Å; E566-K568 PolarHBondContact O-N 3.31Å; K568-T572 WeakPolarHBondContact O-CB 3.29Å; K568-T572 WeakPolarHBondContact O-CG2 3.4Å; K568-T572 PolarHBondContact O-N 2.76Å; K568-T572 PolarHBondContact O-OG1 3.14Å
569	A	66.2	Low	65.8	Low	56 Å²	56	106.3 Å²	106.3	46%	0.463	52%	0.519	S	S	.	.	H	α-helix	trans	-74.9	-42.8	174.6	0	0	0	0	0	111.2	E565 E566 T572 R573	E565-A569 WeakPolarHBondContact O-CB 3.43Å; E565-A569 PolarHBondContact O-N 2.7Å; E566-A569 CarbonylContact O-C 3.57Å; E566-A569 WeakPolarHBondContact O-CA 3.27Å; E566-A569 WeakPolarHBondContact O-CB 3.33Å; E566-A569 PolarHBondContact O-N 3.47Å; A569-T572 PolarHBondContact O-OG1 2.66Å; A569-R573 WeakPolarHBondContact O-CB 3.4Å; A569-R573 PolarHBondContact O-N 2.89Å
570	E	64	Low	65.4	Low	134 Å²	134	108.4 Å²	108.4	63%	0.626	52%	0.522	S	S	*	.	H	α-helix	trans	-69.9	-34.9	169.5	-67.6	-141.2	120.7	0	0	111.5	E566 G574	E566-E570 WeakPolarHBondContact O-CB 3.46Å; E566-E570 WeakPolarHBondContact O-CG 3.33Å; E566-E570 PolarHBondContact O-N 2.74Å; E570-G574 VanDerWaalsContact O-CA 3.27Å; E570-G574 WeakPolarHBondContact O-CA 3.16Å; E570-G574 PolarHBondContact O-N 3.21Å
571	G	57.3	Low	65.3	Low	37 Å²	37	112 Å²	112	38%	0.381	53%	0.532	S	S	.	.	H	α-helix	trans	-64.7	-51.5	173.6	0	0	0	0	0	111.8	E567 G574 E575	E567-G571 WeakPolarHBondContact O-CA 3.39Å; E567-G571 PolarHBondContact O-N 2.8Å; G571-G574 CarbonylContact O-C 3.6Å; G571-G574 PolarHBondContact O-N 3.2Å; G571-E575 WeakPolarHBondContact O-CB 3.17Å; G571-E575 PolarHBondContact O-N 2.83Å
572	T	59.7	Low	64.6	Low	83 Å²	83	111.6 Å²	111.6	51%	0.509	53%	0.533	S	S	.	.	H	α-helix	trans	-71.2	-28.2	175.6	53.8	0	0	0	0	113.1	K568 A569 K576	K568-T572 WeakPolarHBondContact O-CB 3.29Å; K568-T572 WeakPolarHBondContact O-CG2 3.4Å; K568-T572 PolarHBondContact O-N 2.76Å; K568-T572 PolarHBondContact O-OG1 3.14Å; A569-T572 PolarHBondContact O-OG1 2.66Å; T572-K576 WeakPolarHBondContact O-CB 3.36Å; T572-K576 PolarHBondContact O-N 2.77Å
573	R	59.3	Low	64.3	Low	180 Å²	180	112.1 Å²	112.1	68%	0.679	54%	0.537	S	S	*	.	H	α-helix	trans	-72	-37.6	170.2	-175.8	179.3	-172.5	177	1.7	111.6	A569 K576 V577	A569-R573 WeakPolarHBondContact O-CB 3.4Å; A569-R573 PolarHBondContact O-N 2.89Å; R573-K576 CarbonylContact O-C 3.4Å; R573-K576 PolarHBondContact O-N 3.46Å; R573-V577 WeakPolarHBondContact O-CB 3.44Å; R573-V577 VanDerWaalsContact O-CG2 3.25Å; R573-V577 WeakPolarHBondContact O-CG2 3.3Å; R573-V577 PolarHBondContact O-N 3.14Å
574	G	51.9	Low	64.1	Low	31 Å²	31	109.4 Å²	109.4	32%	0.32	53%	0.532	S	S	.	.	H	α-helix	trans	-65.5	-55.9	175.5	0	0	0	0	0	109.9	E570 G571 K576 V577 E578	E570-G574 VanDerWaalsContact O-CA 3.27Å; E570-G574 WeakPolarHBondContact O-CA 3.16Å; E570-G574 PolarHBondContact O-N 3.21Å; G571-G574 CarbonylContact O-C 3.6Å; G571-G574 PolarHBondContact O-N 3.2Å; G574-K576 PolarHBondContact O-N 3.3Å; G574-V577 CarbonylContact O-C 3.6Å; G574-V577 WeakPolarHBondContact O-CA 3.25Å; G574-V577 PolarHBondContact O-N 2.75Å; G574-E578 VanDerWaalsContact O-CB 3.24Å; G574-E578 WeakPolarHBondContact O-CB 3.13Å; G574-E578 PolarHBondContact O-N 2.97Å
575	E	57.3	Low	64	Low	133 Å²	133	109.3 Å²	109.3	62%	0.621	53%	0.533	S	S	*	.	H	α-helix	trans	-54.9	-36	170.6	-175	-178.5	-144.4	0	0	112.1	G571 S579	G571-E575 WeakPolarHBondContact O-CB 3.17Å; G571-E575 PolarHBondContact O-N 2.83Å; E575-S579 WeakPolarHBondContact O-CA 3.41Å; E575-S579 WeakPolarHBondContact O-CB 3.45Å; E575-S579 PolarHBondContact O-N 3.02Å; E575-S579 PolarHBondContact O-OG 2.9Å
576	K	59.4	Low	63.5	Low	144 Å²	144	107.1 Å²	107.1	63%	0.626	53%	0.528	S	S	*	.	H	α-helix	trans	-76.1	-24.9	174.1	-170	164.5	-171.8	166.5	0	114.3	T572 R573 G574 S579 K580	T572-K576 WeakPolarHBondContact O-CB 3.36Å; T572-K576 PolarHBondContact O-N 2.77Å; R573-K576 CarbonylContact O-C 3.4Å; R573-K576 PolarHBondContact O-N 3.46Å; G574-K576 PolarHBondContact O-N 3.3Å; K576-S579 WeakPolarHBondContact CA-OG 3.37Å; K576-S579 PolarHBondContact O-OG 2.86Å; K576-K580 VanDerWaalsContact O-CB 3.29Å; K576-K580 WeakPolarHBondContact O-CB 3.29Å; K576-K580 VanDerWaalsContact O-CG 3.3Å; K576-K580 WeakPolarHBondContact O-CG 3.24Å; K576-K580 PolarHBondContact O-N 2.81Å
577	V	65.3	Low	63.7	Low	72 Å²	72	104.3 Å²	104.3	44%	0.436	52%	0.519	S	S	.	.	H	α-helix	trans	-84	-30.4	171	165.3	0	0	0	0	110.8	R573 G574 R581	R573-V577 WeakPolarHBondContact O-CB 3.44Å; R573-V577 VanDerWaalsContact O-CG2 3.25Å; R573-V577 WeakPolarHBondContact O-CG2 3.3Å; R573-V577 PolarHBondContact O-N 3.14Å; G574-V577 CarbonylContact O-C 3.6Å; G574-V577 WeakPolarHBondContact O-CA 3.25Å; G574-V577 PolarHBondContact O-N 2.75Å; V577-R581 VanDerWaalsContact O-CB 3.31Å; V577-R581 WeakPolarHBondContact O-CB 3.36Å; V577-R581 VanDerWaalsContact O-CG 3.29Å; V577-R581 WeakPolarHBondContact O-CG 3.15Å; V577-R581 PolarHBondContact O-N 3.48Å
578	E	58.8	Low	63.9	Low	101 Å²	101	103.3 Å²	103.3	47%	0.472	51%	0.512	S	S	.	.	H	α-helix	trans	-84.8	-37.9	-178.8	-165.8	-178.3	138.7	0	0	111.3	G574 K580 R581 K582	G574-E578 VanDerWaalsContact O-CB 3.24Å; G574-E578 WeakPolarHBondContact O-CB 3.13Å; G574-E578 PolarHBondContact O-N 2.97Å; E578-K580 VanDerWaalsContact C-N 3.35Å; E578-R581 PolarHBondContact O-N 2.89Å; E578-K582 HydrophobicContact CG-CD 4.33Å; E578-K582 VanDerWaalsContact O-CB 3.25Å; E578-K582 WeakPolarHBondContact O-CB 3.29Å; E578-K582 VanDerWaalsContact O-CG 3.23Å; E578-K582 WeakPolarHBondContact O-CG 3.46Å; E578-K582 PolarHBondContact O-N 3.47Å; E578-K582 WeakPolarHBondContact OE1-CE 3.31Å; E578-K582 IonicContact OE1-NZ 2.61Å; E578-K582 PolarHBondContact OE1-NZ 2.91Å
579	S	63.9	Low	63.9	Low	61 Å²	61	101.9 Å²	101.9	43%	0.427	51%	0.506	S	S	.	.	H	α-helix	trans	-61.9	-43.4	164.7	53	0	0	0	0	110.5	E575 K576 R581 K582 E583	E575-S579 WeakPolarHBondContact O-CA 3.41Å; E575-S579 WeakPolarHBondContact O-CB 3.45Å; E575-S579 PolarHBondContact O-N 3.02Å; E575-S579 PolarHBondContact O-OG 2.9Å; K576-S579 WeakPolarHBondContact CA-OG 3.37Å; K576-S579 PolarHBondContact O-OG 2.86Å; S579-R581 PolarHBondContact O-N 3.29Å; S579-K582 PolarHBondContact O-N 3.33Å; S579-E583 WeakPolarHBondContact O-CB 3.3Å; S579-E583 PolarHBondContact O-N 3.15Å
580	K	66.4	Low	64.2	Low	116 Å²	116	105.5 Å²	105.5	50%	0.504	51%	0.514	S	S	.	.	H	α-helix	trans	-62.9	-37.4	171.4	-87.1	-179.9	159.3	-65.4	0	113.9	K576 E578 E584	K576-K580 VanDerWaalsContact O-CB 3.29Å; K576-K580 WeakPolarHBondContact O-CB 3.29Å; K576-K580 VanDerWaalsContact O-CG 3.3Å; K576-K580 WeakPolarHBondContact O-CG 3.24Å; K576-K580 PolarHBondContact O-N 2.81Å; E578-K580 VanDerWaalsContact C-N 3.35Å; K580-E584 VanDerWaalsContact O-CB 3.32Å; K580-E584 WeakPolarHBondContact O-CB 3.43Å; K580-E584 WeakPolarHBondContact O-CG 3.42Å; K580-E584 PolarHBondContact O-N 3.33Å
581	R	67.6	Low	64.8	Low	177 Å²	177	105.2 Å²	105.2	67%	0.668	51%	0.512	S	S	*	.	H	α-helix	trans	-69.2	-42.5	174.2	-85.4	176	167.2	-178.9	-4.3	111.3	V577 E578 S579 E584 E585	V577-R581 VanDerWaalsContact O-CB 3.31Å; V577-R581 WeakPolarHBondContact O-CB 3.36Å; V577-R581 VanDerWaalsContact O-CG 3.29Å; V577-R581 WeakPolarHBondContact O-CG 3.15Å; V577-R581 PolarHBondContact O-N 3.48Å; E578-R581 PolarHBondContact O-N 2.89Å; S579-R581 PolarHBondContact O-N 3.29Å; R581-E584 CarbonylContact O-C 3.56Å; R581-E584 PolarHBondContact O-N 3Å; R581-E585 WeakPolarHBondContact O-CA 3.48Å; R581-E585 WeakPolarHBondContact O-CB 3.41Å; R581-E585 PolarHBondContact O-N 2.88Å
582	K	61.6	Low	65.5	Low	115 Å²	115	106.9 Å²	106.9	50%	0.5	51%	0.51	S	S	.	.	H	α-helix	trans	-64.2	-40.2	174.7	-75.1	170.5	-176.7	168.5	0	110.8	E578 S579 E585 T586	E578-K582 HydrophobicContact CG-CD 4.33Å; E578-K582 VanDerWaalsContact O-CB 3.25Å; E578-K582 WeakPolarHBondContact O-CB 3.29Å; E578-K582 VanDerWaalsContact O-CG 3.23Å; E578-K582 WeakPolarHBondContact O-CG 3.46Å; E578-K582 PolarHBondContact O-N 3.47Å; E578-K582 WeakPolarHBondContact OE1-CE 3.31Å; E578-K582 IonicContact OE1-NZ 2.61Å; E578-K582 PolarHBondContact OE1-NZ 2.91Å; S579-K582 PolarHBondContact O-N 3.33Å; K582-E585 CarbonylContact O-C 3.51Å; K582-E585 PolarHBondContact O-N 2.86Å; K582-T586 WeakPolarHBondContact O-CB 3.2Å; K582-T586 WeakPolarHBondContact O-CG2 3.38Å; K582-T586 PolarHBondContact O-N 3.16Å; K582-T586 PolarHBondContact O-OG1 2.8Å
583	E	67.8	Low	66.1	Low	121 Å²	121	106.2 Å²	106.2	57%	0.565	51%	0.506	S	S	*	.	H	α-helix	trans	-64.8	-48.4	174	-175	178	-139.2	0	0	111	S579 E585 T586 V587	S579-E583 WeakPolarHBondContact O-CB 3.3Å; S579-E583 PolarHBondContact O-N 3.15Å; E583-E585 VanDerWaalsContact C-N 3.3Å; E583-E585 PolarHBondContact O-N 3.16Å; E583-T586 WeakPolarHBondContact CA-OG1 3.42Å; E583-T586 PolarHBondContact O-N 3.42Å; E583-T586 PolarHBondContact O-OG1 2.63Å; E583-V587 WeakPolarHBondContact O-CB 3.46Å; E583-V587 VanDerWaalsContact O-CG2 3.25Å; E583-V587 WeakPolarHBondContact O-CG2 3.21Å; E583-V587 PolarHBondContact O-N 2.71Å
584	E	70.2	Confident	66.8	Low	108 Å²	108	102.5 Å²	102.5	51%	0.505	50%	0.496	S	S	.	.	H	α-helix	trans	-62.9	-33.4	171.8	-84.8	-169.5	-144.9	0	0	113	K580 R581 K588	K580-E584 VanDerWaalsContact O-CB 3.32Å; K580-E584 WeakPolarHBondContact O-CB 3.43Å; K580-E584 WeakPolarHBondContact O-CG 3.42Å; K580-E584 PolarHBondContact O-N 3.33Å; R581-E584 CarbonylContact O-C 3.56Å; R581-E584 PolarHBondContact O-N 3Å; E584-K588 VanDerWaalsContact O-CB 3.31Å; E584-K588 WeakPolarHBondContact O-CB 3.4Å; E584-K588 VanDerWaalsContact O-CD 3.24Å; E584-K588 WeakPolarHBondContact O-CD 3.39Å; E584-K588 WeakPolarHBondContact O-CG 3.38Å; E584-K588 PolarHBondContact O-N 3.19Å; E584-K588 IonicContact OE2-NZ 2.71Å; E584-K588 PolarHBondContact OE2-NZ 2.82Å
585	E	68.1	Low	68.1	Low	96 Å²	96	106.4 Å²	106.4	45%	0.449	50%	0.501	S	S	.	.	H	α-helix	trans	-79.6	-35.8	-179.9	-168.2	-172.5	141.9	0	0	111.3	R581 K582 E583 K588 K589	R581-E585 WeakPolarHBondContact O-CA 3.48Å; R581-E585 WeakPolarHBondContact O-CB 3.41Å; R581-E585 PolarHBondContact O-N 2.88Å; K582-E585 CarbonylContact O-C 3.51Å; K582-E585 PolarHBondContact O-N 2.86Å; E583-E585 VanDerWaalsContact C-N 3.3Å; E583-E585 PolarHBondContact O-N 3.16Å; E585-K588 PolarHBondContact O-N 3.34Å; E585-K589 HydrophobicContact CG-CD 4.21Å; E585-K589 WeakPolarHBondContact O-CB 3Å; E585-K589 WeakPolarHBondContact O-CG 3.43Å; E585-K589 PolarHBondContact O-N 2.76Å; E585-K589 VanDerWaalsContact OE1-CE 3.26Å; E585-K589 WeakPolarHBondContact OE1-CE 3.39Å; E585-K589 IonicContact OE1-NZ 2.61Å; E585-K589 PolarHBondContact OE1-NZ 3.22Å
586	T	64.3	Low	69	Low	77 Å²	77	105.2 Å²	105.2	47%	0.472	49%	0.494	S	S	.	.	H	α-helix	trans	-66	-42.7	168.6	48.7	0	0	0	0	110.2	K582 E583 K589 E590	K582-T586 WeakPolarHBondContact O-CB 3.2Å; K582-T586 WeakPolarHBondContact O-CG2 3.38Å; K582-T586 PolarHBondContact O-N 3.16Å; K582-T586 PolarHBondContact O-OG1 2.8Å; E583-T586 WeakPolarHBondContact CA-OG1 3.42Å; E583-T586 PolarHBondContact O-N 3.42Å; E583-T586 PolarHBondContact O-OG1 2.63Å; T586-K589 CarbonylContact O-C 3.57Å; T586-K589 PolarHBondContact O-N 3Å; T586-E590 WeakPolarHBondContact O-CB 3.38Å; T586-E590 WeakPolarHBondContact O-CG 3.45Å; T586-E590 PolarHBondContact O-N 2.74Å
587	V	72.5	Confident	69.8	Low	67 Å²	67	106.2 Å²	106.2	41%	0.406	49%	0.494	S	S	.	.	H	α-helix	trans	-62.4	-44.5	174	169	0	0	0	0	110.9	E583 K589 E590 E591	E583-V587 WeakPolarHBondContact O-CB 3.46Å; E583-V587 VanDerWaalsContact O-CG2 3.25Å; E583-V587 WeakPolarHBondContact O-CG2 3.21Å; E583-V587 PolarHBondContact O-N 2.71Å; V587-K589 VanDerWaalsContact C-N 3.34Å; V587-K589 PolarHBondContact O-N 2.88Å; V587-E590 PolarHBondContact O-N 2.6Å; V587-E591 HydrophobicContact CG1-CG 4.41Å; V587-E591 WeakPolarHBondContact O-CB 3.22Å; V587-E591 WeakPolarHBondContact O-CG 3.43Å; V587-E591 PolarHBondContact O-N 2.84Å
588	K	72.9	Confident	70.3	Confident	112 Å²	112	107.4 Å²	107.4	49%	0.487	49%	0.493	S	S	.	.	H	α-helix	trans	-65.9	-33.8	175.4	-73.1	160	-161.6	160.7	0	112.6	E584 E585 E592	E584-K588 VanDerWaalsContact O-CB 3.31Å; E584-K588 WeakPolarHBondContact O-CB 3.4Å; E584-K588 VanDerWaalsContact O-CD 3.24Å; E584-K588 WeakPolarHBondContact O-CD 3.39Å; E584-K588 WeakPolarHBondContact O-CG 3.38Å; E584-K588 PolarHBondContact O-N 3.19Å; E584-K588 IonicContact OE2-NZ 2.71Å; E584-K588 PolarHBondContact OE2-NZ 2.82Å; E585-K588 PolarHBondContact O-N 3.34Å; K588-E592 WeakPolarHBondContact O-CB 3.46Å; K588-E592 PolarHBondContact O-N 2.68Å
589	K	68.3	Low	71.1	Confident	118 Å²	118	107.9 Å²	107.9	51%	0.513	50%	0.495	S	S	.	.	H	α-helix	trans	-71.8	-37.1	173.7	-79.1	168.8	171.7	170.5	0	111.8	E585 T586 V587 E592 V593	E585-K589 HydrophobicContact CG-CD 4.21Å; E585-K589 WeakPolarHBondContact O-CB 3Å; E585-K589 WeakPolarHBondContact O-CG 3.43Å; E585-K589 PolarHBondContact O-N 2.76Å; E585-K589 VanDerWaalsContact OE1-CE 3.26Å; E585-K589 WeakPolarHBondContact OE1-CE 3.39Å; E585-K589 IonicContact OE1-NZ 2.61Å; E585-K589 PolarHBondContact OE1-NZ 3.22Å; T586-K589 CarbonylContact O-C 3.57Å; T586-K589 PolarHBondContact O-N 3Å; V587-K589 VanDerWaalsContact C-N 3.34Å; V587-K589 PolarHBondContact O-N 2.88Å; K589-E592 PolarHBondContact O-N 2.92Å; K589-V593 VanDerWaalsContact O-CB 3.27Å; K589-V593 WeakPolarHBondContact O-CB 3.47Å; K589-V593 WeakPolarHBondContact O-CG2 3.3Å; K589-V593 PolarHBondContact O-N 2.88Å
590	E	71.9	Confident	71.6	Confident	133 Å²	133	111.4 Å²	111.4	62%	0.621	51%	0.505	S	S	*	.	H	α-helix	trans	-70.2	-44.4	173.6	-75.3	-174.9	151.8	0	0	111.1	T586 V587 E592 V593 E594	T586-E590 WeakPolarHBondContact O-CB 3.38Å; T586-E590 WeakPolarHBondContact O-CG 3.45Å; T586-E590 PolarHBondContact O-N 2.74Å; V587-E590 PolarHBondContact O-N 2.6Å; E590-E592 VanDerWaalsContact C-N 3.29Å; E590-E592 PolarHBondContact O-N 3.47Å; E590-V593 PolarHBondContact O-N 3.31Å; E590-E594 VanDerWaalsContact O-CB 3.28Å; E590-E594 WeakPolarHBondContact O-CB 3.49Å; E590-E594 PolarHBondContact O-N 2.78Å
591	E	75.5	Confident	72	Confident	127 Å²	127	112.1 Å²	112.1	59%	0.593	51%	0.51	S	S	*	.	H	α-helix	trans	-61	-36.5	171.1	-75.9	-172.5	156.1	0	0	111.8	V587 R595	V587-E591 HydrophobicContact CG1-CG 4.41Å; V587-E591 WeakPolarHBondContact O-CB 3.22Å; V587-E591 WeakPolarHBondContact O-CG 3.43Å; V587-E591 PolarHBondContact O-N 2.84Å; E591-R595 WeakPolarHBondContact O-CB 3.11Å; E591-R595 PolarHBondContact O-N 3.38Å
592	E	72.6	Confident	72.3	Confident	73 Å²	73	110.3 Å²	110.3	34%	0.341	51%	0.507	S	S	.	.	H	α-helix	trans	-72.7	-39.9	173.9	-177.9	154.9	133.7	0	0	113	K588 K589 E590 E594 R595 K596	K588-E592 WeakPolarHBondContact O-CB 3.46Å; K588-E592 PolarHBondContact O-N 2.68Å; K589-E592 PolarHBondContact O-N 2.92Å; E590-E592 VanDerWaalsContact C-N 3.29Å; E590-E592 PolarHBondContact O-N 3.47Å; E592-E594 VanDerWaalsContact C-N 3.35Å; E592-R595 VanDerWaalsContact CB-NH2 3.35Å; E592-R595 PolarHBondContact O-N 3.42Å; E592-R595 IonicContact OE2-CZ 2.7Å; E592-R595 IonicContact OE2-NH1 3.7Å; E592-R595 IonicContact OE2-NH2 3.88Å; E592-R595 PolarHBondContact OE2-NH2 2.8Å; E592-K596 HydrophobicContact CG-CD 3.94Å; E592-K596 HydrophobicContact CG-CG 4.36Å; E592-K596 VanDerWaalsContact O-CB 3.24Å; E592-K596 WeakPolarHBondContact O-CB 2.96Å; E592-K596 VanDerWaalsContact O-CG 3.29Å; E592-K596 WeakPolarHBondContact O-CG 3.47Å; E592-K596 PolarHBondContact O-N 3.01Å; E592-K596 WeakPolarHBondContact OE1-CE 3.37Å; E592-K596 IonicContact OE1-NZ 2.6Å; E592-K596 PolarHBondContact OE1-NZ 3.47Å
593	V	72.8	Confident	72.7	Confident	69 Å²	69	107.3 Å²	107.3	42%	0.418	50%	0.504	S	S	.	.	H	α-helix	trans	-67.4	-37.1	174.8	164.3	0	0	0	0	110.5	K589 E590 R597	K589-V593 VanDerWaalsContact O-CB 3.27Å; K589-V593 WeakPolarHBondContact O-CB 3.47Å; K589-V593 WeakPolarHBondContact O-CG2 3.3Å; K589-V593 PolarHBondContact O-N 2.88Å; E590-V593 PolarHBondContact O-N 3.31Å; V593-R597 VanDerWaalsContact O-CB 3.27Å; V593-R597 WeakPolarHBondContact O-CB 3.39Å; V593-R597 WeakPolarHBondContact O-CG 3.26Å; V593-R597 PolarHBondContact O-N 2.74Å
594	E	74.7	Confident	73	Confident	101 Å²	101	108.5 Å²	108.5	47%	0.472	51%	0.51	S	S	.	.	H	α-helix	trans	-73.9	-36.5	175.5	-164	179.4	138.4	0	0	111.7	E590 E592 R597 K598	E590-E594 VanDerWaalsContact O-CB 3.28Å; E590-E594 WeakPolarHBondContact O-CB 3.49Å; E590-E594 PolarHBondContact O-N 2.78Å; E592-E594 VanDerWaalsContact C-N 3.35Å; E594-R597 PolarHBondContact O-N 2.98Å; E594-K598 HydrophobicContact CG-CD 4.25Å; E594-K598 WeakPolarHBondContact O-CB 3.21Å; E594-K598 WeakPolarHBondContact O-CD 3.5Å; E594-K598 VanDerWaalsContact O-CG 3.25Å; E594-K598 WeakPolarHBondContact O-CG 3.38Å; E594-K598 PolarHBondContact O-N 2.84Å; E594-K598 VanDerWaalsContact OE1-CE 3.28Å; E594-K598 WeakPolarHBondContact OE1-CE 3.38Å; E594-K598 IonicContact OE1-NZ 2.58Å; E594-K598 PolarHBondContact OE1-NZ 2.79Å
595	R	77.8	Confident	72.9	Confident	114 Å²	114	106.8 Å²	106.8	43%	0.43	51%	0.509	S	S	.	.	H	α-helix	trans	-63.4	-46.9	170.1	172.1	164.7	42.8	87.2	0.5	111.4	E591 E592 K598 E599	E591-R595 WeakPolarHBondContact O-CB 3.11Å; E591-R595 PolarHBondContact O-N 3.38Å; E592-R595 VanDerWaalsContact CB-NH2 3.35Å; E592-R595 PolarHBondContact O-N 3.42Å; E592-R595 IonicContact OE2-CZ 2.7Å; E592-R595 IonicContact OE2-NH1 3.7Å; E592-R595 IonicContact OE2-NH2 3.88Å; E592-R595 PolarHBondContact OE2-NH2 2.8Å; R595-K598 CarbonylContact O-C 3.48Å; R595-K598 PolarHBondContact O-N 3.5Å; R595-E599 WeakPolarHBondContact CG-OE1 3.41Å; R595-E599 WeakPolarHBondContact O-CB 3.2Å; R595-E599 WeakPolarHBondContact O-CG 3.26Å; R595-E599 PolarHBondContact O-N 2.6Å
596	K	76.8	Confident	72.9	Confident	108 Å²	108	106 Å²	106	47%	0.47	51%	0.512	S	S	.	.	H	α-helix	trans	-61.9	-44.2	173.9	-78.3	171.7	173.8	166	0	111.5	E592 K598 E599 E600	E592-K596 HydrophobicContact CG-CD 3.94Å; E592-K596 HydrophobicContact CG-CG 4.36Å; E592-K596 VanDerWaalsContact O-CB 3.24Å; E592-K596 WeakPolarHBondContact O-CB 2.96Å; E592-K596 VanDerWaalsContact O-CG 3.29Å; E592-K596 WeakPolarHBondContact O-CG 3.47Å; E592-K596 PolarHBondContact O-N 3.01Å; E592-K596 WeakPolarHBondContact OE1-CE 3.37Å; E592-K596 IonicContact OE1-NZ 2.6Å; E592-K596 PolarHBondContact OE1-NZ 3.47Å; K596-K598 VanDerWaalsContact C-N 3.34Å; K596-K598 PolarHBondContact O-N 3.2Å; K596-E599 CarbonylContact O-C 3.48Å; K596-E599 PolarHBondContact O-N 3.06Å; K596-E600 WeakPolarHBondContact O-CB 3.28Å; K596-E600 PolarHBondContact O-N 3.13Å
597	R	76.2	Confident	73.1	Confident	165 Å²	165	111.3 Å²	111.3	62%	0.623	52%	0.523	S	S	*	.	H	α-helix	trans	-59.3	-40.7	172.2	-79.1	170.7	176.4	166.7	0.6	112.4	V593 E594 E600 E601	V593-R597 VanDerWaalsContact O-CB 3.27Å; V593-R597 WeakPolarHBondContact O-CB 3.39Å; V593-R597 WeakPolarHBondContact O-CG 3.26Å; V593-R597 PolarHBondContact O-N 2.74Å; E594-R597 PolarHBondContact O-N 2.98Å; R597-E600 PolarHBondContact O-N 2.94Å; R597-E601 WeakPolarHBondContact O-CB 3.49Å; R597-E601 PolarHBondContact O-N 3.38Å
598	K	76.4	Confident	72.8	Confident	97 Å²	97	109.8 Å²	109.8	42%	0.422	52%	0.521	S	S	.	.	H	α-helix	trans	-73.9	-25.7	176.8	-75.5	166.3	174.8	169.7	0	113.5	E594 R595 K596 K602	E594-K598 HydrophobicContact CG-CD 4.25Å; E594-K598 WeakPolarHBondContact O-CB 3.21Å; E594-K598 WeakPolarHBondContact O-CD 3.5Å; E594-K598 VanDerWaalsContact O-CG 3.25Å; E594-K598 WeakPolarHBondContact O-CG 3.38Å; E594-K598 PolarHBondContact O-N 2.84Å; E594-K598 VanDerWaalsContact OE1-CE 3.28Å; E594-K598 WeakPolarHBondContact OE1-CE 3.38Å; E594-K598 IonicContact OE1-NZ 2.58Å; E594-K598 PolarHBondContact OE1-NZ 2.79Å; R595-K598 CarbonylContact O-C 3.48Å; R595-K598 PolarHBondContact O-N 3.5Å; K596-K598 VanDerWaalsContact C-N 3.34Å; K596-K598 PolarHBondContact O-N 3.2Å; K598-K602 WeakPolarHBondContact O-CB 3.49Å; K598-K602 VanDerWaalsContact O-CD 3.25Å; K598-K602 WeakPolarHBondContact O-CD 3.34Å; K598-K602 WeakPolarHBondContact O-CG 3.33Å; K598-K602 PolarHBondContact O-N 2.92Å
599	E	75.8	Confident	72.8	Confident	111 Å²	111	111 Å²	111	52%	0.519	53%	0.528	S	S	.	.	H	α-helix	trans	-79.1	-37.7	171.6	-76	168.2	-173.2	0	0	110.8	R595 K596 K602 A603	R595-E599 WeakPolarHBondContact CG-OE1 3.41Å; R595-E599 WeakPolarHBondContact O-CB 3.2Å; R595-E599 WeakPolarHBondContact O-CG 3.26Å; R595-E599 PolarHBondContact O-N 2.6Å; K596-E599 CarbonylContact O-C 3.48Å; K596-E599 PolarHBondContact O-N 3.06Å; E599-K602 PolarHBondContact O-N 3.05Å; E599-A603 VanDerWaalsContact O-CB 3.26Å; E599-A603 WeakPolarHBondContact O-CB 3.3Å; E599-A603 PolarHBondContact O-N 3.03Å
600	E	73.9	Confident	72.5	Confident	134 Å²	134	112.1 Å²	112.1	63%	0.626	53%	0.533	S	S	*	.	H	α-helix	trans	-70.1	-43	174.7	-173.5	167	-143.2	0	0	111.7	K596 R597 K602 A603 E604	K596-E600 WeakPolarHBondContact O-CB 3.28Å; K596-E600 PolarHBondContact O-N 3.13Å; R597-E600 PolarHBondContact O-N 2.94Å; E600-K602 VanDerWaalsContact C-N 3.31Å; E600-K602 PolarHBondContact O-N 3.01Å; E600-A603 CarbonylContact O-C 3.56Å; E600-A603 PolarHBondContact O-N 3.22Å; E600-A603 VanDerWaalsContact O-N 3.14Å; E600-E604 VanDerWaalsContact O-CB 3.3Å; E600-E604 WeakPolarHBondContact O-CB 3.27Å; E600-E604 PolarHBondContact O-N 2.95Å
601	E	73.9	Confident	72.4	Confident	131 Å²	131	109.2 Å²	109.2	61%	0.612	52%	0.524	S	S	*	.	H	α-helix	trans	-61.6	-37.6	171.8	-178.4	-176.3	-162.1	0	0	111.2	R597 S605	R597-E601 WeakPolarHBondContact O-CB 3.49Å; R597-E601 PolarHBondContact O-N 3.38Å; E601-S605 WeakPolarHBondContact O-CB 3.33Å; E601-S605 PolarHBondContact O-N 2.92Å
602	K	74	Confident	72.1	Confident	139 Å²	139	108.4 Å²	108.4	60%	0.604	52%	0.52	S	S	*	.	H	α-helix	trans	-72.2	-36.9	172	-75.3	170.5	-170.1	170.3	0	112.5	K598 E599 E600 T606	K598-K602 WeakPolarHBondContact O-CB 3.49Å; K598-K602 VanDerWaalsContact O-CD 3.25Å; K598-K602 WeakPolarHBondContact O-CD 3.34Å; K598-K602 WeakPolarHBondContact O-CG 3.33Å; K598-K602 PolarHBondContact O-N 2.92Å; E599-K602 PolarHBondContact O-N 3.05Å; E600-K602 VanDerWaalsContact C-N 3.31Å; E600-K602 PolarHBondContact O-N 3.01Å; K602-T606 WeakPolarHBondContact O-CB 3.41Å; K602-T606 WeakPolarHBondContact O-CG2 3.5Å; K602-T606 PolarHBondContact O-N 3.05Å; K602-T606 PolarHBondContact O-OG1 3.17Å
603	A	71	Confident	72.1	Confident	53 Å²	53	107.5 Å²	107.5	44%	0.438	52%	0.522	S	S	.	.	H	α-helix	trans	-68.1	-37.2	175	0	0	0	0	0	110.9	E599 E600 T606 R607	E599-A603 VanDerWaalsContact O-CB 3.26Å; E599-A603 WeakPolarHBondContact O-CB 3.3Å; E599-A603 PolarHBondContact O-N 3.03Å; E600-A603 CarbonylContact O-C 3.56Å; E600-A603 PolarHBondContact O-N 3.22Å; E600-A603 VanDerWaalsContact O-N 3.14Å; A603-T606 PolarHBondContact O-OG1 3.04Å; A603-R607 WeakPolarHBondContact O-CA 3.42Å; A603-R607 WeakPolarHBondContact O-CB 3.19Å; A603-R607 PolarHBondContact O-N 2.99Å
604	E	72.5	Confident	71.9	Confident	146 Å²	146	109.9 Å²	109.9	68%	0.682	53%	0.527	S	S	*	.	H	α-helix	trans	-73.4	-39.9	174.7	-173.8	169.9	-144.8	0	0	111.2	E600 R607 G608	E600-E604 VanDerWaalsContact O-CB 3.3Å; E600-E604 WeakPolarHBondContact O-CB 3.27Å; E600-E604 PolarHBondContact O-N 2.95Å; E604-R607 CarbonylContact O-C 3.56Å; E604-R607 PolarHBondContact O-N 3.06Å; E604-G608 WeakPolarHBondContact O-CA 3.36Å; E604-G608 PolarHBondContact O-N 2.8Å
605	S	69.6	Low	71.9	Confident	71 Å²	71	113.3 Å²	113.3	50%	0.497	54%	0.536	S	S	.	.	H	α-helix	trans	-59.6	-50.3	171.1	178.3	0	0	0	0	111.4	E601 G608 E609	E601-S605 WeakPolarHBondContact O-CB 3.33Å; E601-S605 PolarHBondContact O-N 2.92Å; S605-G608 WeakPolarHBondContact O-CA 3.47Å; S605-G608 PolarHBondContact O-N 2.82Å; S605-E609 PolarHBondContact O-N 2.75Å
606	T	66.7	Low	71.6	Confident	81 Å²	81	113.3 Å²	113.3	50%	0.497	54%	0.539	S	S	.	.	H	α-helix	trans	-73.6	-30.3	-179.7	53.1	0	0	0	0	112.6	K602 A603 G608 K610	K602-T606 WeakPolarHBondContact O-CB 3.41Å; K602-T606 WeakPolarHBondContact O-CG2 3.5Å; K602-T606 PolarHBondContact O-N 3.05Å; K602-T606 PolarHBondContact O-OG1 3.17Å; A603-T606 PolarHBondContact O-OG1 3.04Å; T606-G608 VanDerWaalsContact C-N 3.34Å; T606-K610 WeakPolarHBondContact O-CB 3.13Å; T606-K610 PolarHBondContact O-N 3Å
607	R	68.2	Low	71.4	Confident	188 Å²	188	113.7 Å²	113.7	71%	0.709	54%	0.542	S	S	*	.	H	α-helix	trans	-68.7	-34.8	167.9	-174.5	176.9	-169.9	165.1	2.2	111.2	A603 E604 K610 V611	A603-R607 WeakPolarHBondContact O-CA 3.42Å; A603-R607 WeakPolarHBondContact O-CB 3.19Å; A603-R607 PolarHBondContact O-N 2.99Å; E604-R607 CarbonylContact O-C 3.56Å; E604-R607 PolarHBondContact O-N 3.06Å; R607-K610 CarbonylContact O-C 3.59Å; R607-K610 PolarHBondContact O-N 2.97Å; R607-V611 HydrophobicContact CG-CG2 4.39Å; R607-V611 WeakPolarHBondContact O-CB 3.47Å; R607-V611 WeakPolarHBondContact O-CG2 3.49Å; R607-V611 PolarHBondContact O-N 2.93Å
608	G	67.7	Low	71.2	Confident	35 Å²	35	112 Å²	112	36%	0.361	54%	0.541	S	S	.	.	H	α-helix	trans	-64.2	-54.2	173.6	0	0	0	0	0	111	E604 S605 T606 K610 V611 E612	E604-G608 WeakPolarHBondContact O-CA 3.36Å; E604-G608 PolarHBondContact O-N 2.8Å; S605-G608 WeakPolarHBondContact O-CA 3.47Å; S605-G608 PolarHBondContact O-N 2.82Å; T606-G608 VanDerWaalsContact C-N 3.34Å; G608-K610 VanDerWaalsContact C-N 3.28Å; G608-K610 PolarHBondContact O-N 3.26Å; G608-V611 CarbonylContact O-C 3.6Å; G608-V611 PolarHBondContact O-N 2.92Å; G608-E612 WeakPolarHBondContact O-CB 3.45Å; G608-E612 PolarHBondContact O-N 3.48Å
609	E	71.4	Confident	71	Confident	137 Å²	137	112.4 Å²	112.4	64%	0.64	55%	0.545	S	S	*	.	H	α-helix	trans	-56.8	-40.8	172.5	-73.5	-168.9	132.4	0	0	112	S605 E612 S613	S605-E609 PolarHBondContact O-N 2.75Å; E609-E612 PolarHBondContact O-N 3.33Å; E609-S613 VanDerWaalsContact O-CB 3.31Å; E609-S613 WeakPolarHBondContact O-CB 3.38Å; E609-S613 PolarHBondContact O-N 3.07Å; E609-S613 PolarHBondContact O-OG 3.01Å
610	K	63.4	Low	70.9	Confident	141 Å²	141	110.8 Å²	110.8	61%	0.613	54%	0.542	S	S	*	.	H	α-helix	trans	-74.6	-26.6	179.1	-169	170.6	-174.7	174.2	0	113.7	T606 R607 G608 S613 K614	T606-K610 WeakPolarHBondContact O-CB 3.13Å; T606-K610 PolarHBondContact O-N 3Å; R607-K610 CarbonylContact O-C 3.59Å; R607-K610 PolarHBondContact O-N 2.97Å; G608-K610 VanDerWaalsContact C-N 3.28Å; G608-K610 PolarHBondContact O-N 3.26Å; K610-S613 PolarHBondContact O-OG 3.13Å; K610-K614 VanDerWaalsContact O-CB 3.26Å; K610-K614 WeakPolarHBondContact O-CB 3.28Å; K610-K614 WeakPolarHBondContact O-CG 3.44Å; K610-K614 PolarHBondContact O-N 3.09Å
611	V	68.7	Low	70.9	Confident	73 Å²	73	107.9 Å²	107.9	44%	0.442	53%	0.534	S	S	.	.	H	α-helix	trans	-79.7	-33.6	170.9	165.1	0	0	0	0	110.5	R607 G608 R615	R607-V611 HydrophobicContact CG-CG2 4.39Å; R607-V611 WeakPolarHBondContact O-CB 3.47Å; R607-V611 WeakPolarHBondContact O-CG2 3.49Å; R607-V611 PolarHBondContact O-N 2.93Å; G608-V611 CarbonylContact O-C 3.6Å; G608-V611 PolarHBondContact O-N 2.92Å; V611-R615 VanDerWaalsContact O-CB 3.27Å; V611-R615 WeakPolarHBondContact O-CB 3.2Å; V611-R615 WeakPolarHBondContact O-CG 3.36Å; V611-R615 PolarHBondContact O-N 3.09Å
612	E	70.2	Confident	70.9	Confident	109 Å²	109	107.5 Å²	107.5	51%	0.509	53%	0.53	S	S	.	.	H	α-helix	trans	-75.3	-35.5	174.4	-158.7	-176.3	135.3	0	0	111.5	G608 E609 R615 K616	G608-E612 WeakPolarHBondContact O-CB 3.45Å; G608-E612 PolarHBondContact O-N 3.48Å; E609-E612 PolarHBondContact O-N 3.33Å; E612-R615 PolarHBondContact O-N 2.83Å; E612-K616 WeakPolarHBondContact O-CB 3.27Å; E612-K616 WeakPolarHBondContact O-CD 3.21Å; E612-K616 VanDerWaalsContact O-CG 3.25Å; E612-K616 WeakPolarHBondContact O-CG 3.17Å; E612-K616 PolarHBondContact O-N 2.95Å; E612-K616 WeakPolarHBondContact OE1-CE 3.46Å; E612-K616 IonicContact OE1-NZ 2.84Å; E612-K616 PolarHBondContact OE1-NZ 2.79Å
613	S	71.6	Confident	71	Confident	54 Å²	54	106.1 Å²	106.1	38%	0.378	52%	0.524	S	S	.	.	H	α-helix	trans	-65.5	-46.7	170	80.2	0	0	0	0	110.4	E609 K610 R615 K616 E617	E609-S613 VanDerWaalsContact O-CB 3.31Å; E609-S613 WeakPolarHBondContact O-CB 3.38Å; E609-S613 PolarHBondContact O-N 3.07Å; E609-S613 PolarHBondContact O-OG 3.01Å; K610-S613 PolarHBondContact O-OG 3.13Å; S613-R615 VanDerWaalsContact C-N 3.35Å; S613-R615 PolarHBondContact O-N 3.39Å; S613-K616 PolarHBondContact O-N 3.17Å; S613-K616 VanDerWaalsContact O-N 3.16Å; S613-E617 PolarHBondContact O-N 3.48Å
614	K	69.8	Low	71.3	Confident	120 Å²	120	110 Å²	110	52%	0.522	53%	0.533	S	S	.	.	H	α-helix	trans	-61.5	-38.9	173.4	-86	-166.1	163.4	-149.9	0	113	K610 K616 E617 E618	K610-K614 VanDerWaalsContact O-CB 3.26Å; K610-K614 WeakPolarHBondContact O-CB 3.28Å; K610-K614 WeakPolarHBondContact O-CG 3.44Å; K610-K614 PolarHBondContact O-N 3.09Å; K614-K616 VanDerWaalsContact C-N 3.34Å; K614-E617 PolarHBondContact O-N 3.36Å; K614-E618 WeakPolarHBondContact O-CB 3.43Å; K614-E618 WeakPolarHBondContact O-CG 3.31Å; K614-E618 PolarHBondContact O-N 2.94Å
615	R	73.9	Confident	71.5	Confident	173 Å²	173	109.1 Å²	109.1	65%	0.653	53%	0.529	S	S	*	.	H	α-helix	trans	-65.2	-37.6	173.8	-87.6	-179.6	164.1	177.9	-3.2	112.1	V611 E612 S613 E619	V611-R615 VanDerWaalsContact O-CB 3.27Å; V611-R615 WeakPolarHBondContact O-CB 3.2Å; V611-R615 WeakPolarHBondContact O-CG 3.36Å; V611-R615 PolarHBondContact O-N 3.09Å; E612-R615 PolarHBondContact O-N 2.83Å; S613-R615 VanDerWaalsContact C-N 3.35Å; S613-R615 PolarHBondContact O-N 3.39Å; R615-E619 WeakPolarHBondContact O-CB 3.34Å; R615-E619 PolarHBondContact O-N 3.38Å
616	K	71.4	Confident	71.8	Confident	114 Å²	114	110.1 Å²	110.1	50%	0.496	53%	0.526	S	S	.	.	H	α-helix	trans	-67.8	-41.7	174.2	-73.7	163.5	-174	165	0	111	E612 S613 K614 E619 T620	E612-K616 WeakPolarHBondContact O-CB 3.27Å; E612-K616 WeakPolarHBondContact O-CD 3.21Å; E612-K616 VanDerWaalsContact O-CG 3.25Å; E612-K616 WeakPolarHBondContact O-CG 3.17Å; E612-K616 PolarHBondContact O-N 2.95Å; E612-K616 WeakPolarHBondContact OE1-CE 3.46Å; E612-K616 IonicContact OE1-NZ 2.84Å; E612-K616 PolarHBondContact OE1-NZ 2.79Å; S613-K616 PolarHBondContact O-N 3.17Å; S613-K616 VanDerWaalsContact O-N 3.16Å; K614-K616 VanDerWaalsContact C-N 3.34Å; K616-E619 PolarHBondContact O-N 3.48Å; K616-T620 WeakPolarHBondContact O-CG2 3.47Å; K616-T620 PolarHBondContact O-N 2.81Å; K616-T620 PolarHBondContact O-OG1 3.16Å
617	E	72.5	Confident	72.4	Confident	116 Å²	116	110.4 Å²	110.4	54%	0.542	52%	0.521	S	S	.	.	H	α-helix	trans	-59.9	-53.2	171.1	-75.2	-179.7	125.7	0	0	111.2	S613 K614 E619 T620 V621	S613-E617 PolarHBondContact O-N 3.48Å; K614-E617 PolarHBondContact O-N 3.36Å; E617-E619 VanDerWaalsContact C-N 3.32Å; E617-E619 PolarHBondContact O-N 2.6Å; E617-T620 WeakPolarHBondContact CA-OG1 3.48Å; E617-T620 CarbonylContact O-C 3.54Å; E617-T620 PolarHBondContact O-N 2.79Å; E617-T620 VanDerWaalsContact O-N 3.11Å; E617-T620 PolarHBondContact O-OG1 2.9Å; E617-V621 WeakPolarHBondContact O-CB 3.45Å; E617-V621 WeakPolarHBondContact O-CG2 3.25Å; E617-V621 PolarHBondContact O-N 3.05Å
618	E	72.1	Confident	72.8	Confident	128 Å²	128	104.8 Å²	104.8	60%	0.598	51%	0.508	S	S	*	.	H	α-helix	trans	-58.6	-38.1	176.1	-76.2	176.9	165.3	0	0	112.4	K614 K622	K614-E618 WeakPolarHBondContact O-CB 3.43Å; K614-E618 WeakPolarHBondContact O-CG 3.31Å; K614-E618 PolarHBondContact O-N 2.94Å; E618-K622 WeakPolarHBondContact O-CB 3.35Å; E618-K622 PolarHBondContact O-N 2.74Å
619	E	73.4	Confident	73.2	Confident	107 Å²	107	107.8 Å²	107.8	50%	0.5	51%	0.512	S	S	.	.	H	α-helix	trans	-71.6	-34.4	175.9	-161.9	-168.5	154.2	0	0	111.7	R615 K616 E617 K623	R615-E619 WeakPolarHBondContact O-CB 3.34Å; R615-E619 PolarHBondContact O-N 3.38Å; K616-E619 PolarHBondContact O-N 3.48Å; E617-E619 VanDerWaalsContact C-N 3.32Å; E617-E619 PolarHBondContact O-N 2.6Å; E619-K623 WeakPolarHBondContact O-CB 3.23Å; E619-K623 WeakPolarHBondContact O-CD 3.38Å; E619-K623 WeakPolarHBondContact O-CG 3.39Å; E619-K623 PolarHBondContact O-N 3.48Å; E619-K623 VanDerWaalsContact OE1-CE 3.28Å; E619-K623 WeakPolarHBondContact OE1-CE 3.48Å; E619-K623 IonicContact OE1-NZ 3.55Å; E619-K623 PolarHBondContact OE1-NZ 2.75Å
620	T	72.2	Confident	73.6	Confident	76 Å²	76	107.7 Å²	107.7	47%	0.466	51%	0.506	S	S	.	.	H	α-helix	trans	-70.7	-46.9	171.5	48.4	0	0	0	0	112.2	K616 E617 K622 K623 E624	K616-T620 WeakPolarHBondContact O-CG2 3.47Å; K616-T620 PolarHBondContact O-N 2.81Å; K616-T620 PolarHBondContact O-OG1 3.16Å; E617-T620 WeakPolarHBondContact CA-OG1 3.48Å; E617-T620 CarbonylContact O-C 3.54Å; E617-T620 PolarHBondContact O-N 2.79Å; E617-T620 VanDerWaalsContact O-N 3.11Å; E617-T620 PolarHBondContact O-OG1 2.9Å; T620-K622 VanDerWaalsContact C-N 3.32Å; T620-K622 PolarHBondContact O-N 3.44Å; T620-K623 PolarHBondContact O-N 3.16Å; T620-K623 VanDerWaalsContact O-N 3.1Å; T620-E624 WeakPolarHBondContact O-CG 2.95Å; T620-E624 PolarHBondContact O-N 3.44Å
621	V	74.2	Confident	74.3	Confident	74 Å²	74	106.2 Å²	106.2	45%	0.448	50%	0.5	S	S	.	.	H	α-helix	trans	-59.5	-44.4	175.8	170.1	0	0	0	0	109.8	E617 K623 E624 E625	E617-V621 WeakPolarHBondContact O-CB 3.45Å; E617-V621 WeakPolarHBondContact O-CG2 3.25Å; E617-V621 PolarHBondContact O-N 3.05Å; V621-K623 PolarHBondContact O-N 2.82Å; V621-E624 CarbonylContact O-C 3.59Å; V621-E624 PolarHBondContact O-N 3.4Å; V621-E625 HydrophobicContact CG1-CG 4.4Å; V621-E625 WeakPolarHBondContact O-CB 3.19Å; V621-E625 WeakPolarHBondContact O-CG 3.33Å; V621-E625 PolarHBondContact O-N 3.44Å
622	K	75.2	Confident	74.7	Confident	123 Å²	123	110.8 Å²	110.8	54%	0.535	51%	0.509	S	S	.	.	H	α-helix	trans	-64.8	-35.8	175.6	-177.5	171.1	175	177.4	0	112.8	E618 T620 E625 E626	E618-K622 WeakPolarHBondContact O-CB 3.35Å; E618-K622 PolarHBondContact O-N 2.74Å; T620-K622 VanDerWaalsContact C-N 3.32Å; T620-K622 PolarHBondContact O-N 3.44Å; K622-E625 PolarHBondContact O-N 2.86Å; K622-E626 WeakPolarHBondContact CE-OE1 3.46Å; K622-E626 HydrophobicContact CG-CG 4.45Å; K622-E626 IonicContact NZ-OE1 2.65Å; K622-E626 VanDerWaalsContact O-CB 3.32Å; K622-E626 WeakPolarHBondContact O-CB 3.32Å; K622-E626 WeakPolarHBondContact O-CG 3.32Å; K622-E626 PolarHBondContact O-N 2.73Å
623	K	76	Confident	75	Confident	109 Å²	109	109.8 Å²	109.8	47%	0.474	50%	0.503	S	S	.	.	H	α-helix	trans	-68.2	-37.6	173.1	-78.2	166.8	-174.4	165	0	112.1	E619 T620 V621 E627	E619-K623 WeakPolarHBondContact O-CB 3.23Å; E619-K623 WeakPolarHBondContact O-CD 3.38Å; E619-K623 WeakPolarHBondContact O-CG 3.39Å; E619-K623 PolarHBondContact O-N 3.48Å; E619-K623 VanDerWaalsContact OE1-CE 3.28Å; E619-K623 WeakPolarHBondContact OE1-CE 3.48Å; E619-K623 IonicContact OE1-NZ 3.55Å; E619-K623 PolarHBondContact OE1-NZ 2.75Å; T620-K623 PolarHBondContact O-N 3.16Å; T620-K623 VanDerWaalsContact O-N 3.1Å; V621-K623 PolarHBondContact O-N 2.82Å; K623-E627 WeakPolarHBondContact O-CB 3.02Å; K623-E627 PolarHBondContact O-N 3.41Å
624	E	77.6	Confident	75.2	Confident	134 Å²	134	113.8 Å²	113.8	63%	0.626	52%	0.516	S	S	*	.	H	α-helix	trans	-67.9	-41.6	173.4	-71.8	-176	170	0	0	111.3	T620 V621 E627 V628	T620-E624 WeakPolarHBondContact O-CG 2.95Å; T620-E624 PolarHBondContact O-N 3.44Å; V621-E624 CarbonylContact O-C 3.59Å; V621-E624 PolarHBondContact O-N 3.4Å; E624-E627 CarbonylContact O-C 3.51Å; E624-E627 PolarHBondContact O-N 2.79Å; E624-V628 WeakPolarHBondContact O-CB 3.37Å; E624-V628 VanDerWaalsContact O-CG2 3.28Å; E624-V628 WeakPolarHBondContact O-CG2 3.02Å; E624-V628 PolarHBondContact O-N 2.76Å
625	E	75.8	Confident	75.4	Confident	128 Å²	128	114.2 Å²	114.2	60%	0.598	52%	0.52	S	S	*	.	H	α-helix	trans	-63.4	-45.6	172	-75	-169.5	135.9	0	0	111.8	V621 K622 E627 V628 E629	V621-E625 HydrophobicContact CG1-CG 4.4Å; V621-E625 WeakPolarHBondContact O-CB 3.19Å; V621-E625 WeakPolarHBondContact O-CG 3.33Å; V621-E625 PolarHBondContact O-N 3.44Å; K622-E625 PolarHBondContact O-N 2.86Å; E625-E627 PolarHBondContact O-N 3.21Å; E625-V628 PolarHBondContact O-N 3.49Å; E625-E629 VanDerWaalsContact O-CB 3.25Å; E625-E629 WeakPolarHBondContact O-CB 3.19Å; E625-E629 PolarHBondContact O-N 3.02Å
626	E	77	Confident	75.3	Confident	93 Å²	93	112.5 Å²	112.5	44%	0.435	52%	0.519	S	S	.	.	H	α-helix	trans	-65.5	-23.9	174.4	-77.7	-178.3	-166.5	0	0	112.5	K622 R630	K622-E626 WeakPolarHBondContact CE-OE1 3.46Å; K622-E626 HydrophobicContact CG-CG 4.45Å; K622-E626 IonicContact NZ-OE1 2.65Å; K622-E626 VanDerWaalsContact O-CB 3.32Å; K622-E626 WeakPolarHBondContact O-CB 3.32Å; K622-E626 WeakPolarHBondContact O-CG 3.32Å; K622-E626 PolarHBondContact O-N 2.73Å; E626-R630 WeakPolarHBondContact O-CB 3.42Å; E626-R630 WeakPolarHBondContact O-CG 3.21Å; E626-R630 PolarHBondContact O-N 3.33Å; E626-R630 PolarHBondContact O-NE 3.12Å
627	E	78.1	Confident	75.4	Confident	86 Å²	86	113.9 Å²	113.9	40%	0.402	53%	0.525	S	S	.	.	H	α-helix	trans	-82.5	-40	171.7	-168.1	171.5	129.7	0	0	112.5	K623 E624 E625 E629 R630 K631	K623-E627 WeakPolarHBondContact O-CB 3.02Å; K623-E627 PolarHBondContact O-N 3.41Å; E624-E627 CarbonylContact O-C 3.51Å; E624-E627 PolarHBondContact O-N 2.79Å; E625-E627 PolarHBondContact O-N 3.21Å; E627-E629 VanDerWaalsContact C-N 3.34Å; E627-R630 PolarHBondContact O-N 3.33Å; E627-K631 HydrophobicContact CG-CD 4.35Å; E627-K631 WeakPolarHBondContact O-CB 3.15Å; E627-K631 VanDerWaalsContact O-CG 3.3Å; E627-K631 WeakPolarHBondContact O-CG 3.4Å; E627-K631 PolarHBondContact O-N 2.99Å; E627-K631 VanDerWaalsContact OE1-CE 3.26Å; E627-K631 WeakPolarHBondContact OE1-CE 3.09Å; E627-K631 IonicContact OE1-NZ 3.67Å; E627-K631 PolarHBondContact OE1-NZ 3.09Å
628	V	77.6	Confident	75.3	Confident	70 Å²	70	111 Å²	111	42%	0.424	52%	0.521	S	S	.	.	H	α-helix	trans	-65.5	-38.5	173.2	167.1	0	0	0	0	110.6	E624 E625 K631 R632	E624-V628 WeakPolarHBondContact O-CB 3.37Å; E624-V628 VanDerWaalsContact O-CG2 3.28Å; E624-V628 WeakPolarHBondContact O-CG2 3.02Å; E624-V628 PolarHBondContact O-N 2.76Å; E625-V628 PolarHBondContact O-N 3.49Å; V628-K631 PolarHBondContact O-N 3.27Å; V628-R632 WeakPolarHBondContact O-CB 3.21Å; V628-R632 WeakPolarHBondContact O-CG 3.4Å; V628-R632 PolarHBondContact O-N 2.79Å
629	E	75.6	Confident	75.1	Confident	98 Å²	98	111.3 Å²	111.3	46%	0.458	52%	0.522	S	S	.	.	H	α-helix	trans	-72.8	-35.1	175.7	-153.6	-155.3	-172.3	0	0	111.6	E625 E627 K633	E625-E629 VanDerWaalsContact O-CB 3.25Å; E625-E629 WeakPolarHBondContact O-CB 3.19Å; E625-E629 PolarHBondContact O-N 3.02Å; E627-E629 VanDerWaalsContact C-N 3.34Å; E629-K633 VanDerWaalsContact CD-CE 3.44Å; E629-K633 HydrophobicContact CG-CD 4.36Å; E629-K633 WeakPolarHBondContact O-CB 3.45Å; E629-K633 VanDerWaalsContact O-CG 3.26Å; E629-K633 WeakPolarHBondContact O-CG 3.32Å; E629-K633 PolarHBondContact O-N 2.81Å; E629-K633 WeakPolarHBondContact OE1-CE 3.33Å; E629-K633 IonicContact OE1-NZ 2.67Å; E629-K633 PolarHBondContact OE1-NZ 2.89Å; E629-K633 IonicContact OE2-NZ 2.66Å; E629-K633 PolarHBondContact OE2-NZ 3.41Å
630	R	79.1	Confident	74.6	Confident	136 Å²	136	108.2 Å²	108.2	51%	0.513	52%	0.519	S	S	.	.	H	α-helix	trans	-61.6	-48.2	167.5	-88.6	176.6	-71.6	141.2	-0	111.6	E626 E627 R632 K633 E634	E626-R630 WeakPolarHBondContact O-CB 3.42Å; E626-R630 WeakPolarHBondContact O-CG 3.21Å; E626-R630 PolarHBondContact O-N 3.33Å; E626-R630 PolarHBondContact O-NE 3.12Å; E627-R630 PolarHBondContact O-N 3.33Å; R630-R632 PolarHBondContact O-N 2.82Å; R630-K633 CarbonylContact O-C 3.57Å; R630-K633 PolarHBondContact O-N 2.82Å; R630-K633 VanDerWaalsContact O-N 3.14Å; R630-E634 WeakPolarHBondContact O-CG 3.26Å; R630-E634 PolarHBondContact O-N 2.95Å
631	K	78.8	Confident	74.3	Confident	110 Å²	110	108.6 Å²	108.6	48%	0.478	52%	0.522	S	S	.	.	H	α-helix	trans	-60.1	-44.4	176.6	-74.8	168	-174.3	164.2	0	111.3	E627 V628 K633 E634 E635	E627-K631 HydrophobicContact CG-CD 4.35Å; E627-K631 WeakPolarHBondContact O-CB 3.15Å; E627-K631 VanDerWaalsContact O-CG 3.3Å; E627-K631 WeakPolarHBondContact O-CG 3.4Å; E627-K631 PolarHBondContact O-N 2.99Å; E627-K631 VanDerWaalsContact OE1-CE 3.26Å; E627-K631 WeakPolarHBondContact OE1-CE 3.09Å; E627-K631 IonicContact OE1-NZ 3.67Å; E627-K631 PolarHBondContact OE1-NZ 3.09Å; V628-K631 PolarHBondContact O-N 3.27Å; K631-K633 PolarHBondContact O-N 2.76Å; K631-E634 PolarHBondContact O-N 2.9Å; K631-E635 VanDerWaalsContact O-CB 3.24Å; K631-E635 WeakPolarHBondContact O-CB 3.38Å; K631-E635 PolarHBondContact O-N 3.12Å
632	R	77	Confident	73.9	Confident	169 Å²	169	113.6 Å²	113.6	64%	0.638	53%	0.533	S	S	*	.	H	α-helix	trans	-59.3	-43.5	172	-78.3	176.3	174.2	169.1	0	112.3	V628 R630 E634 E635 E636	V628-R632 WeakPolarHBondContact O-CB 3.21Å; V628-R632 WeakPolarHBondContact O-CG 3.4Å; V628-R632 PolarHBondContact O-N 2.79Å; R630-R632 PolarHBondContact O-N 2.82Å; R632-E634 VanDerWaalsContact C-N 3.33Å; R632-E634 PolarHBondContact O-N 2.95Å; R632-E635 PolarHBondContact O-N 3.45Å; R632-E636 WeakPolarHBondContact O-CB 3.33Å; R632-E636 PolarHBondContact O-N 3.14Å
633	K	75.9	Confident	73.2	Confident	87 Å²	87	109.4 Å²	109.4	38%	0.378	52%	0.524	S	S	.	.	H	α-helix	trans	-72.4	-22.1	177.6	-73.7	168.1	-178.3	167.5	0	113.6	E629 R630 K631 K637	E629-K633 VanDerWaalsContact CD-CE 3.44Å; E629-K633 HydrophobicContact CG-CD 4.36Å; E629-K633 WeakPolarHBondContact O-CB 3.45Å; E629-K633 VanDerWaalsContact O-CG 3.26Å; E629-K633 WeakPolarHBondContact O-CG 3.32Å; E629-K633 PolarHBondContact O-N 2.81Å; E629-K633 WeakPolarHBondContact OE1-CE 3.33Å; E629-K633 IonicContact OE1-NZ 2.67Å; E629-K633 PolarHBondContact OE1-NZ 2.89Å; E629-K633 IonicContact OE2-NZ 2.66Å; E629-K633 PolarHBondContact OE2-NZ 3.41Å; R630-K633 CarbonylContact O-C 3.57Å; R630-K633 PolarHBondContact O-N 2.82Å; R630-K633 VanDerWaalsContact O-N 3.14Å; K631-K633 PolarHBondContact O-N 2.76Å; K633-K637 WeakPolarHBondContact O-CD 3.45Å; K633-K637 WeakPolarHBondContact O-CG 3.47Å; K633-K637 PolarHBondContact O-N 2.89Å
634	E	76.7	Confident	72.7	Confident	138 Å²	138	110.9 Å²	110.9	65%	0.645	53%	0.532	S	S	*	.	H	α-helix	trans	-81.3	-40	169.3	-73.5	-172.3	148.8	0	0	111.5	R630 K631 R632 K637 A638	R630-E634 WeakPolarHBondContact O-CG 3.26Å; R630-E634 PolarHBondContact O-N 2.95Å; K631-E634 PolarHBondContact O-N 2.9Å; R632-E634 VanDerWaalsContact C-N 3.33Å; R632-E634 PolarHBondContact O-N 2.95Å; E634-K637 PolarHBondContact O-N 3.22Å; E634-A638 WeakPolarHBondContact O-CB 3.23Å; E634-A638 PolarHBondContact O-N 2.59Å
635	E	74.3	Confident	72.1	Confident	130 Å²	130	111.6 Å²	111.6	61%	0.607	53%	0.533	S	S	*	.	H	α-helix	trans	-67.5	-40.8	175.4	-171.2	162.3	-136.7	0	0	111.5	K631 R632 K637 A638 E639	K631-E635 VanDerWaalsContact O-CB 3.24Å; K631-E635 WeakPolarHBondContact O-CB 3.38Å; K631-E635 PolarHBondContact O-N 3.12Å; R632-E635 PolarHBondContact O-N 3.45Å; E635-K637 VanDerWaalsContact C-N 3.33Å; E635-K637 PolarHBondContact O-N 3.46Å; E635-A638 CarbonylContact O-C 3.43Å; E635-A638 WeakPolarHBondContact O-CA 3.47Å; E635-A638 WeakPolarHBondContact O-CB 3.13Å; E635-A638 PolarHBondContact O-N 2.7Å; E635-A638 VanDerWaalsContact O-N 3.12Å; E635-E639 WeakPolarHBondContact O-CB 3.46Å; E635-E639 WeakPolarHBondContact O-CG 3.36Å; E635-E639 PolarHBondContact O-N 2.95Å
636	E	71.8	Confident	71.7	Confident	136 Å²	136	109.4 Å²	109.4	64%	0.636	53%	0.529	S	S	*	.	H	α-helix	trans	-63.5	-35.2	171.7	-177.2	-177.1	-157.6	0	0	111.8	R632 G640	R632-E636 WeakPolarHBondContact O-CB 3.33Å; R632-E636 PolarHBondContact O-N 3.14Å; E636-G640 WeakPolarHBondContact O-CA 3.37Å; E636-G640 PolarHBondContact O-N 2.92Å
637	K	72.3	Confident	71.2	Confident	144 Å²	144	109.9 Å²	109.9	63%	0.626	53%	0.531	S	S	*	.	H	α-helix	trans	-73.3	-33.5	171.2	-74.5	169.2	-168.8	169.4	0	112.3	K633 E634 E635 T641	K633-K637 WeakPolarHBondContact O-CD 3.45Å; K633-K637 WeakPolarHBondContact O-CG 3.47Å; K633-K637 PolarHBondContact O-N 2.89Å; E634-K637 PolarHBondContact O-N 3.22Å; E635-K637 VanDerWaalsContact C-N 3.33Å; E635-K637 PolarHBondContact O-N 3.46Å; K637-T641 WeakPolarHBondContact O-CB 3.1Å; K637-T641 WeakPolarHBondContact O-CG2 3.38Å; K637-T641 PolarHBondContact O-N 3.36Å; K637-T641 PolarHBondContact O-OG1 3.16Å
638	A	71	Confident	70.8	Confident	54 Å²	54	108.8 Å²	108.8	45%	0.446	53%	0.533	S	S	.	.	H	α-helix	trans	-69.6	-41.5	174	0	0	0	0	0	111	E634 E635 T641 R642	E634-A638 WeakPolarHBondContact O-CB 3.23Å; E634-A638 PolarHBondContact O-N 2.59Å; E635-A638 CarbonylContact O-C 3.43Å; E635-A638 WeakPolarHBondContact O-CA 3.47Å; E635-A638 WeakPolarHBondContact O-CB 3.13Å; E635-A638 PolarHBondContact O-N 2.7Å; E635-A638 VanDerWaalsContact O-N 3.12Å; A638-T641 PolarHBondContact O-OG1 3.04Å; A638-R642 WeakPolarHBondContact O-CB 3.48Å; A638-R642 PolarHBondContact O-N 3.43Å
639	E	68.1	Low	70.4	Confident	135 Å²	135	111.7 Å²	111.7	63%	0.631	54%	0.54	S	S	*	.	H	α-helix	trans	-67.3	-39.9	171.2	-73.2	-132	113.5	0	0	111.7	E635 R642 G643	E635-E639 WeakPolarHBondContact O-CB 3.46Å; E635-E639 WeakPolarHBondContact O-CG 3.36Å; E635-E639 PolarHBondContact O-N 2.95Å; E639-R642 CarbonylContact O-C 3.58Å; E639-R642 PolarHBondContact O-N 3.37Å; E639-G643 WeakPolarHBondContact O-CA 3.04Å; E639-G643 PolarHBondContact O-N 3.35Å
640	G	63.2	Low	70.2	Confident	43 Å²	43	115.9 Å²	115.9	44%	0.443	55%	0.551	S	S	.	*	H	α-helix	trans	-61.3	-51.5	175	0	0	0	0	0	112	E636 R642 G643 E644	E636-G640 WeakPolarHBondContact O-CA 3.37Å; E636-G640 PolarHBondContact O-N 2.92Å; G640-R642 PolarHBondContact O-N 3.06Å; G640-G643 PolarHBondContact O-N 2.87Å; G640-E644 WeakPolarHBondContact O-CB 3.05Å; G640-E644 PolarHBondContact O-N 2.75Å
641	T	65.2	Low	69.6	Low	84 Å²	84	114.8 Å²	114.8	52%	0.515	55%	0.55	S	S	.	*	H	α-helix	trans	-69.7	-30.6	176.5	53.1	0	0	0	0	113.1	K637 A638 K645	K637-T641 WeakPolarHBondContact O-CB 3.1Å; K637-T641 WeakPolarHBondContact O-CG2 3.38Å; K637-T641 PolarHBondContact O-N 3.36Å; K637-T641 PolarHBondContact O-OG1 3.16Å; A638-T641 PolarHBondContact O-OG1 3.04Å; T641-K645 WeakPolarHBondContact O-CB 3.28Å; T641-K645 PolarHBondContact O-N 3.1Å
642	R	65.6	Low	69.3	Low	179 Å²	179	115.2 Å²	115.2	68%	0.675	55%	0.554	S	S	*	*	H	α-helix	trans	-70.9	-36.3	171.4	-173.1	178.8	-166	169.4	2.7	111.6	A638 E639 G640 K645 V646	A638-R642 WeakPolarHBondContact O-CB 3.48Å; A638-R642 PolarHBondContact O-N 3.43Å; E639-R642 CarbonylContact O-C 3.58Å; E639-R642 PolarHBondContact O-N 3.37Å; G640-R642 PolarHBondContact O-N 3.06Å; R642-K645 CarbonylContact O-C 3.54Å; R642-K645 PolarHBondContact O-N 3.42Å; R642-V646 WeakPolarHBondContact O-CB 3.43Å; R642-V646 VanDerWaalsContact O-CG2 3.23Å; R642-V646 WeakPolarHBondContact O-CG2 3.4Å; R642-V646 PolarHBondContact O-N 3.35Å
643	G	60.5	Low	69	Low	34 Å²	34	112.4 Å²	112.4	35%	0.351	55%	0.548	S	S	.	.	H	α-helix	trans	-66.6	-49.2	174.7	0	0	0	0	0	110.9	E639 G640 K645 V646 E647	E639-G643 WeakPolarHBondContact O-CA 3.04Å; E639-G643 PolarHBondContact O-N 3.35Å; G640-G643 PolarHBondContact O-N 2.87Å; G643-K645 VanDerWaalsContact C-N 3.28Å; G643-K645 PolarHBondContact O-N 3.11Å; G643-V646 CarbonylContact O-C 3.53Å; G643-V646 PolarHBondContact O-N 3.42Å; G643-E647 WeakPolarHBondContact O-CB 3.48Å; G643-E647 PolarHBondContact O-N 2.81Å
644	E	66.3	Low	68.8	Low	140 Å²	140	112.9 Å²	112.9	65%	0.654	55%	0.552	S	S	*	*	H	α-helix	trans	-59.2	-39	173.1	-167.5	176.4	-140.8	0	0	111.4	G640 E647 S648	G640-E644 WeakPolarHBondContact O-CB 3.05Å; G640-E644 PolarHBondContact O-N 2.75Å; E644-E647 PolarHBondContact O-N 2.84Å; E644-S648 VanDerWaalsContact O-CB 3.31Å; E644-S648 WeakPolarHBondContact O-CB 3.4Å; E644-S648 PolarHBondContact O-N 3.35Å; E644-S648 PolarHBondContact O-OG 3.01Å
645	K	63.8	Low	68.4	Low	149 Å²	149	110 Å²	110	65%	0.648	54%	0.544	S	S	*	.	H	α-helix	trans	-73.9	-24.4	174.6	-168.1	168.9	-171.8	170	0	114.3	T641 R642 G643 S648 K649	T641-K645 WeakPolarHBondContact O-CB 3.28Å; T641-K645 PolarHBondContact O-N 3.1Å; R642-K645 CarbonylContact O-C 3.54Å; R642-K645 PolarHBondContact O-N 3.42Å; G643-K645 VanDerWaalsContact C-N 3.28Å; G643-K645 PolarHBondContact O-N 3.11Å; K645-S648 WeakPolarHBondContact CA-OG 3.27Å; K645-S648 PolarHBondContact O-OG 2.8Å; K645-K649 WeakPolarHBondContact O-CB 3.35Å; K645-K649 WeakPolarHBondContact O-CG 3.49Å; K645-K649 PolarHBondContact O-N 2.89Å
646	V	67.7	Low	68.4	Low	83 Å²	83	107.2 Å²	107.2	50%	0.503	54%	0.535	S	S	.	.	H	α-helix	trans	-80.5	-37.4	170.8	162.4	0	0	0	0	110.3	R642 G643 K649 R650	R642-V646 WeakPolarHBondContact O-CB 3.43Å; R642-V646 VanDerWaalsContact O-CG2 3.23Å; R642-V646 WeakPolarHBondContact O-CG2 3.4Å; R642-V646 PolarHBondContact O-N 3.35Å; G643-V646 CarbonylContact O-C 3.53Å; G643-V646 PolarHBondContact O-N 3.42Å; V646-K649 CarbonylContact O-C 3.53Å; V646-K649 PolarHBondContact O-N 3.15Å; V646-R650 WeakPolarHBondContact O-CB 3.46Å; V646-R650 PolarHBondContact O-N 3.37Å
647	E	67.1	Low	68.4	Low	103 Å²	103	106 Å²	106	48%	0.481	53%	0.528	S	S	.	.	H	α-helix	trans	-73.9	-38.4	178.6	-162.5	-173.6	142.9	0	0	111.4	G643 E644 R650 K651	G643-E647 WeakPolarHBondContact O-CB 3.48Å; G643-E647 PolarHBondContact O-N 2.81Å; E644-E647 PolarHBondContact O-N 2.84Å; E647-R650 PolarHBondContact O-N 2.75Å; E647-K651 WeakPolarHBondContact O-CB 3.33Å; E647-K651 WeakPolarHBondContact O-CG 3.35Å; E647-K651 PolarHBondContact O-N 2.96Å; E647-K651 WeakPolarHBondContact OE1-CE 3.35Å; E647-K651 IonicContact OE1-NZ 2.86Å; E647-K651 PolarHBondContact OE1-NZ 2.72Å
648	S	68.9	Low	68.3	Low	63 Å²	63	104.5 Å²	104.5	44%	0.441	52%	0.521	S	S	.	.	H	α-helix	trans	-61	-45.4	169.6	70.4	0	0	0	0	110.6	E644 K645 R650 K651 E652	E644-S648 VanDerWaalsContact O-CB 3.31Å; E644-S648 WeakPolarHBondContact O-CB 3.4Å; E644-S648 PolarHBondContact O-N 3.35Å; E644-S648 PolarHBondContact O-OG 3.01Å; K645-S648 WeakPolarHBondContact CA-OG 3.27Å; K645-S648 PolarHBondContact O-OG 2.8Å; S648-R650 VanDerWaalsContact C-N 3.32Å; S648-R650 PolarHBondContact O-N 2.76Å; S648-K651 PolarHBondContact O-N 2.72Å; S648-E652 VanDerWaalsContact O-CB 3.27Å; S648-E652 WeakPolarHBondContact O-CB 3.47Å; S648-E652 PolarHBondContact O-N 3.48Å
649	K	70.2	Confident	68.4	Low	130 Å²	130	108.5 Å²	108.5	57%	0.565	53%	0.531	S	S	*	.	H	α-helix	trans	-62.3	-34.7	171.7	-87.7	-164.9	164.9	-153.2	0	113.6	K645 V646 E652 E653	K645-K649 WeakPolarHBondContact O-CB 3.35Å; K645-K649 WeakPolarHBondContact O-CG 3.49Å; K645-K649 PolarHBondContact O-N 2.89Å; V646-K649 CarbonylContact O-C 3.53Å; V646-K649 PolarHBondContact O-N 3.15Å; K649-E652 PolarHBondContact O-N 2.84Å; K649-E653 WeakPolarHBondContact O-CB 3.33Å; K649-E653 PolarHBondContact O-N 3.22Å
650	R	71.6	Confident	68.8	Low	186 Å²	186	107.6 Å²	107.6	70%	0.702	53%	0.527	S	S	*	.	H	α-helix	trans	-68.6	-41.9	176.4	-121.6	177.6	178.1	177.6	-1.2	111.2	V646 E647 S648 E654	V646-R650 WeakPolarHBondContact O-CB 3.46Å; V646-R650 PolarHBondContact O-N 3.37Å; E647-R650 PolarHBondContact O-N 2.75Å; S648-R650 VanDerWaalsContact C-N 3.32Å; S648-R650 PolarHBondContact O-N 2.76Å; R650-E654 VanDerWaalsContact O-CB 3.25Å; R650-E654 WeakPolarHBondContact O-CB 3.28Å; R650-E654 PolarHBondContact O-N 2.99Å
651	K	66.6	Low	69.3	Low	114 Å²	114	109.5 Å²	109.5	50%	0.496	52%	0.524	S	S	.	.	H	α-helix	trans	-65.7	-40.3	173.7	-72.2	167.9	-175.8	166.1	0	111.1	E647 S648 E654 T655	E647-K651 WeakPolarHBondContact O-CB 3.33Å; E647-K651 WeakPolarHBondContact O-CG 3.35Å; E647-K651 PolarHBondContact O-N 2.96Å; E647-K651 WeakPolarHBondContact OE1-CE 3.35Å; E647-K651 IonicContact OE1-NZ 2.86Å; E647-K651 PolarHBondContact OE1-NZ 2.72Å; S648-K651 PolarHBondContact O-N 2.72Å; K651-E654 PolarHBondContact O-N 2.87Å; K651-T655 PolarHBondContact O-N 3.29Å; K651-T655 PolarHBondContact O-OG1 2.88Å
652	E	70.6	Confident	69.7	Low	119 Å²	119	109.6 Å²	109.6	56%	0.556	52%	0.524	S	S	*	.	H	α-helix	trans	-62.9	-48.9	174.4	-168	171.2	-131.4	0	0	111.3	S648 K649 E654 T655 V656	S648-E652 VanDerWaalsContact O-CB 3.27Å; S648-E652 WeakPolarHBondContact O-CB 3.47Å; S648-E652 PolarHBondContact O-N 3.48Å; K649-E652 PolarHBondContact O-N 2.84Å; E652-E654 VanDerWaalsContact C-N 3.32Å; E652-E654 PolarHBondContact O-N 3.12Å; E652-T655 WeakPolarHBondContact CA-OG1 3.37Å; E652-T655 PolarHBondContact O-N 3.09Å; E652-T655 PolarHBondContact O-OG1 2.99Å; E652-V656 WeakPolarHBondContact O-CG2 3.32Å; E652-V656 PolarHBondContact O-N 2.81Å
653	E	72	Confident	70.1	Confident	109 Å²	109	106 Å²	106	51%	0.509	52%	0.515	S	S	.	.	H	α-helix	trans	-60.2	-37.3	170.5	-88	-165.6	-153.9	0	0	113.1	K649 V656 K657	K649-E653 WeakPolarHBondContact O-CB 3.33Å; K649-E653 PolarHBondContact O-N 3.22Å; E653-V656 PolarHBondContact O-N 2.84Å; E653-K657 VanDerWaalsContact O-CB 3.3Å; E653-K657 WeakPolarHBondContact O-CB 3.25Å; E653-K657 WeakPolarHBondContact O-CD 3.35Å; E653-K657 VanDerWaalsContact O-CG 3.24Å; E653-K657 WeakPolarHBondContact O-CG 3.2Å; E653-K657 PolarHBondContact O-N 3.05Å; E653-K657 IonicContact OE2-NZ 2.6Å; E653-K657 PolarHBondContact OE2-NZ 3.22Å
654	E	71.3	Confident	70.7	Confident	98 Å²	98	111.2 Å²	111.2	46%	0.458	52%	0.524	S	S	.	.	H	α-helix	trans	-71.8	-36.5	178.6	-163.7	-169.4	154.1	0	0	111.2	R650 K651 E652 K658	R650-E654 VanDerWaalsContact O-CB 3.25Å; R650-E654 WeakPolarHBondContact O-CB 3.28Å; R650-E654 PolarHBondContact O-N 2.99Å; K651-E654 PolarHBondContact O-N 2.87Å; E652-E654 VanDerWaalsContact C-N 3.32Å; E652-E654 PolarHBondContact O-N 3.12Å; E654-K658 HydrophobicContact CG-CD 4.5Å; E654-K658 WeakPolarHBondContact O-CB 3.44Å; E654-K658 VanDerWaalsContact O-CG 3.25Å; E654-K658 WeakPolarHBondContact O-CG 3.26Å; E654-K658 PolarHBondContact O-N 2.8Å; E654-K658 WeakPolarHBondContact OE1-CE 3.25Å; E654-K658 IonicContact OE1-NZ 2.89Å; E654-K658 PolarHBondContact OE1-NZ 3.33Å
655	T	67.8	Low	71.1	Confident	77 Å²	77	110 Å²	110	47%	0.472	52%	0.517	S	S	.	.	H	α-helix	trans	-65.4	-44.4	169.9	44	0	0	0	0	111.4	K651 E652 K657 K658 E659	K651-T655 PolarHBondContact O-N 3.29Å; K651-T655 PolarHBondContact O-OG1 2.88Å; E652-T655 WeakPolarHBondContact CA-OG1 3.37Å; E652-T655 PolarHBondContact O-N 3.09Å; E652-T655 PolarHBondContact O-OG1 2.99Å; T655-K657 PolarHBondContact O-N 2.86Å; T655-K658 CarbonylContact O-C 3.53Å; T655-K658 PolarHBondContact O-N 2.58Å; T655-E659 WeakPolarHBondContact O-CG 3.24Å; T655-E659 PolarHBondContact O-N 3.33Å
656	V	74.6	Confident	71.7	Confident	71 Å²	71	111.5 Å²	111.5	43%	0.43	52%	0.518	S	S	.	.	H	α-helix	trans	-61.5	-44.4	175.1	170.5	0	0	0	0	110.9	E652 E653 K658 E659 E660	E652-V656 WeakPolarHBondContact O-CG2 3.32Å; E652-V656 PolarHBondContact O-N 2.81Å; E653-V656 PolarHBondContact O-N 2.84Å; V656-K658 VanDerWaalsContact C-N 3.31Å; V656-K658 PolarHBondContact O-N 2.92Å; V656-E659 PolarHBondContact O-N 2.93Å; V656-E660 HydrophobicContact CG1-CG 4.39Å; V656-E660 WeakPolarHBondContact O-CB 3.41Å; V656-E660 WeakPolarHBondContact O-CG 3.42Å; V656-E660 PolarHBondContact O-N 2.82Å
657	K	72.3	Confident	72	Confident	110 Å²	110	112.6 Å²	112.6	48%	0.478	52%	0.516	S	S	.	.	H	α-helix	trans	-63.7	-34.1	176	-77.2	161.4	-179.2	156.5	0	112.6	E653 T655 E661	E653-K657 VanDerWaalsContact O-CB 3.3Å; E653-K657 WeakPolarHBondContact O-CB 3.25Å; E653-K657 WeakPolarHBondContact O-CD 3.35Å; E653-K657 VanDerWaalsContact O-CG 3.24Å; E653-K657 WeakPolarHBondContact O-CG 3.2Å; E653-K657 PolarHBondContact O-N 3.05Å; E653-K657 IonicContact OE2-NZ 2.6Å; E653-K657 PolarHBondContact OE2-NZ 3.22Å; T655-K657 PolarHBondContact O-N 2.86Å; K657-E661 WeakPolarHBondContact O-CB 3.46Å; K657-E661 PolarHBondContact O-N 2.83Å
658	K	70.4	Confident	72.3	Confident	114 Å²	114	114.1 Å²	114.1	50%	0.496	52%	0.524	S	S	.	.	H	α-helix	trans	-71.2	-39.5	172.9	-76.5	169.5	-174.5	168.1	0	112	E654 T655 V656 E661 V662	E654-K658 HydrophobicContact CG-CD 4.5Å; E654-K658 WeakPolarHBondContact O-CB 3.44Å; E654-K658 VanDerWaalsContact O-CG 3.25Å; E654-K658 WeakPolarHBondContact O-CG 3.26Å; E654-K658 PolarHBondContact O-N 2.8Å; E654-K658 WeakPolarHBondContact OE1-CE 3.25Å; E654-K658 IonicContact OE1-NZ 2.89Å; E654-K658 PolarHBondContact OE1-NZ 3.33Å; T655-K658 CarbonylContact O-C 3.53Å; T655-K658 PolarHBondContact O-N 2.58Å; V656-K658 VanDerWaalsContact C-N 3.31Å; V656-K658 PolarHBondContact O-N 2.92Å; K658-E661 PolarHBondContact O-N 2.82Å; K658-V662 WeakPolarHBondContact O-CB 3.26Å; K658-V662 VanDerWaalsContact O-CG2 3.27Å; K658-V662 WeakPolarHBondContact O-CG2 3.2Å; K658-V662 PolarHBondContact O-N 2.75Å
659	E	73.6	Confident	72.5	Confident	138 Å²	138	117.9 Å²	117.9	65%	0.645	53%	0.534	S	S	*	.	H	α-helix	trans	-66.1	-42.5	173	-71.9	-172.9	148.2	0	0	111.4	T655 V656 E661 V662 E663	T655-E659 WeakPolarHBondContact O-CG 3.24Å; T655-E659 PolarHBondContact O-N 3.33Å; V656-E659 PolarHBondContact O-N 2.93Å; E659-E661 VanDerWaalsContact C-N 3.32Å; E659-E661 PolarHBondContact O-N 2.99Å; E659-V662 PolarHBondContact O-N 3.21Å; E659-E663 VanDerWaalsContact O-CB 3.31Å; E659-E663 WeakPolarHBondContact O-CB 3.42Å; E659-E663 PolarHBondContact O-N 2.85Å
660	E	75.7	Confident	72.6	Confident	116 Å²	116	118 Å²	118	54%	0.542	54%	0.537	S	S	.	.	H	α-helix	trans	-64.2	-31.2	172	-74.9	-172.4	151.3	0	0	113.3	V656 R664	V656-E660 HydrophobicContact CG1-CG 4.39Å; V656-E660 WeakPolarHBondContact O-CB 3.41Å; V656-E660 WeakPolarHBondContact O-CG 3.42Å; V656-E660 PolarHBondContact O-N 2.82Å; E660-R664 VanDerWaalsContact O-CB 3.3Å; E660-R664 WeakPolarHBondContact O-CB 3.45Å; E660-R664 WeakPolarHBondContact O-CG 3.25Å; E660-R664 PolarHBondContact O-N 2.81Å; E660-R664 PolarHBondContact O-NE 3.4Å
661	E	72.9	Confident	72.6	Confident	83 Å²	83	116.3 Å²	116.3	39%	0.388	53%	0.534	S	S	.	.	H	α-helix	trans	-75.8	-40.4	173.1	-163.8	-170	125.2	0	0	111.8	K657 K658 E659 E663 R664 K665	K657-E661 WeakPolarHBondContact O-CB 3.46Å; K657-E661 PolarHBondContact O-N 2.83Å; K658-E661 PolarHBondContact O-N 2.82Å; E659-E661 VanDerWaalsContact C-N 3.32Å; E659-E661 PolarHBondContact O-N 2.99Å; E661-E663 VanDerWaalsContact C-N 3.33Å; E661-R664 PolarHBondContact O-N 2.94Å; E661-K665 HydrophobicContact CG-CD 4.42Å; E661-K665 WeakPolarHBondContact O-CB 3.34Å; E661-K665 WeakPolarHBondContact O-CG 3.3Å; E661-K665 PolarHBondContact O-N 2.77Å; E661-K665 WeakPolarHBondContact OE1-CE 3.29Å; E661-K665 IonicContact OE1-NZ 3.73Å; E661-K665 PolarHBondContact OE1-NZ 2.73Å
662	V	74.6	Confident	72.7	Confident	86 Å²	86	113.3 Å²	113.3	52%	0.521	53%	0.531	S	S	.	.	H	α-helix	trans	-64.9	-38.2	173.2	166.9	0	0	0	0	110.8	K658 E659 K665 R666	K658-V662 WeakPolarHBondContact O-CB 3.26Å; K658-V662 VanDerWaalsContact O-CG2 3.27Å; K658-V662 WeakPolarHBondContact O-CG2 3.2Å; K658-V662 PolarHBondContact O-N 2.75Å; E659-V662 PolarHBondContact O-N 3.21Å; V662-K665 PolarHBondContact O-N 2.82Å; V662-R666 WeakPolarHBondContact O-CB 3.44Å; V662-R666 PolarHBondContact O-N 3.28Å
663	E	73.5	Confident	72.6	Confident	104 Å²	104	114.6 Å²	114.6	49%	0.486	54%	0.537	S	S	.	.	H	α-helix	trans	-74.7	-35.3	176	-161.7	179.1	119.3	0	0	111.9	E659 E661 R666 K667	E659-E663 VanDerWaalsContact O-CB 3.31Å; E659-E663 WeakPolarHBondContact O-CB 3.42Å; E659-E663 PolarHBondContact O-N 2.85Å; E661-E663 VanDerWaalsContact C-N 3.33Å; E663-R666 PolarHBondContact O-N 3.31Å; E663-K667 HydrophobicContact CG-CD 4.24Å; E663-K667 WeakPolarHBondContact O-CB 3.39Å; E663-K667 VanDerWaalsContact O-CG 3.31Å; E663-K667 WeakPolarHBondContact O-CG 3.39Å; E663-K667 PolarHBondContact O-N 3.22Å; E663-K667 WeakPolarHBondContact OE1-CE 3.44Å; E663-K667 IonicContact OE1-NZ 2.83Å; E663-K667 PolarHBondContact OE1-NZ 3.17Å
664	R	74.2	Confident	72.2	Confident	143 Å²	143	112.8 Å²	112.8	54%	0.54	54%	0.537	S	S	.	.	H	α-helix	trans	-60	-48	166.4	-92.6	-178.6	-68.3	140.6	0.8	111.5	E660 E661 R666 K667 E668	E660-R664 VanDerWaalsContact O-CB 3.3Å; E660-R664 WeakPolarHBondContact O-CB 3.45Å; E660-R664 WeakPolarHBondContact O-CG 3.25Å; E660-R664 PolarHBondContact O-N 2.81Å; E660-R664 PolarHBondContact O-NE 3.4Å; E661-R664 PolarHBondContact O-N 2.94Å; R664-R666 VanDerWaalsContact C-N 3.34Å; R664-R666 PolarHBondContact O-N 3.17Å; R664-K667 CarbonylContact O-C 3.58Å; R664-K667 PolarHBondContact O-N 2.93Å; R664-K667 VanDerWaalsContact O-N 3.08Å; R664-E668 WeakPolarHBondContact O-CB 3.25Å; R664-E668 WeakPolarHBondContact O-CG 2.99Å; R664-E668 PolarHBondContact O-N 2.75Å
665	K	74.7	Confident	71.7	Confident	115 Å²	115	111.9 Å²	111.9	50%	0.5	54%	0.538	S	S	.	.	H	α-helix	trans	-61.6	-41.1	177.6	-80.2	170.1	170.7	167.5	0	111.6	E661 V662 E668 E669	E661-K665 HydrophobicContact CG-CD 4.42Å; E661-K665 WeakPolarHBondContact O-CB 3.34Å; E661-K665 WeakPolarHBondContact O-CG 3.3Å; E661-K665 PolarHBondContact O-N 2.77Å; E661-K665 WeakPolarHBondContact OE1-CE 3.29Å; E661-K665 IonicContact OE1-NZ 3.73Å; E661-K665 PolarHBondContact OE1-NZ 2.73Å; V662-K665 PolarHBondContact O-N 2.82Å; K665-E668 PolarHBondContact O-N 3.49Å; K665-E669 WeakPolarHBondContact O-CB 3.22Å; K665-E669 PolarHBondContact O-N 2.75Å
666	R	74.7	Confident	71.2	Confident	180 Å²	180	117.3 Å²	117.3	68%	0.679	55%	0.55	S	S	*	.	H	α-helix	trans	-60.2	-43.1	169.6	-95.8	-178	164	167.2	-4.1	112.7	V662 E663 R664 E669 E670	V662-R666 WeakPolarHBondContact O-CB 3.44Å; V662-R666 PolarHBondContact O-N 3.28Å; E663-R666 PolarHBondContact O-N 3.31Å; R664-R666 VanDerWaalsContact C-N 3.34Å; R664-R666 PolarHBondContact O-N 3.17Å; R666-E669 PolarHBondContact O-N 3.21Å; R666-E670 WeakPolarHBondContact O-CB 3.36Å; R666-E670 PolarHBondContact O-N 3.01Å
667	K	73.8	Confident	70.5	Confident	106 Å²	106	115.8 Å²	115.8	46%	0.461	55%	0.548	S	S	.	.	H	α-helix	trans	-72.8	-26.2	178.4	-75.6	167.5	172.2	170	0	113.2	E663 R664 K671	E663-K667 HydrophobicContact CG-CD 4.24Å; E663-K667 WeakPolarHBondContact O-CB 3.39Å; E663-K667 VanDerWaalsContact O-CG 3.31Å; E663-K667 WeakPolarHBondContact O-CG 3.39Å; E663-K667 PolarHBondContact O-N 3.22Å; E663-K667 WeakPolarHBondContact OE1-CE 3.44Å; E663-K667 IonicContact OE1-NZ 2.83Å; E663-K667 PolarHBondContact OE1-NZ 3.17Å; R664-K667 CarbonylContact O-C 3.58Å; R664-K667 PolarHBondContact O-N 2.93Å; R664-K667 VanDerWaalsContact O-N 3.08Å; K667-K671 VanDerWaalsContact O-CB 3.23Å; K667-K671 WeakPolarHBondContact O-CB 3.36Å; K667-K671 WeakPolarHBondContact O-CG 3.41Å; K667-K671 PolarHBondContact O-N 2.62Å
668	E	74.2	Confident	70	Confident	135 Å²	135	116.4 Å²	116.4	63%	0.631	55%	0.552	S	S	*	*	H	α-helix	trans	-77.1	-38.1	169.4	-75.2	-172.2	134.9	0	0	111.6	R664 K665 K671 A672	R664-E668 WeakPolarHBondContact O-CB 3.25Å; R664-E668 WeakPolarHBondContact O-CG 2.99Å; R664-E668 PolarHBondContact O-N 2.75Å; K665-E668 PolarHBondContact O-N 3.49Å; E668-K671 CarbonylContact O-C 3.55Å; E668-K671 PolarHBondContact O-N 2.83Å; E668-A672 VanDerWaalsContact O-CB 3.24Å; E668-A672 WeakPolarHBondContact O-CB 3.5Å; E668-A672 PolarHBondContact O-N 3.47Å
669	E	72.5	Confident	69.2	Low	141 Å²	141	118.1 Å²	118.1	66%	0.659	56%	0.56	S	S	*	*	H	α-helix	trans	-71.2	-40.2	175.8	-171.3	166.1	-131.5	0	0	111.4	K665 R666 A672 E673	K665-E669 WeakPolarHBondContact O-CB 3.22Å; K665-E669 PolarHBondContact O-N 2.75Å; R666-E669 PolarHBondContact O-N 3.21Å; E669-A672 CarbonylContact O-C 3.58Å; E669-A672 WeakPolarHBondContact O-CB 3.28Å; E669-A672 PolarHBondContact O-N 2.78Å; E669-E673 WeakPolarHBondContact O-CB 3.22Å; E669-E673 PolarHBondContact O-N 3.42Å
670	E	73	Confident	68.5	Low	133 Å²	133	115.7 Å²	115.7	62%	0.621	55%	0.554	S	S	*	*	H	α-helix	trans	-66.5	-35.1	170.7	-176.5	178.9	-143.1	0	0	111.4	R666 S674	R666-E670 WeakPolarHBondContact O-CB 3.36Å; R666-E670 PolarHBondContact O-N 3.01Å; E670-S674 WeakPolarHBondContact O-CA 3.26Å; E670-S674 WeakPolarHBondContact O-CB 3.32Å; E670-S674 PolarHBondContact O-N 3.39Å
671	K	71.8	Confident	67.7	Low	150 Å²	150	115.2 Å²	115.2	65%	0.652	55%	0.552	S	S	*	*	H	α-helix	trans	-71.1	-33.8	168.4	-83.6	178.9	175.8	-177.3	0	112.9	K667 E668 T675	K667-K671 VanDerWaalsContact O-CB 3.23Å; K667-K671 WeakPolarHBondContact O-CB 3.36Å; K667-K671 WeakPolarHBondContact O-CG 3.41Å; K667-K671 PolarHBondContact O-N 2.62Å; E668-K671 CarbonylContact O-C 3.55Å; E668-K671 PolarHBondContact O-N 2.83Å; K671-T675 WeakPolarHBondContact O-CB 3.4Å; K671-T675 WeakPolarHBondContact O-CG2 3.38Å; K671-T675 PolarHBondContact O-N 2.93Å; K671-T675 PolarHBondContact O-OG1 2.84Å
672	A	68.8	Low	67	Low	52 Å²	52	114 Å²	114	43%	0.43	55%	0.55	S	S	.	*	H	α-helix	trans	-71	-37.8	175.4	0	0	0	0	0	110.6	E668 E669 T675 R676	E668-A672 VanDerWaalsContact O-CB 3.24Å; E668-A672 WeakPolarHBondContact O-CB 3.5Å; E668-A672 PolarHBondContact O-N 3.47Å; E669-A672 CarbonylContact O-C 3.58Å; E669-A672 WeakPolarHBondContact O-CB 3.28Å; E669-A672 PolarHBondContact O-N 2.78Å; A672-T675 PolarHBondContact O-OG1 3.4Å; A672-R676 WeakPolarHBondContact O-CB 3.25Å; A672-R676 PolarHBondContact O-N 2.89Å
673	E	69	Low	66.2	Low	146 Å²	146	115.2 Å²	115.2	68%	0.682	55%	0.549	S	S	*	.	H	α-helix	trans	-73.9	-37.7	173.7	-172.9	161.6	-128.7	0	0	111.6	E669 R676 G677	E669-E673 WeakPolarHBondContact O-CB 3.22Å; E669-E673 PolarHBondContact O-N 3.42Å; E673-R676 PolarHBondContact O-N 3.19Å; E673-G677 WeakPolarHBondContact O-CA 3.24Å; E673-G677 PolarHBondContact O-N 3.27Å
674	S	62.2	Low	65.5	Low	71 Å²	71	118.8 Å²	118.8	50%	0.497	56%	0.558	S	S	.	*	H	α-helix	trans	-61.9	-50.6	170.4	169.3	0	0	0	0	111.4	E670 R676 G677 E678	E670-S674 WeakPolarHBondContact O-CA 3.26Å; E670-S674 WeakPolarHBondContact O-CB 3.32Å; E670-S674 PolarHBondContact O-N 3.39Å; S674-R676 VanDerWaalsContact C-N 3.31Å; S674-R676 PolarHBondContact O-N 3.47Å; S674-G677 PolarHBondContact O-N 2.87Å; S674-E678 VanDerWaalsContact O-CB 3.26Å; S674-E678 WeakPolarHBondContact O-CB 3.16Å; S674-E678 PolarHBondContact O-N 3.23Å
675	T	61.1	Low	64.7	Low	79 Å²	79	117.3 Å²	117.3	49%	0.485	56%	0.555	S	S	.	*	H	α-helix	trans	-71.5	-24	177.7	53.8	0	0	0	0	112.6	K671 A672 K679	K671-T675 WeakPolarHBondContact O-CB 3.4Å; K671-T675 WeakPolarHBondContact O-CG2 3.38Å; K671-T675 PolarHBondContact O-N 2.93Å; K671-T675 PolarHBondContact O-OG1 2.84Å; A672-T675 PolarHBondContact O-OG1 3.4Å; T675-K679 WeakPolarHBondContact O-CB 3.42Å; T675-K679 PolarHBondContact O-N 3.05Å
676	R	57.8	Low	63.9	Low	191 Å²	191	116.9 Å²	116.9	72%	0.721	56%	0.555	S	S	*	*	H	α-helix	trans	-76.8	-36.1	170.2	-172.4	178	-163.9	165.7	3.6	111.9	A672 E673 S674 V680	A672-R676 WeakPolarHBondContact O-CB 3.25Å; A672-R676 PolarHBondContact O-N 2.89Å; E673-R676 PolarHBondContact O-N 3.19Å; S674-R676 VanDerWaalsContact C-N 3.31Å; S674-R676 PolarHBondContact O-N 3.47Å; R676-V680 VanDerWaalsContact O-CB 3.25Å; R676-V680 WeakPolarHBondContact O-CB 3.44Å; R676-V680 WeakPolarHBondContact O-CG2 3.49Å; R676-V680 PolarHBondContact O-N 3.06Å
677	G	59.5	Low	63	Low	38 Å²	38	114 Å²	114	39%	0.392	55%	0.549	S	S	.	.	H	α-helix	trans	-67.7	-47.3	173	0	0	0	0	0	111.1	E673 S674 V680 E681	E673-G677 WeakPolarHBondContact O-CA 3.24Å; E673-G677 PolarHBondContact O-N 3.27Å; S674-G677 PolarHBondContact O-N 2.87Å; G677-V680 CarbonylContact O-C 3.55Å; G677-V680 PolarHBondContact O-N 3.19Å; G677-E681 WeakPolarHBondContact O-CB 3.39Å; G677-E681 PolarHBondContact O-N 3.03Å
678	E	61.6	Low	62.3	Low	123 Å²	123	114.3 Å²	114.3	58%	0.575	55%	0.552	S	S	*	*	H	α-helix	trans	-61.7	-44.3	171.9	-172.8	174.2	-138.9	0	0	110.7	S674 V680 E681 T682	S674-E678 VanDerWaalsContact O-CB 3.26Å; S674-E678 WeakPolarHBondContact O-CB 3.16Å; S674-E678 PolarHBondContact O-N 3.23Å; E678-V680 VanDerWaalsContact C-N 3.29Å; E678-V680 PolarHBondContact O-N 2.81Å; E678-E681 CarbonylContact O-C 3.58Å; E678-E681 PolarHBondContact O-N 2.8Å; E678-E681 VanDerWaalsContact O-N 3.09Å; E678-T682 HydrophobicContact CG-CG2 4.44Å; E678-T682 WeakPolarHBondContact O-CG2 3.4Å; E678-T682 PolarHBondContact O-N 2.71Å; E678-T682 PolarHBondContact O-OG1 2.87Å
679	K	55.1	Low	61.5	Low	151 Å²	151	111.4 Å²	111.4	66%	0.657	54%	0.544	S	S	*	.	H	α-helix	trans	-71.6	-19.3	175.8	-168.8	167.6	-171.4	168.9	0	114.1	T675 T682 K683	T675-K679 WeakPolarHBondContact O-CB 3.42Å; T675-K679 PolarHBondContact O-N 3.05Å; K679-T682 WeakPolarHBondContact CA-OG1 3.3Å; K679-T682 PolarHBondContact O-OG1 2.91Å; K679-K683 VanDerWaalsContact O-CB 3.26Å; K679-K683 WeakPolarHBondContact O-CB 3.42Å; K679-K683 WeakPolarHBondContact O-CG 3.4Å; K679-K683 PolarHBondContact O-N 2.93Å
680	V	57.9	Low	60.8	Low	86 Å²	86	108 Å²	108	52%	0.521	53%	0.532	S	S	.	.	H	α-helix	trans	-79.7	-36.9	166.7	161.9	0	0	0	0	110.3	R676 G677 E678 K683 R684	R676-V680 VanDerWaalsContact O-CB 3.25Å; R676-V680 WeakPolarHBondContact O-CB 3.44Å; R676-V680 WeakPolarHBondContact O-CG2 3.49Å; R676-V680 PolarHBondContact O-N 3.06Å; G677-V680 CarbonylContact O-C 3.55Å; G677-V680 PolarHBondContact O-N 3.19Å; E678-V680 VanDerWaalsContact C-N 3.29Å; E678-V680 PolarHBondContact O-N 2.81Å; V680-K683 CarbonylContact O-C 3.58Å; V680-K683 PolarHBondContact O-N 3.36Å; V680-R684 VanDerWaalsContact O-CB 3.31Å; V680-R684 WeakPolarHBondContact O-CB 3.49Å; V680-R684 PolarHBondContact O-N 2.93Å
681	E	59.2	Low	60.1	Low	106 Å²	106	108 Å²	108	50%	0.495	53%	0.53	S	S	.	.	H	α-helix	trans	-77.7	-35.6	179.1	-154.9	-167.8	-124.9	0	0	112.4	G677 E678 R684 K685	G677-E681 WeakPolarHBondContact O-CB 3.39Å; G677-E681 PolarHBondContact O-N 3.03Å; E678-E681 CarbonylContact O-C 3.58Å; E678-E681 PolarHBondContact O-N 2.8Å; E678-E681 VanDerWaalsContact O-N 3.09Å; E681-R684 PolarHBondContact O-N 3.23Å; E681-K685 HydrophobicContact CG-CD 4.4Å; E681-K685 WeakPolarHBondContact O-CB 3.37Å; E681-K685 WeakPolarHBondContact O-CD 3.43Å; E681-K685 VanDerWaalsContact O-CG 3.26Å; E681-K685 WeakPolarHBondContact O-CG 3.42Å; E681-K685 PolarHBondContact O-N 3.37Å; E681-K685 WeakPolarHBondContact OE2-CE 3.32Å; E681-K685 IonicContact OE2-NZ 3.78Å; E681-K685 PolarHBondContact OE2-NZ 2.9Å
682	T	58.8	Low	59.6	Low	57 Å²	57	106.6 Å²	106.6	35%	0.35	52%	0.524	S	S	.	.	H	α-helix	trans	-64.4	-44.7	165.7	66.1	0	0	0	0	109.4	E678 K679 R684 K685 E686	E678-T682 HydrophobicContact CG-CG2 4.44Å; E678-T682 WeakPolarHBondContact O-CG2 3.4Å; E678-T682 PolarHBondContact O-N 2.71Å; E678-T682 PolarHBondContact O-OG1 2.87Å; K679-T682 WeakPolarHBondContact CA-OG1 3.3Å; K679-T682 PolarHBondContact O-OG1 2.91Å; T682-R684 PolarHBondContact O-N 3.28Å; T682-K685 CarbonylContact O-C 3.59Å; T682-K685 PolarHBondContact O-N 2.67Å; T682-E686 WeakPolarHBondContact O-CB 3.23Å; T682-E686 WeakPolarHBondContact O-CG 3.38Å; T682-E686 PolarHBondContact O-N 3.06Å
683	K	56.5	Low	59.2	Low	112 Å²	112	110 Å²	110	49%	0.487	53%	0.531	S	S	.	.	H	α-helix	trans	-57.9	-35.7	171.2	-94	-174.1	145.2	-79	0	113.1	K679 V680 E687	K679-K683 VanDerWaalsContact O-CB 3.26Å; K679-K683 WeakPolarHBondContact O-CB 3.42Å; K679-K683 WeakPolarHBondContact O-CG 3.4Å; K679-K683 PolarHBondContact O-N 2.93Å; V680-K683 CarbonylContact O-C 3.58Å; V680-K683 PolarHBondContact O-N 3.36Å; K683-E687 VanDerWaalsContact O-CB 3.26Å; K683-E687 WeakPolarHBondContact O-CB 3.45Å; K683-E687 VanDerWaalsContact O-CG 3.25Å; K683-E687 WeakPolarHBondContact O-CG 3.44Å; K683-E687 PolarHBondContact O-N 2.8Å
684	R	59.3	Low	58.6	Low	180 Å²	180	109 Å²	109	68%	0.679	53%	0.526	S	S	*	.	H	α-helix	trans	-74.8	-37.1	179.7	-146.5	173.4	-168.1	175.1	2.5	111.9	V680 E681 T682 E688	V680-R684 VanDerWaalsContact O-CB 3.31Å; V680-R684 WeakPolarHBondContact O-CB 3.49Å; V680-R684 PolarHBondContact O-N 2.93Å; E681-R684 PolarHBondContact O-N 3.23Å; T682-R684 PolarHBondContact O-N 3.28Å; R684-E688 WeakPolarHBondContact O-CB 3.5Å; R684-E688 PolarHBondContact O-N 3.37Å
685	K	57.9	Low	58.5	Low	112 Å²	112	110.9 Å²	110.9	49%	0.487	53%	0.527	S	S	.	.	H	α-helix	trans	-69.6	-40.4	172.3	-73.2	162.6	176.7	168.7	0	111.1	E681 T682 E688 T689	E681-K685 HydrophobicContact CG-CD 4.4Å; E681-K685 WeakPolarHBondContact O-CB 3.37Å; E681-K685 WeakPolarHBondContact O-CD 3.43Å; E681-K685 VanDerWaalsContact O-CG 3.26Å; E681-K685 WeakPolarHBondContact O-CG 3.42Å; E681-K685 PolarHBondContact O-N 3.37Å; E681-K685 WeakPolarHBondContact OE2-CE 3.32Å; E681-K685 IonicContact OE2-NZ 3.78Å; E681-K685 PolarHBondContact OE2-NZ 2.9Å; T682-K685 CarbonylContact O-C 3.59Å; T682-K685 PolarHBondContact O-N 2.67Å; K685-E688 PolarHBondContact O-N 2.87Å; K685-T689 WeakPolarHBondContact O-CG2 3.28Å; K685-T689 PolarHBondContact O-N 3.27Å; K685-T689 PolarHBondContact O-OG1 3.39Å; K685-T689 VanDerWaalsContact O-OG1 3.07Å
686	E	57.1	Low	58.5	Low	106 Å²	106	111.5 Å²	111.5	50%	0.495	53%	0.525	S	S	.	.	H	α-helix	trans	-62.9	-44.9	171.1	-75.3	166.2	-177.2	0	0	110.7	T682 E688 T689 V690	T682-E686 WeakPolarHBondContact O-CB 3.23Å; T682-E686 WeakPolarHBondContact O-CG 3.38Å; T682-E686 PolarHBondContact O-N 3.06Å; E686-E688 VanDerWaalsContact C-N 3.32Å; E686-E688 PolarHBondContact O-N 2.81Å; E686-T689 WeakPolarHBondContact CA-OG1 3.4Å; E686-T689 PolarHBondContact O-N 3.48Å; E686-T689 PolarHBondContact O-OG1 3.24Å; E686-V690 WeakPolarHBondContact O-CA 3.43Å; E686-V690 WeakPolarHBondContact O-CB 3.29Å; E686-V690 WeakPolarHBondContact O-CG2 3.4Å; E686-V690 PolarHBondContact O-N 2.83Å
687	E	55.9	Low	58.6	Low	119 Å²	119	105.9 Å²	105.9	56%	0.556	51%	0.512	S	S	*	.	H	α-helix	trans	-64.3	-34.4	173.4	-79.5	170.7	-171.8	0	0	111.8	K683 K691	K683-E687 VanDerWaalsContact O-CB 3.26Å; K683-E687 WeakPolarHBondContact O-CB 3.45Å; K683-E687 VanDerWaalsContact O-CG 3.25Å; K683-E687 WeakPolarHBondContact O-CG 3.44Å; K683-E687 PolarHBondContact O-N 2.8Å; E687-K691 WeakPolarHBondContact O-CB 3.44Å; E687-K691 PolarHBondContact O-N 3.4Å
688	E	58.7	Low	58.5	Low	113 Å²	113	110.1 Å²	110.1	53%	0.528	52%	0.521	S	S	.	.	H	α-helix	trans	-77.7	-34.3	176.6	-150.5	-162.3	145.5	0	0	113.2	R684 K685 E686 K692	R684-E688 WeakPolarHBondContact O-CB 3.5Å; R684-E688 PolarHBondContact O-N 3.37Å; K685-E688 PolarHBondContact O-N 2.87Å; E686-E688 VanDerWaalsContact C-N 3.32Å; E686-E688 PolarHBondContact O-N 2.81Å; E688-K692 PolarHBondContact O-N 2.82Å; E688-K692 VanDerWaalsContact O-N 3.12Å; E688-K692 IonicContact OE1-NZ 3.95Å; E688-K692 PolarHBondContact OE1-NZ 2.78Å
689	T	57.6	Low	58.3	Low	74 Å²	74	111.3 Å²	111.3	45%	0.454	52%	0.52	S	S	.	.	H	α-helix	trans	-73.2	-44	171.5	54.2	0	0	0	0	110.8	K685 E686 K691 K692 E693	K685-T689 WeakPolarHBondContact O-CG2 3.28Å; K685-T689 PolarHBondContact O-N 3.27Å; K685-T689 PolarHBondContact O-OG1 3.39Å; K685-T689 VanDerWaalsContact O-OG1 3.07Å; E686-T689 WeakPolarHBondContact CA-OG1 3.4Å; E686-T689 PolarHBondContact O-N 3.48Å; E686-T689 PolarHBondContact O-OG1 3.24Å; T689-K691 PolarHBondContact O-N 3.14Å; T689-K692 CarbonylContact O-C 3.51Å; T689-K692 PolarHBondContact O-N 3.48Å; T689-K692 VanDerWaalsContact O-N 3.12Å; T689-E693 WeakPolarHBondContact O-CB 3.16Å; T689-E693 WeakPolarHBondContact O-CG 3.47Å; T689-E693 PolarHBondContact O-N 3.38Å
690	V	58.2	Low	58.5	Low	69 Å²	69	109.1 Å²	109.1	42%	0.418	51%	0.511	S	S	.	.	H	α-helix	trans	-58.4	-38.7	172.7	167.2	0	0	0	0	110	E686 E693 E694	E686-V690 WeakPolarHBondContact O-CA 3.43Å; E686-V690 WeakPolarHBondContact O-CB 3.29Å; E686-V690 WeakPolarHBondContact O-CG2 3.4Å; E686-V690 PolarHBondContact O-N 2.83Å; V690-E693 CarbonylContact O-C 3.6Å; V690-E693 PolarHBondContact O-N 3.48Å; V690-E694 HydrophobicContact CG1-CG 4.26Å; V690-E694 VanDerWaalsContact O-CB 3.29Å; V690-E694 WeakPolarHBondContact O-CB 3.14Å; V690-E694 VanDerWaalsContact O-CG 3.31Å; V690-E694 WeakPolarHBondContact O-CG 3.41Å; V690-E694 PolarHBondContact O-N 2.98Å
691	K	59.3	Low	58.2	Low	132 Å²	132	112.3 Å²	112.3	57%	0.574	51%	0.514	S	S	*	.	H	α-helix	trans	-69	-35.5	176.1	-168.1	168.4	-174.2	175.8	0	113.7	E687 T689 E695	E687-K691 WeakPolarHBondContact O-CB 3.44Å; E687-K691 PolarHBondContact O-N 3.4Å; T689-K691 PolarHBondContact O-N 3.14Å; K691-E695 PolarHBondContact O-N 2.86Å
692	K	59.5	Low	58	Low	122 Å²	122	112.6 Å²	112.6	53%	0.53	52%	0.519	S	S	.	.	H	α-helix	trans	-71.1	-37.8	172.2	-81.3	168.5	173.1	138.5	0	112.3	E688 T689 E695 E696	E688-K692 PolarHBondContact O-N 2.82Å; E688-K692 VanDerWaalsContact O-N 3.12Å; E688-K692 IonicContact OE1-NZ 3.95Å; E688-K692 PolarHBondContact OE1-NZ 2.78Å; T689-K692 CarbonylContact O-C 3.51Å; T689-K692 PolarHBondContact O-N 3.48Å; T689-K692 VanDerWaalsContact O-N 3.12Å; K692-E695 PolarHBondContact O-N 2.78Å; K692-E696 PolarHBondContact O-N 2.8Å
693	E	60.8	Low	57.8	Low	123 Å²	123	117.1 Å²	117.1	58%	0.575	54%	0.536	S	S	*	.	H	α-helix	trans	-70.2	-34.4	173.8	-73.2	-178.5	169.3	0	0	110.9	T689 V690 E696 V697	T689-E693 WeakPolarHBondContact O-CB 3.16Å; T689-E693 WeakPolarHBondContact O-CG 3.47Å; T689-E693 PolarHBondContact O-N 3.38Å; V690-E693 CarbonylContact O-C 3.6Å; V690-E693 PolarHBondContact O-N 3.48Å; E693-E696 PolarHBondContact O-N 2.83Å; E693-V697 WeakPolarHBondContact O-CA 3.36Å; E693-V697 WeakPolarHBondContact O-CB 3.45Å; E693-V697 WeakPolarHBondContact O-CG2 3.35Å; E693-V697 PolarHBondContact O-N 3.07Å
694	E	56.5	Low	57.5	Low	124 Å²	124	118.5 Å²	118.5	58%	0.579	54%	0.544	S	S	*	.	H	α-helix	trans	-65.2	-44.5	169.3	-80.7	-175.6	142.1	0	0	110.8	V690 E696 V697 E698	V690-E694 HydrophobicContact CG1-CG 4.26Å; V690-E694 VanDerWaalsContact O-CB 3.29Å; V690-E694 WeakPolarHBondContact O-CB 3.14Å; V690-E694 VanDerWaalsContact O-CG 3.31Å; V690-E694 WeakPolarHBondContact O-CG 3.41Å; V690-E694 PolarHBondContact O-N 2.98Å; E694-E696 VanDerWaalsContact C-N 3.26Å; E694-E696 PolarHBondContact O-N 2.92Å; E694-V697 PolarHBondContact O-N 2.91Å; E694-E698 WeakPolarHBondContact O-CB 3.38Å; E694-E698 PolarHBondContact O-N 2.63Å
695	E	61.1	Low	57	Low	111 Å²	111	117.2 Å²	117.2	52%	0.519	55%	0.546	S	S	.	.	H	α-helix	trans	-65.5	-24.1	174.2	-79.1	-175.4	-175.5	0	0	113.5	K691 K692 R699	K691-E695 PolarHBondContact O-N 2.86Å; K692-E695 PolarHBondContact O-N 2.78Å; E695-R699 VanDerWaalsContact O-CZ 3.28Å; E695-R699 PolarHBondContact O-NE 3.36Å; E695-R699 PolarHBondContact O-NH2 3.17Å
696	E	61.1	Low	56.3	Low	92 Å²	92	120.8 Å²	120.8	43%	0.43	56%	0.561	S	S	.	*	H	α-helix	trans	-90	-38	175.2	-164.5	179.9	124.4	0	0	112.7	K692 E693 E694 R699 K700	K692-E696 PolarHBondContact O-N 2.8Å; E693-E696 PolarHBondContact O-N 2.83Å; E694-E696 VanDerWaalsContact C-N 3.26Å; E694-E696 PolarHBondContact O-N 2.92Å; E696-R699 WeakPolarHBondContact O-CB 3.48Å; E696-R699 PolarHBondContact O-N 2.85Å; E696-K700 HydrophobicContact CG-CD 4.45Å; E696-K700 WeakPolarHBondContact O-CG 3.33Å; E696-K700 PolarHBondContact O-N 2.97Å; E696-K700 WeakPolarHBondContact OE1-CE 3.5Å; E696-K700 IonicContact OE1-NZ 2.62Å; E696-K700 PolarHBondContact OE1-NZ 3.42Å
697	V	58.4	Low	55.5	Low	73 Å²	73	118.5 Å²	118.5	44%	0.442	56%	0.561	S	S	.	*	H	α-helix	trans	-67.7	-37.4	172.9	168.2	0	0	0	0	109.9	E693 E694 R699 K700 R701	E693-V697 WeakPolarHBondContact O-CA 3.36Å; E693-V697 WeakPolarHBondContact O-CB 3.45Å; E693-V697 WeakPolarHBondContact O-CG2 3.35Å; E693-V697 PolarHBondContact O-N 3.07Å; E694-V697 PolarHBondContact O-N 2.91Å; V697-R699 VanDerWaalsContact C-N 3.31Å; V697-R699 PolarHBondContact O-N 3.3Å; V697-K700 CarbonylContact O-C 3.55Å; V697-K700 PolarHBondContact O-N 3.15Å; V697-R701 WeakPolarHBondContact O-CA 3.44Å; V697-R701 WeakPolarHBondContact O-CB 3.39Å; V697-R701 PolarHBondContact O-N 2.57Å
698	E	58.7	Low	54.6	Low	127 Å²	127	121.7 Å²	121.7	59%	0.593	58%	0.575	S	S	*	*	H	α-helix	trans	-65.2	-36.3	173.6	-174	170.7	-144.7	0	0	111.2	E694 N702	E694-E698 WeakPolarHBondContact O-CB 3.38Å; E694-E698 PolarHBondContact O-N 2.63Å; E698-N702 WeakPolarHBondContact O-CB 3.43Å; E698-N702 PolarHBondContact O-N 2.98Å; E698-N702 PolarHBondContact O-ND2 3.4Å
699	R	57.5	Low	53.4	Low	148 Å²	148	121.1 Å²	121.1	56%	0.558	58%	0.584	S	S	*	*	H	α-helix	trans	-63.2	-50.9	169.8	-87.4	173.5	-76.9	151.1	-0.5	111.8	E695 E696 V697 R701 N702 E703	E695-R699 VanDerWaalsContact O-CZ 3.28Å; E695-R699 PolarHBondContact O-NE 3.36Å; E695-R699 PolarHBondContact O-NH2 3.17Å; E696-R699 WeakPolarHBondContact O-CB 3.48Å; E696-R699 PolarHBondContact O-N 2.85Å; V697-R699 VanDerWaalsContact C-N 3.31Å; V697-R699 PolarHBondContact O-N 3.3Å; R699-R701 VanDerWaalsContact C-N 3.32Å; R699-R701 PolarHBondContact O-N 2.88Å; R699-N702 PolarHBondContact O-N 3.32Å; R699-E703 PolarHBondContact O-N 3.38Å
700	K	58.5	Low	52.3	Low	106 Å²	106	123.1 Å²	123.1	46%	0.461	60%	0.596	S	S	.	*	H	α-helix	trans	-63	-36.1	177.9	-74.7	166.9	172.2	166.9	0	112.6	E696 V697 E703 E704	E696-K700 HydrophobicContact CG-CD 4.45Å; E696-K700 WeakPolarHBondContact O-CG 3.33Å; E696-K700 PolarHBondContact O-N 2.97Å; E696-K700 WeakPolarHBondContact OE1-CE 3.5Å; E696-K700 IonicContact OE1-NZ 2.62Å; E696-K700 PolarHBondContact OE1-NZ 3.42Å; V697-K700 CarbonylContact O-C 3.55Å; V697-K700 PolarHBondContact O-N 3.15Å; K700-E703 CarbonylContact O-C 3.57Å; K700-E703 WeakPolarHBondContact O-CA 3.44Å; K700-E703 WeakPolarHBondContact O-CB 3.33Å; K700-E703 PolarHBondContact O-N 2.87Å; K700-E704 VanDerWaalsContact O-CB 3.23Å; K700-E704 WeakPolarHBondContact O-CB 3.38Å; K700-E704 PolarHBondContact O-N 3.24Å
701	R	52.1	Low	51.2	Low	152 Å²	152	130.4 Å²	130.4	57%	0.574	62%	0.616	S	S	*	*	H	α-helix	trans	-71.3	-33.9	177.2	-161.1	177	-151.1	145.9	5.4	111.5	V697 R699 E703 E704 E705	V697-R701 WeakPolarHBondContact O-CA 3.44Å; V697-R701 WeakPolarHBondContact O-CB 3.39Å; V697-R701 PolarHBondContact O-N 2.57Å; R699-R701 VanDerWaalsContact C-N 3.32Å; R699-R701 PolarHBondContact O-N 2.88Å; R701-E703 PolarHBondContact O-N 2.92Å; R701-E704 PolarHBondContact O-N 3.06Å; R701-E705 HydrophobicContact CG-CB 4.4Å; R701-E705 WeakPolarHBondContact O-CA 3.41Å; R701-E705 WeakPolarHBondContact O-CB 3.35Å; R701-E705 PolarHBondContact O-N 3.4Å
702	N	54.8	Low	50.1	Low	112 Å²	112	127 Å²	127	60%	0.599	62%	0.619	S	S	*	*	H	α-helix	trans	-67.6	-18.3	168.2	-83.6	-81.2	0	0	0	113.5	E698 R699	E698-N702 WeakPolarHBondContact O-CB 3.43Å; E698-N702 PolarHBondContact O-N 2.98Å; E698-N702 PolarHBondContact O-ND2 3.4Å; R699-N702 PolarHBondContact O-N 3.32Å
703	E	54.6	Low	49	Very low	152 Å²	152	129.2 Å²	129.2	71%	0.71	63%	0.631	S	S	*	*	H	α-helix	trans	-90.3	-36.7	170.1	-64.5	-173.5	125.3	0	0	112.7	R699 K700 R701	R699-E703 PolarHBondContact O-N 3.38Å; K700-E703 CarbonylContact O-C 3.57Å; K700-E703 WeakPolarHBondContact O-CA 3.44Å; K700-E703 WeakPolarHBondContact O-CB 3.33Å; K700-E703 PolarHBondContact O-N 2.87Å; R701-E703 PolarHBondContact O-N 2.92Å
704	E	49.9	Very low	47.6	Very low	142 Å²	142	131 Å²	131	66%	0.664	64%	0.637	S	S	*	*	H	α-helix	trans	-96.6	-23.8	-170.5	-165	167.7	-126.3	0	0	113.9	K700 R701 K706 A707	K700-E704 VanDerWaalsContact O-CB 3.23Å; K700-E704 WeakPolarHBondContact O-CB 3.38Å; K700-E704 PolarHBondContact O-N 3.24Å; R701-E704 PolarHBondContact O-N 3.06Å; E704-K706 PolarHBondContact O-N 2.89Å; E704-K706 VanDerWaalsContact O-N 3.17Å; E704-A707 CarbonylContact O-C 3.53Å; E704-A707 WeakPolarHBondContact O-CA 3.39Å; E704-A707 WeakPolarHBondContact O-CB 3.31Å; E704-A707 PolarHBondContact O-N 3.17Å
705	E	49	Very low	46.6	Very low	152 Å²	152	130.4 Å²	130.4	71%	0.71	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.1	-3.6	171	-167.3	160.2	-145	0	0	112.4	R701 A707	R701-E705 HydrophobicContact CG-CB 4.4Å; R701-E705 WeakPolarHBondContact O-CA 3.41Å; R701-E705 WeakPolarHBondContact O-CB 3.35Å; R701-E705 PolarHBondContact O-N 3.4Å; E705-A707 PolarHBondContact O-N 3.17Å
706	K	43.1	Very low	45.3	Very low	188 Å²	188	131.1 Å²	131.1	82%	0.817	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.9	-6.1	158.7	-84.6	176.9	176	165.5	0	113.8	E704	E704-K706 PolarHBondContact O-N 2.89Å; E704-K706 VanDerWaalsContact O-N 3.17Å
707	A	40.1	Very low	44.5	Very low	58 Å²	58	132.3 Å²	132.3	48%	0.479	66%	0.663	S	S	.	*	S	Bend	trans	-136.7	72.7	-170.2	0	0	0	0	0	113.1	E704 E705	E704-A707 CarbonylContact O-C 3.53Å; E704-A707 WeakPolarHBondContact O-CA 3.39Å; E704-A707 WeakPolarHBondContact O-CB 3.31Å; E704-A707 PolarHBondContact O-N 3.17Å; E705-A707 PolarHBondContact O-N 3.17Å
708	E	36.7	Very low	43.4	Very low	185 Å²	185	136.6 Å²	136.6	86%	0.864	68%	0.676	S	S	*	*			trans	70.8	119.1	163	-48.4	179.9	101.2	0	0	115.3
709	S	34.7	Very low	42.7	Very low	101 Å²	101	140.8 Å²	140.8	71%	0.706	69%	0.687	S	S	*	*			cis	88.5	103.2	22.3	115	0	0	0	0	117.2
710	T	34.1	Very low	41.8	Very low	117 Å²	117	143.4 Å²	143.4	72%	0.718	70%	0.702	S	S	*	*			trans	73.9	150.7	173.4	83.2	0	0	0	0	115.8
711	R	35.7	Very low	41.2	Very low	221 Å²	221	146.1 Å²	146.1	83%	0.834	72%	0.716	S	S	*	*			cis	-167.3	163.9	11.1	-147.4	178	-139.9	87.4	1.4	109.9
712	G	35.4	Very low	41	Very low	62 Å²	62	146.5 Å²	146.5	64%	0.639	73%	0.725	S	S	*	*			cis	150.2	103.6	-19	0	0	0	0	0	116.6
713	E	35.3	Very low	40.6	Very low	168 Å²	168	148.3 Å²	148.3	79%	0.785	73%	0.729	S	S	*	*			trans	68.9	160.8	152.1	-76.4	-147.8	126.7	0	0	122.2
714	K	33.4	Very low	40.2	Very low	161 Å²	161	145.3 Å²	145.3	70%	0.7	72%	0.721	S	S	*	*			cis	-177.3	149.1	-25.7	-153.1	-156.1	-154.6	132.3	0	114
715	V	34.3	Very low	40.5	Very low	110 Å²	110	142.5 Å²	142.5	67%	0.667	71%	0.714	S	S	*	*			trans	70.6	143.1	137.1	141.4	0	0	0	0	127.7
716	E	34.5	Very low	40.8	Very low	126 Å²	126	142.7 Å²	142.7	59%	0.589	71%	0.712	S	S	*	*			trans	18.7	133.9	158.1	-57.3	-176.4	86.2	0	0	127	K718	E716-K718 VanDerWaalsContact OE1-CD 3.32Å; E716-K718 WeakPolarHBondContact OE1-CD 3.28Å; E716-K718 WeakPolarHBondContact OE1-CE 3.46Å; E716-K718 IonicContact OE1-NZ 2.8Å; E716-K718 PolarHBondContact OE1-NZ 2.87Å; E716-K718 IonicContact OE2-NZ 3.22Å
717	S	42.9	Very low	41.3	Very low	117 Å²	117	140.6 Å²	140.6	82%	0.818	70%	0.703	S	S	*	*				-162.4	98.5	126.6	60.3	0	0	0	0	110.7
718	K	36.9	Very low	42.2	Very low	163 Å²	163	144.7 Å²	144.7	71%	0.709	71%	0.712	S	S	*	*				54.3	124.9	79	-93.6	172.1	178.8	151.4	0	116.8	E716	E716-K718 VanDerWaalsContact OE1-CD 3.32Å; E716-K718 WeakPolarHBondContact OE1-CD 3.28Å; E716-K718 WeakPolarHBondContact OE1-CE 3.46Å; E716-K718 IonicContact OE1-NZ 2.8Å; E716-K718 PolarHBondContact OE1-NZ 2.87Å; E716-K718 IonicContact OE2-NZ 3.22Å
719	R	42.6	Very low	43.3	Very low	216 Å²	216	141.4 Å²	141.4	82%	0.815	70%	0.697	S	S	*	*			trans	63.1	89.7	162.2	-66.5	176.3	168.4	161.6	-4.6	117.9
720	K	40.1	Very low	44.4	Very low	202 Å²	202	141.4 Å²	141.4	88%	0.878	69%	0.686	S	S	*	*	S	Bend	trans	-162.8	-7.8	151.5	-116.3	163.6	-173.4	177.4	0	118
721	E	44.4	Very low	45.9	Very low	163 Å²	163	140.2 Å²	140.2	76%	0.762	68%	0.678	S	S	*	*	S	Bend	trans	-95.5	-5.9	-175.1	-70.9	170.3	121.6	0	0	115.4	E723 T724	E721-E723 PolarHBondContact O-N 2.88Å; E721-T724 PolarHBondContact O-N 2.9Å; E721-T724 PolarHBondContact O-OG1 2.89Å; E721-T724 VanDerWaalsContact O-OG1 3.04Å
722	E	48.5	Very low	47.4	Very low	161 Å²	161	134.9 Å²	134.9	75%	0.752	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.3	-1.1	-178.5	-67.6	176.2	102.6	0	0	114.8
723	E	46.8	Very low	48.8	Very low	149 Å²	149	139.5 Å²	139.5	70%	0.696	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.5	-18.2	-178.8	-152.2	-174.8	149.7	0	0	114	E721	E721-E723 PolarHBondContact O-N 2.88Å
724	T	45.5	Very low	50.3	Low	89 Å²	89	137.1 Å²	137.1	55%	0.546	65%	0.648	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.9	-45.7	178.6	46.4	0	0	0	0	111.9	E721 K726 K727	E721-T724 PolarHBondContact O-N 2.9Å; E721-T724 PolarHBondContact O-OG1 2.89Å; E721-T724 VanDerWaalsContact O-OG1 3.04Å; T724-K726 PolarHBondContact O-N 2.97Å; T724-K726 VanDerWaalsContact O-N 3.14Å; T724-K727 PolarHBondContact O-N 2.6Å
725	V	56.3	Low	51.9	Low	83 Å²	83	137.8 Å²	137.8	50%	0.503	65%	0.646	S	S	.	*	H	α-helix	trans	-52.6	-39.2	-176	-176.4	0	0	0	0	112.7	K727 E728 E729	V725-K727 PolarHBondContact O-N 3.06Å; V725-E728 PolarHBondContact O-N 3.1Å; V725-E729 PolarHBondContact O-N 2.88Å
726	K	55.2	Low	53.4	Low	156 Å²	156	137.8 Å²	137.8	68%	0.678	64%	0.637	S	S	*	*	H	α-helix	trans	-66.5	-17.3	-178.4	-77.4	-177	175.7	174.5	0	115	T724	T724-K726 PolarHBondContact O-N 2.97Å; T724-K726 VanDerWaalsContact O-N 3.14Å
727	K	54.1	Low	54.8	Low	145 Å²	145	138.6 Å²	138.6	63%	0.63	64%	0.641	S	S	*	*	H	α-helix	trans	-86.1	-24.7	176.4	-75.9	174.5	177.5	163.2	0	112.6	T724 V725	T724-K727 PolarHBondContact O-N 2.6Å; V725-K727 PolarHBondContact O-N 3.06Å
728	E	58.7	Low	55.5	Low	143 Å²	143	139.8 Å²	139.8	67%	0.668	63%	0.633	S	S	*	*	H	α-helix	trans	-76.7	-39	178.4	-61.7	-177.7	132.1	0	0	110.9	V725 E730 V731 E732	V725-E728 PolarHBondContact O-N 3.1Å; E728-E730 PolarHBondContact O-N 2.91Å; E728-V731 PolarHBondContact O-N 3.33Å; E728-E732 PolarHBondContact O-N 3.3Å; E728-E732 VanDerWaalsContact O-N 3.15Å
729	E	59.4	Low	56.6	Low	116 Å²	116	138.6 Å²	138.6	54%	0.542	63%	0.63	S	S	.	*	H	α-helix	trans	-63.2	-17.4	174	-69.3	-167.3	133.3	0	0	115.3	V725 R733	V725-E729 PolarHBondContact O-N 2.88Å; E729-R733 PolarHBondContact O-NE 2.92Å; E729-R733 PolarHBondContact O-NH2 3.27Å
730	E	58.8	Low	57.3	Low	101 Å²	101	135.6 Å²	135.6	47%	0.472	62%	0.623	S	S	.	*	H	α-helix	trans	-86.7	-37.2	174.5	-156.3	-161.2	124.5	0	0	111.5	E728 R733 K734	E728-E730 PolarHBondContact O-N 2.91Å; E730-R733 PolarHBondContact O-N 3.41Å; E730-K734 PolarHBondContact O-N 3.12Å; E730-K734 IonicContact OE1-NZ 2.63Å; E730-K734 PolarHBondContact OE1-NZ 2.78Å
731	V	64.9	Low	58	Low	92 Å²	92	129 Å²	129	56%	0.558	61%	0.606	S	S	*	*	H	α-helix	trans	-66.7	-41.3	177.9	174.1	0	0	0	0	111.1	E728 R733 K734 R735	E728-V731 PolarHBondContact O-N 3.33Å; V731-R733 VanDerWaalsContact C-N 3.32Å; V731-R733 PolarHBondContact O-N 2.76Å; V731-K734 PolarHBondContact O-N 2.82Å; V731-R735 PolarHBondContact O-N 3.45Å
732	E	67	Low	58.6	Low	109 Å²	109	128.5 Å²	128.5	51%	0.509	60%	0.604	S	S	.	*	H	α-helix	trans	-69.1	-29.9	178.5	-162.9	177.6	123.7	0	0	112.8	E728 K736	E728-E732 PolarHBondContact O-N 3.3Å; E728-E732 VanDerWaalsContact O-N 3.15Å; E732-K736 HydrophobicContact CG-CD 4.47Å; E732-K736 PolarHBondContact O-N 2.75Å; E732-K736 WeakPolarHBondContact OE1-CE 3.35Å; E732-K736 IonicContact OE1-NZ 2.74Å; E732-K736 PolarHBondContact OE1-NZ 3.37Å
733	R	66	Low	58.8	Low	160 Å²	160	124.6 Å²	124.6	60%	0.604	60%	0.595	S	S	*	*	H	α-helix	trans	-63.2	-44.3	174	-103.8	176.5	-73.5	-176.5	-7	112.4	E729 E730 V731 K736 E737	E729-R733 PolarHBondContact O-NE 2.92Å; E729-R733 PolarHBondContact O-NH2 3.27Å; E730-R733 PolarHBondContact O-N 3.41Å; V731-R733 VanDerWaalsContact C-N 3.32Å; V731-R733 PolarHBondContact O-N 2.76Å; R733-K736 PolarHBondContact O-N 3.37Å; R733-E737 PolarHBondContact O-N 2.89Å
734	K	66.1	Low	58.8	Low	117 Å²	117	121.7 Å²	121.7	51%	0.509	59%	0.587	S	S	.	*	H	α-helix	trans	-64	-39.9	179.1	-76.7	165.8	173.3	161.6	0	112.4	E730 V731 K736 E737 E738	E730-K734 PolarHBondContact O-N 3.12Å; E730-K734 IonicContact OE1-NZ 2.63Å; E730-K734 PolarHBondContact OE1-NZ 2.78Å; V731-K734 PolarHBondContact O-N 2.82Å; K734-K736 PolarHBondContact O-N 2.72Å; K734-E737 WeakPolarHBondContact O-CB 3.35Å; K734-E737 PolarHBondContact O-N 2.89Å; K734-E737 VanDerWaalsContact O-N 3.08Å; K734-E738 PolarHBondContact O-N 3.17Å; K734-E738 VanDerWaalsContact O-N 3.07Å
735	R	66.6	Low	58.8	Low	176 Å²	176	127.1 Å²	127.1	66%	0.664	60%	0.598	S	S	*	*	H	α-helix	trans	-57.7	-44.7	172.7	-82.6	-177.3	164.2	170.9	-4.8	113.1	V731 E737 E738 E739	V731-R735 PolarHBondContact O-N 3.45Å; R735-E737 PolarHBondContact O-N 2.8Å; R735-E738 PolarHBondContact O-N 3.2Å; R735-E739 WeakPolarHBondContact O-CB 3.43Å; R735-E739 PolarHBondContact O-N 2.93Å
736	K	65.8	Low	58.4	Low	110 Å²	110	125.2 Å²	125.2	48%	0.478	60%	0.595	S	S	.	*	H	α-helix	trans	-71	-6.5	178.1	-71.4	170.6	175.2	170.1	0	113.9	E732 R733 K734 K740	E732-K736 HydrophobicContact CG-CD 4.47Å; E732-K736 PolarHBondContact O-N 2.75Å; E732-K736 WeakPolarHBondContact OE1-CE 3.35Å; E732-K736 IonicContact OE1-NZ 2.74Å; E732-K736 PolarHBondContact OE1-NZ 3.37Å; R733-K736 PolarHBondContact O-N 3.37Å; K734-K736 PolarHBondContact O-N 2.72Å; K736-K740 WeakPolarHBondContact O-CG 3.33Å
737	E	63.6	Low	58.2	Low	143 Å²	143	124.6 Å²	124.6	67%	0.668	60%	0.595	S	S	*	*	H	α-helix	trans	-95.8	-42.8	173.9	-140.9	163.2	-152.4	0	0	110.8	R733 K734 R735 K740 A741	R733-E737 PolarHBondContact O-N 2.89Å; K734-E737 WeakPolarHBondContact O-CB 3.35Å; K734-E737 PolarHBondContact O-N 2.89Å; K734-E737 VanDerWaalsContact O-N 3.08Å; R735-E737 PolarHBondContact O-N 2.8Å; E737-K740 PolarHBondContact O-N 3.4Å; E737-A741 PolarHBondContact O-N 3.24Å
738	E	58.5	Low	57.7	Low	141 Å²	141	125.7 Å²	125.7	66%	0.659	60%	0.599	S	S	*	*	H	α-helix	trans	-61.9	-43.9	171	-71	-176.4	123.6	0	0	112.3	K734 R735 K740 A741 E742	K734-E738 PolarHBondContact O-N 3.17Å; K734-E738 VanDerWaalsContact O-N 3.07Å; R735-E738 PolarHBondContact O-N 3.2Å; E738-K740 PolarHBondContact O-N 3.23Å; E738-A741 WeakPolarHBondContact O-CB 3.47Å; E738-A741 PolarHBondContact O-N 2.89Å; E738-E742 PolarHBondContact O-N 2.72Å
739	E	59.8	Low	57.3	Low	138 Å²	138	123 Å²	123	65%	0.645	59%	0.593	S	S	*	*	H	α-helix	trans	-59.6	-32.8	178.5	-171.4	173.9	-152.4	0	0	112.5	R735 S743	R735-E739 WeakPolarHBondContact O-CB 3.43Å; R735-E739 PolarHBondContact O-N 2.93Å; E739-S743 PolarHBondContact O-N 2.7Å
740	K	57.7	Low	57	Low	153 Å²	153	123 Å²	123	67%	0.665	59%	0.593	S	S	*	*	H	α-helix	trans	-78.9	-31.7	173.4	-72.9	-178.1	176.9	-176.9	0	113.2	K736 E737 E738 E742 S743	K736-K740 WeakPolarHBondContact O-CG 3.33Å; E737-K740 PolarHBondContact O-N 3.4Å; E738-K740 PolarHBondContact O-N 3.23Å; K740-E742 VanDerWaalsContact C-N 3.29Å; K740-S743 PolarHBondContact O-OG 2.91Å
741	A	54.5	Low	56.8	Low	63 Å²	63	121.4 Å²	121.4	52%	0.521	59%	0.59	S	S	.	*	H	α-helix	trans	-66.1	-35.5	173.6	0	0	0	0	0	111.2	E737 E738 T744	E737-A741 PolarHBondContact O-N 3.24Å; E738-A741 WeakPolarHBondContact O-CB 3.47Å; E738-A741 PolarHBondContact O-N 2.89Å; A741-T744 PolarHBondContact O-OG1 3.18Å
742	E	56.6	Low	56.2	Low	153 Å²	153	123.5 Å²	123.5	72%	0.715	59%	0.592	S	S	*	*	H	α-helix	trans	-72.1	-39.6	-179.9	-165.8	155.3	-137.1	0	0	113	E738 K740 T744 R745	E738-E742 PolarHBondContact O-N 2.72Å; K740-E742 VanDerWaalsContact C-N 3.29Å; E742-T744 PolarHBondContact O-N 3.11Å; E742-R745 WeakPolarHBondContact O-CB 3.28Å; E742-R745 PolarHBondContact O-N 2.85Å; E742-R745 VanDerWaalsContact O-N 3.1Å
743	S	52.2	Low	55.8	Low	80 Å²	80	127.4 Å²	127.4	56%	0.559	60%	0.601	S	S	*	*	H	α-helix	trans	-62	-42	179.6	80.2	0	0	0	0	113	E739 K740 R745 G746	E739-S743 PolarHBondContact O-N 2.7Å; K740-S743 PolarHBondContact O-OG 2.91Å; S743-R745 PolarHBondContact O-N 2.85Å; S743-R745 VanDerWaalsContact O-N 3.13Å; S743-G746 PolarHBondContact O-N 3.41Å; S743-G746 VanDerWaalsContact O-N 3.17Å
744	T	47.5	Very low	55.3	Low	87 Å²	87	125.4 Å²	125.4	53%	0.534	60%	0.597	S	S	.	*	H	α-helix	trans	-65.1	-15.8	178.2	64.2	0	0	0	0	113.6	A741 E742	A741-T744 PolarHBondContact O-OG1 3.18Å; E742-T744 PolarHBondContact O-N 3.11Å
745	R	44.7	Very low	54.7	Low	203 Å²	203	125.4 Å²	125.4	77%	0.766	60%	0.599	S	S	*	*	H	α-helix	trans	-83.5	-25.4	177.5	-161.7	171.5	-173.6	154.2	1.1	113	E742 S743	E742-R745 WeakPolarHBondContact O-CB 3.28Å; E742-R745 PolarHBondContact O-N 2.85Å; E742-R745 VanDerWaalsContact O-N 3.1Å; S743-R745 PolarHBondContact O-N 2.85Å; S743-R745 VanDerWaalsContact O-N 3.13Å
746	G	49.8	Very low	54.3	Low	44 Å²	44	122.9 Å²	122.9	45%	0.454	60%	0.595	S	S	.	*	H	α-helix	trans	-74.4	-44.6	175.5	0	0	0	0	0	112.9	S743 K748 V749 E750	S743-G746 PolarHBondContact O-N 3.41Å; S743-G746 VanDerWaalsContact O-N 3.17Å; G746-K748 VanDerWaalsContact C-N 3.27Å; G746-K748 PolarHBondContact O-N 3.31Å; G746-V749 WeakPolarHBondContact O-CB 3.41Å; G746-V749 PolarHBondContact O-N 2.63Å; G746-E750 PolarHBondContact O-N 2.81Å
747	E	49.3	Very low	54.1	Low	143 Å²	143	122.7 Å²	122.7	67%	0.668	60%	0.596	S	S	*	*	H	α-helix	trans	-57.3	-38.9	-177.5	-168.5	170.9	-153.8	0	0	112.6	V749 E750 T751	E747-V749 PolarHBondContact O-N 3.49Å; E747-E750 PolarHBondContact O-N 2.98Å; E747-T751 PolarHBondContact O-N 2.68Å
748	K	44.6	Very low	53.7	Low	167 Å²	167	119.6 Å²	119.6	73%	0.726	59%	0.587	S	S	*	*	H	α-helix	trans	-73.2	-3.1	178.1	-158	165.4	-174	169.2	0	114.8	G746	G746-K748 VanDerWaalsContact C-N 3.27Å; G746-K748 PolarHBondContact O-N 3.31Å
749	V	49.9	Very low	53.9	Low	88 Å²	88	116.4 Å²	116.4	53%	0.533	58%	0.577	S	S	.	*	H	α-helix	trans	-101.6	-30	173.1	179.7	0	0	0	0	111.2	G746 E747 R753	G746-V749 WeakPolarHBondContact O-CB 3.41Å; G746-V749 PolarHBondContact O-N 2.63Å; E747-V749 PolarHBondContact O-N 3.49Å; V749-R753 PolarHBondContact O-N 3.5Å
750	E	53.8	Low	54.1	Low	116 Å²	116	116.2 Å²	116.2	54%	0.542	57%	0.574	S	S	.	*	H	α-helix	trans	-67.8	-41.1	171.8	-81	-144.5	162.4	0	0	112.9	G746 E747 K752 R753 K754	G746-E750 PolarHBondContact O-N 2.81Å; E747-E750 PolarHBondContact O-N 2.98Å; E750-K752 PolarHBondContact O-N 3Å; E750-R753 PolarHBondContact O-N 3.26Å; E750-R753 VanDerWaalsContact O-N 3.17Å; E750-K754 WeakPolarHBondContact O-CG 3.24Å; E750-K754 PolarHBondContact O-N 3.5Å; E750-K754 WeakPolarHBondContact OE2-CE 3.44Å; E750-K754 IonicContact OE2-NZ 3.21Å; E750-K754 PolarHBondContact OE2-NZ 3.35Å
751	T	53.3	Low	54.4	Low	67 Å²	67	114.4 Å²	114.4	41%	0.411	57%	0.566	S	S	.	*	H	α-helix	trans	-59	-49	-178	50.9	0	0	0	0	111.6	E747 R753 K754 E755	E747-T751 PolarHBondContact O-N 2.68Å; T751-R753 VanDerWaalsContact C-N 3.3Å; T751-R753 PolarHBondContact O-N 3.4Å; T751-K754 PolarHBondContact O-N 3.36Å; T751-K754 VanDerWaalsContact O-N 3.09Å; T751-E755 WeakPolarHBondContact O-CG 3.46Å; T751-E755 PolarHBondContact O-N 3.17Å
752	K	53.3	Low	54.9	Low	136 Å²	136	117.9 Å²	117.9	59%	0.591	57%	0.571	S	S	*	*	H	α-helix	trans	-59.5	-35.7	175.3	-84.1	-160.9	162.1	-139.4	0	114.2	E750 K754 E755 E756	E750-K752 PolarHBondContact O-N 3Å; K752-K754 VanDerWaalsContact C-N 3.35Å; K752-E755 PolarHBondContact O-N 2.8Å; K752-E756 PolarHBondContact O-N 2.85Å
753	R	58	Low	55.4	Low	190 Å²	190	116.9 Å²	116.9	72%	0.717	57%	0.567	S	S	*	*	H	α-helix	trans	-67.2	-36.3	175.3	-93	-177	164.9	174.5	-4.6	112.4	V749 E750 T751 E757	V749-R753 PolarHBondContact O-N 3.5Å; E750-R753 PolarHBondContact O-N 3.26Å; E750-R753 VanDerWaalsContact O-N 3.17Å; T751-R753 VanDerWaalsContact C-N 3.3Å; T751-R753 PolarHBondContact O-N 3.4Å; R753-E757 WeakPolarHBondContact O-CB 3.36Å; R753-E757 PolarHBondContact O-N 3.18Å; R753-E757 VanDerWaalsContact O-N 3.16Å
754	K	55.3	Low	56.1	Low	118 Å²	118	117.1 Å²	117.1	51%	0.513	56%	0.559	S	S	.	*	H	α-helix	trans	-69.9	-40.1	176.4	-68.2	166.7	-170.6	167	0	110.9	E750 T751 K752 E757 T758	E750-K754 WeakPolarHBondContact O-CG 3.24Å; E750-K754 PolarHBondContact O-N 3.5Å; E750-K754 WeakPolarHBondContact OE2-CE 3.44Å; E750-K754 IonicContact OE2-NZ 3.21Å; E750-K754 PolarHBondContact OE2-NZ 3.35Å; T751-K754 PolarHBondContact O-N 3.36Å; T751-K754 VanDerWaalsContact O-N 3.09Å; K752-K754 VanDerWaalsContact C-N 3.35Å; K754-E757 PolarHBondContact O-N 3.03Å; K754-T758 PolarHBondContact O-N 2.69Å; K754-T758 PolarHBondContact O-OG1 2.65Å
755	E	54	Low	57.1	Low	117 Å²	117	116.9 Å²	116.9	55%	0.547	56%	0.557	S	S	.	*	H	α-helix	trans	-60.6	-45.3	172.9	-68.5	169.7	162.8	0	0	112.6	T751 K752 E757 T758 V759	T751-E755 WeakPolarHBondContact O-CG 3.46Å; T751-E755 PolarHBondContact O-N 3.17Å; K752-E755 PolarHBondContact O-N 2.8Å; E755-E757 PolarHBondContact O-N 3.35Å; E755-T758 PolarHBondContact O-N 2.89Å; E755-T758 PolarHBondContact O-OG1 2.9Å; E755-V759 WeakPolarHBondContact O-CG2 3.15Å; E755-V759 PolarHBondContact O-N 3.32Å
756	E	57.8	Low	58.1	Low	123 Å²	123	112.4 Å²	112.4	58%	0.575	55%	0.545	S	S	*	.	H	α-helix	trans	-67.7	-21.4	175.6	-75.9	-176	-176.6	0	0	113.8	K752 K760	K752-E756 PolarHBondContact O-N 2.85Å; E756-K760 WeakPolarHBondContact O-CD 3.42Å
757	E	62.2	Low	59.1	Low	107 Å²	107	116.6 Å²	116.6	50%	0.5	55%	0.547	S	S	.	.	H	α-helix	trans	-86.4	-32	176.6	-156.6	-168.1	134.3	0	0	112.4	R753 K754 E755 K761	R753-E757 WeakPolarHBondContact O-CB 3.36Å; R753-E757 PolarHBondContact O-N 3.18Å; R753-E757 VanDerWaalsContact O-N 3.16Å; K754-E757 PolarHBondContact O-N 3.03Å; E755-E757 PolarHBondContact O-N 3.35Å; E757-K761 WeakPolarHBondContact O-CG 3.38Å; E757-K761 PolarHBondContact O-N 3.48Å; E757-K761 WeakPolarHBondContact OE1-CE 3.38Å; E757-K761 IonicContact OE1-NZ 3.66Å; E757-K761 PolarHBondContact OE1-NZ 2.94Å
758	T	55.7	Low	60.2	Low	78 Å²	78	115 Å²	115	48%	0.479	54%	0.538	S	S	.	.	H	α-helix	trans	-68.6	-45.6	174.6	44.2	0	0	0	0	112	K754 E755 K760 K761 E762	K754-T758 PolarHBondContact O-N 2.69Å; K754-T758 PolarHBondContact O-OG1 2.65Å; E755-T758 PolarHBondContact O-N 2.89Å; E755-T758 PolarHBondContact O-OG1 2.9Å; T758-K760 VanDerWaalsContact C-N 3.29Å; T758-K760 PolarHBondContact O-N 2.73Å; T758-K761 WeakPolarHBondContact O-CB 3.13Å; T758-K761 PolarHBondContact O-N 2.68Å; T758-E762 PolarHBondContact O-N 2.61Å; T758-E762 VanDerWaalsContact O-N 3.11Å
759	V	62.2	Low	61.4	Low	74 Å²	74	115.3 Å²	115.3	45%	0.448	53%	0.534	S	S	.	.	H	α-helix	trans	-58.3	-41.2	-179.9	173.1	0	0	0	0	111.7	E755 K761 E762 E763	E755-V759 WeakPolarHBondContact O-CG2 3.15Å; E755-V759 PolarHBondContact O-N 3.32Å; V759-K761 VanDerWaalsContact C-N 3.28Å; V759-K761 PolarHBondContact O-N 3.36Å; V759-E762 PolarHBondContact O-N 3.47Å; V759-E763 PolarHBondContact O-N 3.08Å
760	K	63.7	Low	62.2	Low	134 Å²	134	115.9 Å²	115.9	58%	0.583	53%	0.53	S	S	*	.	H	α-helix	trans	-65.3	-28.6	177.5	-74.7	172.3	-178.5	157.1	0	113.8	E756 T758 E764	E756-K760 WeakPolarHBondContact O-CD 3.42Å; T758-K760 VanDerWaalsContact C-N 3.29Å; T758-K760 PolarHBondContact O-N 2.73Å; K760-E764 PolarHBondContact O-N 3.14Å
761	K	64.3	Low	62.9	Low	114 Å²	114	115.9 Å²	115.9	50%	0.496	53%	0.53	S	S	.	.	H	α-helix	trans	-76.3	-36.1	175.8	-70.2	171.3	-172.9	170.6	0	111.2	E757 T758 V759 E764 V765	E757-K761 WeakPolarHBondContact O-CG 3.38Å; E757-K761 PolarHBondContact O-N 3.48Å; E757-K761 WeakPolarHBondContact OE1-CE 3.38Å; E757-K761 IonicContact OE1-NZ 3.66Å; E757-K761 PolarHBondContact OE1-NZ 2.94Å; T758-K761 WeakPolarHBondContact O-CB 3.13Å; T758-K761 PolarHBondContact O-N 2.68Å; V759-K761 VanDerWaalsContact C-N 3.28Å; V759-K761 PolarHBondContact O-N 3.36Å; K761-E764 PolarHBondContact O-N 2.85Å; K761-V765 VanDerWaalsContact O-CG2 3.32Å; K761-V765 WeakPolarHBondContact O-CG2 3.48Å; K761-V765 PolarHBondContact O-N 3.41Å
762	E	65	Low	63.5	Low	136 Å²	136	119.2 Å²	119.2	64%	0.636	54%	0.54	S	S	*	.	H	α-helix	trans	-65.6	-45.4	172.9	-66.4	-179.8	140.6	0	0	111.6	T758 V759 E764 V765 E766	T758-E762 PolarHBondContact O-N 2.61Å; T758-E762 VanDerWaalsContact O-N 3.11Å; V759-E762 PolarHBondContact O-N 3.47Å; E762-E764 VanDerWaalsContact C-N 3.3Å; E762-E764 PolarHBondContact O-N 2.9Å; E762-V765 PolarHBondContact O-N 3.42Å; E762-E766 PolarHBondContact O-N 3.01Å
763	E	66.8	Low	64.1	Low	133 Å²	133	118.9 Å²	118.9	62%	0.621	54%	0.541	S	S	*	.	H	α-helix	trans	-59.4	-36.5	173.7	-72.1	-173.5	141.7	0	0	112.9	V759 R767	V759-E763 PolarHBondContact O-N 3.08Å; E763-R767 WeakPolarHBondContact O-CB 3.32Å; E763-R767 PolarHBondContact O-N 3.34Å; E763-R767 VanDerWaalsContact O-N 3.14Å
764	E	66.8	Low	64.4	Low	84 Å²	84	116.6 Å²	116.6	39%	0.393	54%	0.536	S	S	.	.	H	α-helix	trans	-70.7	-39.4	175	-176.4	171.5	161.1	0	0	112.7	K760 K761 E762 R767 K768	K760-E764 PolarHBondContact O-N 3.14Å; K761-E764 PolarHBondContact O-N 2.85Å; E762-E764 VanDerWaalsContact C-N 3.3Å; E762-E764 PolarHBondContact O-N 2.9Å; E764-R767 PolarHBondContact O-N 2.6Å; E764-K768 WeakPolarHBondContact O-CG 2.99Å; E764-K768 PolarHBondContact O-N 3.19Å; E764-K768 WeakPolarHBondContact OE1-CE 3.46Å; E764-K768 IonicContact OE1-NZ 3.93Å; E764-K768 PolarHBondContact OE1-NZ 3.38Å
765	V	67.9	Low	64.9	Low	82 Å²	82	113.7 Å²	113.7	50%	0.497	53%	0.534	S	S	.	.	H	α-helix	trans	-66	-43.9	177.5	167.7	0	0	0	0	111.3	K761 E762 R767 K768 R769	K761-V765 VanDerWaalsContact O-CG2 3.32Å; K761-V765 WeakPolarHBondContact O-CG2 3.48Å; K761-V765 PolarHBondContact O-N 3.41Å; E762-V765 PolarHBondContact O-N 3.42Å; V765-R767 VanDerWaalsContact C-N 3.32Å; V765-R767 PolarHBondContact O-N 3.45Å; V765-K768 PolarHBondContact O-N 3.25Å; V765-R769 PolarHBondContact O-N 2.81Å; V765-R769 VanDerWaalsContact O-N 3.09Å
766	E	65.5	Low	65.3	Low	109 Å²	109	115.1 Å²	115.1	51%	0.509	54%	0.541	S	S	.	.	H	α-helix	trans	-66.9	-34.7	177.4	-166.1	179.9	138.1	0	0	111.9	E762 K770	E762-E766 PolarHBondContact O-N 3.01Å; E766-K770 WeakPolarHBondContact O-CG 3.33Å; E766-K770 PolarHBondContact O-N 3.36Å; E766-K770 VanDerWaalsContact OE1-CE 3.32Å; E766-K770 WeakPolarHBondContact OE1-CE 3.28Å; E766-K770 IonicContact OE1-NZ 2.64Å; E766-K770 PolarHBondContact OE1-NZ 2.66Å
767	R	71.6	Confident	65.3	Low	133 Å²	133	113.1 Å²	113.1	50%	0.502	54%	0.541	S	S	.	.	H	α-helix	trans	-63.7	-41.9	173.6	-177.4	168.1	57.2	81.3	-1.3	112.2	E763 E764 V765 K770 E771	E763-R767 WeakPolarHBondContact O-CB 3.32Å; E763-R767 PolarHBondContact O-N 3.34Å; E763-R767 VanDerWaalsContact O-N 3.14Å; E764-R767 PolarHBondContact O-N 2.6Å; V765-R767 VanDerWaalsContact C-N 3.32Å; V765-R767 PolarHBondContact O-N 3.45Å; R767-K770 PolarHBondContact O-N 3.43Å; R767-E771 PolarHBondContact O-N 2.68Å
768	K	72.2	Confident	65.2	Low	110 Å²	110	112 Å²	112	48%	0.478	54%	0.542	S	S	.	.	H	α-helix	trans	-64.4	-45.2	176.6	-74.4	177.2	-174.6	169.1	0	112	E764 V765 K770 E771 E772	E764-K768 WeakPolarHBondContact O-CG 2.99Å; E764-K768 PolarHBondContact O-N 3.19Å; E764-K768 WeakPolarHBondContact OE1-CE 3.46Å; E764-K768 IonicContact OE1-NZ 3.93Å; E764-K768 PolarHBondContact OE1-NZ 3.38Å; V765-K768 PolarHBondContact O-N 3.25Å; K768-K770 VanDerWaalsContact C-N 3.25Å; K768-K770 PolarHBondContact O-N 2.72Å; K768-E771 PolarHBondContact O-N 3.07Å; K768-E772 WeakPolarHBondContact O-CB 3.5Å; K768-E772 PolarHBondContact O-N 2.82Å
769	R	69.7	Low	65.4	Low	173 Å²	173	116.9 Å²	116.9	65%	0.653	55%	0.551	S	S	*	*	H	α-helix	trans	-53.2	-41.3	174.1	-80.2	-179.2	164.9	173.2	-5.3	112.7	V765 E771 E772 E773	V765-R769 PolarHBondContact O-N 2.81Å; V765-R769 VanDerWaalsContact O-N 3.09Å; R769-E771 VanDerWaalsContact C-N 3.3Å; R769-E771 PolarHBondContact O-N 3.07Å; R769-E772 PolarHBondContact O-N 3.37Å; R769-E773 VanDerWaalsContact O-CB 3.29Å; R769-E773 WeakPolarHBondContact O-CB 3.47Å; R769-E773 PolarHBondContact O-N 3.44Å
770	K	67.3	Low	64.9	Low	99 Å²	99	115.1 Å²	115.1	43%	0.43	55%	0.548	S	S	.	.	H	α-helix	trans	-77.6	-7	179.3	-68.6	175.5	-174.7	172.4	0	115	E766 R767 K768 K774	E766-K770 WeakPolarHBondContact O-CG 3.33Å; E766-K770 PolarHBondContact O-N 3.36Å; E766-K770 VanDerWaalsContact OE1-CE 3.32Å; E766-K770 WeakPolarHBondContact OE1-CE 3.28Å; E766-K770 IonicContact OE1-NZ 2.64Å; E766-K770 PolarHBondContact OE1-NZ 2.66Å; R767-K770 PolarHBondContact O-N 3.43Å; K768-K770 VanDerWaalsContact C-N 3.25Å; K768-K770 PolarHBondContact O-N 2.72Å; K770-K774 VanDerWaalsContact O-CD 3.3Å; K770-K774 WeakPolarHBondContact O-CD 3.31Å; K770-K774 WeakPolarHBondContact O-CE 3.34Å; K770-K774 WeakPolarHBondContact O-CG 3.43Å
771	E	69.2	Low	64.8	Low	117 Å²	117	115.6 Å²	115.6	55%	0.547	55%	0.552	S	S	.	*	H	α-helix	trans	-92.8	-40.1	165.8	-70.6	-177.2	119	0	0	110.5	R767 K768 R769 K774 A775	R767-E771 PolarHBondContact O-N 2.68Å; K768-E771 PolarHBondContact O-N 3.07Å; R769-E771 VanDerWaalsContact C-N 3.3Å; R769-E771 PolarHBondContact O-N 3.07Å; E771-K774 PolarHBondContact O-N 2.76Å; E771-A775 PolarHBondContact O-N 3.29Å
772	E	66	Low	64.3	Low	136 Å²	136	117.4 Å²	117.4	64%	0.636	56%	0.56	S	S	*	*	H	α-helix	trans	-62.3	-48.5	176.6	-168.6	164.2	-134.4	0	0	112.5	K768 R769 K774 A775 E776	K768-E772 WeakPolarHBondContact O-CB 3.5Å; K768-E772 PolarHBondContact O-N 2.82Å; R769-E772 PolarHBondContact O-N 3.37Å; E772-K774 PolarHBondContact O-N 3.2Å; E772-A775 CarbonylContact O-C 3.6Å; E772-A775 WeakPolarHBondContact O-CA 3.37Å; E772-A775 WeakPolarHBondContact O-CB 3.45Å; E772-A775 PolarHBondContact O-N 3.22Å; E772-E776 PolarHBondContact O-N 3.02Å
773	E	64.5	Low	64.2	Low	130 Å²	130	114.7 Å²	114.7	61%	0.607	55%	0.553	S	S	*	*	H	α-helix	trans	-55.5	-35	174.4	-177.3	-177.8	-156.7	0	0	112.7	R769 S777	R769-E773 VanDerWaalsContact O-CB 3.29Å; R769-E773 WeakPolarHBondContact O-CB 3.47Å; R769-E773 PolarHBondContact O-N 3.44Å; E773-S777 WeakPolarHBondContact O-CB 3.46Å; E773-S777 PolarHBondContact O-N 2.9Å
774	K	64.8	Low	63.8	Low	142 Å²	142	113.2 Å²	113.2	62%	0.617	55%	0.546	S	S	*	.	H	α-helix	trans	-78.2	-36.1	176	-69	175.5	-174.2	161.4	0	112.6	K770 E771 E772 E776 T778	K770-K774 VanDerWaalsContact O-CD 3.3Å; K770-K774 WeakPolarHBondContact O-CD 3.31Å; K770-K774 WeakPolarHBondContact O-CE 3.34Å; K770-K774 WeakPolarHBondContact O-CG 3.43Å; E771-K774 PolarHBondContact O-N 2.76Å; E772-K774 PolarHBondContact O-N 3.2Å; K774-E776 VanDerWaalsContact C-N 3.32Å; K774-T778 WeakPolarHBondContact O-CG2 3.43Å; K774-T778 PolarHBondContact O-N 3.38Å; K774-T778 VanDerWaalsContact O-N 3.07Å; K774-T778 PolarHBondContact O-OG1 3.04Å
775	A	65.3	Low	63.7	Low	57 Å²	57	112.3 Å²	112.3	47%	0.471	55%	0.549	S	S	.	.	H	α-helix	trans	-64.4	-40.7	172.7	0	0	0	0	0	110.6	E771 E772 T778 R779	E771-A775 PolarHBondContact O-N 3.29Å; E772-A775 CarbonylContact O-C 3.6Å; E772-A775 WeakPolarHBondContact O-CA 3.37Å; E772-A775 WeakPolarHBondContact O-CB 3.45Å; E772-A775 PolarHBondContact O-N 3.22Å; A775-T778 PolarHBondContact O-OG1 3.41Å; A775-R779 VanDerWaalsContact O-CB 3.23Å; A775-R779 WeakPolarHBondContact O-CB 3.16Å; A775-R779 PolarHBondContact O-N 3.5Å
776	E	63.4	Low	63.5	Low	146 Å²	146	115 Å²	115	68%	0.682	55%	0.554	S	S	*	*	H	α-helix	trans	-66.4	-46.8	175.1	-172.5	168.1	-148.3	0	0	112	E772 K774 T778 R779 G780	E772-E776 PolarHBondContact O-N 3.02Å; K774-E776 VanDerWaalsContact C-N 3.32Å; E776-T778 PolarHBondContact O-N 3.07Å; E776-R779 CarbonylContact O-C 3.54Å; E776-R779 WeakPolarHBondContact O-CA 3.23Å; E776-R779 WeakPolarHBondContact O-CB 3.38Å; E776-R779 PolarHBondContact O-N 3.36Å; E776-R779 VanDerWaalsContact O-N 3.08Å; E776-G780 PolarHBondContact O-N 2.87Å
777	S	58.2	Low	63.5	Low	81 Å²	81	118.8 Å²	118.8	57%	0.566	56%	0.563	S	S	*	*	H	α-helix	trans	-52.7	-51.9	174.3	171.7	0	0	0	0	112.6	E773 R779 G780 E781	E773-S777 WeakPolarHBondContact O-CB 3.46Å; E773-S777 PolarHBondContact O-N 2.9Å; S777-R779 VanDerWaalsContact C-N 3.28Å; S777-R779 PolarHBondContact O-N 3.49Å; S777-G780 PolarHBondContact O-N 3.24Å; S777-E781 PolarHBondContact O-N 2.93Å
778	T	58.4	Low	63	Low	85 Å²	85	118 Å²	118	52%	0.521	56%	0.563	S	S	.	*	H	α-helix	trans	-69.7	-24	178.7	55.4	0	0	0	0	113.3	K774 A775 E776 K782	K774-T778 WeakPolarHBondContact O-CG2 3.43Å; K774-T778 PolarHBondContact O-N 3.38Å; K774-T778 VanDerWaalsContact O-N 3.07Å; K774-T778 PolarHBondContact O-OG1 3.04Å; A775-T778 PolarHBondContact O-OG1 3.41Å; E776-T778 PolarHBondContact O-N 3.07Å; T778-K782 WeakPolarHBondContact O-CB 3.2Å; T778-K782 PolarHBondContact O-N 3.07Å
779	R	61.5	Low	62.6	Low	180 Å²	180	118.9 Å²	118.9	68%	0.679	57%	0.569	S	S	*	*	H	α-helix	trans	-74	-40.8	171.8	-166.2	177.6	-161.9	147.1	5.5	111.4	A775 E776 S777 K782 V783	A775-R779 VanDerWaalsContact O-CB 3.23Å; A775-R779 WeakPolarHBondContact O-CB 3.16Å; A775-R779 PolarHBondContact O-N 3.5Å; E776-R779 CarbonylContact O-C 3.54Å; E776-R779 WeakPolarHBondContact O-CA 3.23Å; E776-R779 WeakPolarHBondContact O-CB 3.38Å; E776-R779 PolarHBondContact O-N 3.36Å; E776-R779 VanDerWaalsContact O-N 3.08Å; S777-R779 VanDerWaalsContact C-N 3.28Å; S777-R779 PolarHBondContact O-N 3.49Å; R779-K782 PolarHBondContact O-N 2.95Å; R779-V783 WeakPolarHBondContact O-CG2 3.42Å; R779-V783 PolarHBondContact O-N 2.77Å
780	G	51.7	Low	62.4	Low	37 Å²	37	116.1 Å²	116.1	38%	0.381	56%	0.564	S	S	.	*	H	α-helix	trans	-59	-53.1	173.9	0	0	0	0	0	111.8	E776 S777 K782 V783 E784	E776-G780 PolarHBondContact O-N 2.87Å; S777-G780 PolarHBondContact O-N 3.24Å; G780-K782 PolarHBondContact O-N 3.08Å; G780-V783 PolarHBondContact O-N 3.47Å; G780-E784 WeakPolarHBondContact O-CB 3.49Å; G780-E784 PolarHBondContact O-N 3.26Å
781	E	60.4	Low	62.4	Low	143 Å²	143	116 Å²	116	67%	0.668	57%	0.565	S	S	*	*	H	α-helix	trans	-56.7	-36.2	177.9	-166.2	177.9	-145.2	0	0	112.3	S777 S785	S777-E781 PolarHBondContact O-N 2.93Å; E781-S785 WeakPolarHBondContact O-CB 3.49Å; E781-S785 PolarHBondContact O-N 3.35Å; E781-S785 PolarHBondContact O-OG 2.74Å
782	K	54.9	Low	62	Low	152 Å²	152	114.2 Å²	114.2	66%	0.661	56%	0.562	S	S	*	*	H	α-helix	trans	-77.2	-22.3	176.6	-166.2	169.6	-175	174.3	0	114.6	T778 R779 G780 S785	T778-K782 WeakPolarHBondContact O-CB 3.2Å; T778-K782 PolarHBondContact O-N 3.07Å; R779-K782 PolarHBondContact O-N 2.95Å; G780-K782 PolarHBondContact O-N 3.08Å; K782-S785 WeakPolarHBondContact CA-OG 3.36Å; K782-S785 PolarHBondContact O-OG 3.02Å
783	V	63.3	Low	62.3	Low	80 Å²	80	111.3 Å²	111.3	49%	0.485	55%	0.554	S	S	.	*	H	α-helix	trans	-83.7	-39.8	171.6	168.1	0	0	0	0	110.5	R779 G780 K786 R787	R779-V783 WeakPolarHBondContact O-CG2 3.42Å; R779-V783 PolarHBondContact O-N 2.77Å; G780-V783 PolarHBondContact O-N 3.47Å; V783-K786 PolarHBondContact O-N 2.84Å; V783-R787 PolarHBondContact O-N 2.81Å
784	E	58.1	Low	62.6	Low	102 Å²	102	110.4 Å²	110.4	48%	0.477	55%	0.547	S	S	.	.	H	α-helix	trans	-69.6	-40.6	-178.9	-160.3	-170.5	133.6	0	0	112.2	G780 K786 R787 K788	G780-E784 WeakPolarHBondContact O-CB 3.49Å; G780-E784 PolarHBondContact O-N 3.26Å; E784-K786 PolarHBondContact O-N 3.32Å; E784-R787 PolarHBondContact O-N 2.83Å; E784-K788 HydrophobicContact CG-CD 4.45Å; E784-K788 WeakPolarHBondContact O-CB 3.44Å; E784-K788 WeakPolarHBondContact O-CG 3.48Å; E784-K788 PolarHBondContact O-N 3.43Å; E784-K788 VanDerWaalsContact OE1-CE 3.29Å; E784-K788 WeakPolarHBondContact OE1-CE 3.07Å; E784-K788 IonicContact OE1-NZ 2.65Å; E784-K788 PolarHBondContact OE1-NZ 3.17Å
785	S	63.1	Low	62.7	Low	65 Å²	65	109.2 Å²	109.2	46%	0.455	54%	0.542	S	S	.	.	H	α-helix	trans	-58.6	-45	171.1	45	0	0	0	0	112.1	E781 K782 K788 E789	E781-S785 WeakPolarHBondContact O-CB 3.49Å; E781-S785 PolarHBondContact O-N 3.35Å; E781-S785 PolarHBondContact O-OG 2.74Å; K782-S785 WeakPolarHBondContact CA-OG 3.36Å; K782-S785 PolarHBondContact O-OG 3.02Å; S785-K788 PolarHBondContact O-N 3.43Å; S785-E789 WeakPolarHBondContact O-CB 3.33Å; S785-E789 PolarHBondContact O-N 3.13Å
786	K	63.6	Low	62.9	Low	138 Å²	138	113.3 Å²	113.3	60%	0.6	55%	0.552	S	S	*	*	H	α-helix	trans	-63.7	-39	173	-83.1	-166.7	165.6	-156.6	0	113.8	V783 E784 E789 E790	V783-K786 PolarHBondContact O-N 2.84Å; E784-K786 PolarHBondContact O-N 3.32Å; K786-E789 PolarHBondContact O-N 2.78Å; K786-E790 PolarHBondContact O-N 2.82Å
787	R	66.9	Low	63.4	Low	189 Å²	189	112 Å²	112	71%	0.713	55%	0.546	S	S	*	.	H	α-helix	trans	-61.9	-45.1	174.4	-96.5	-175.5	168.7	173.4	-2.5	111.1	V783 E784 E789 E790 E791	V783-R787 PolarHBondContact O-N 2.81Å; E784-R787 PolarHBondContact O-N 2.83Å; R787-E789 VanDerWaalsContact C-N 3.34Å; R787-E789 PolarHBondContact O-N 3.44Å; R787-E790 PolarHBondContact O-N 3.35Å; R787-E791 VanDerWaalsContact O-CB 3.28Å; R787-E791 WeakPolarHBondContact O-CB 3.38Å; R787-E791 PolarHBondContact O-N 3Å
788	K	59.7	Low	63.9	Low	116 Å²	116	112.1 Å²	112.1	50%	0.504	54%	0.537	S	S	.	.	H	α-helix	trans	-61.6	-41.9	176.1	-75.8	166.4	170.2	169.8	0	111.6	E784 S785 E791 T792	E784-K788 HydrophobicContact CG-CD 4.45Å; E784-K788 WeakPolarHBondContact O-CB 3.44Å; E784-K788 WeakPolarHBondContact O-CG 3.48Å; E784-K788 PolarHBondContact O-N 3.43Å; E784-K788 VanDerWaalsContact OE1-CE 3.29Å; E784-K788 WeakPolarHBondContact OE1-CE 3.07Å; E784-K788 IonicContact OE1-NZ 2.65Å; E784-K788 PolarHBondContact OE1-NZ 3.17Å; S785-K788 PolarHBondContact O-N 3.43Å; K788-E791 PolarHBondContact O-N 3.1Å; K788-T792 WeakPolarHBondContact O-CG2 3.39Å; K788-T792 PolarHBondContact O-N 3.14Å; K788-T792 PolarHBondContact O-OG1 3.07Å; K788-T792 VanDerWaalsContact O-OG1 3.08Å
789	E	64.3	Low	64.5	Low	128 Å²	128	111.8 Å²	111.8	60%	0.598	54%	0.535	S	S	*	.	H	α-helix	trans	-62.3	-50	175.5	-165.4	170.3	-140	0	0	111.8	S785 K786 R787 E791 T792 V793	S785-E789 WeakPolarHBondContact O-CB 3.33Å; S785-E789 PolarHBondContact O-N 3.13Å; K786-E789 PolarHBondContact O-N 2.78Å; R787-E789 VanDerWaalsContact C-N 3.34Å; R787-E789 PolarHBondContact O-N 3.44Å; E789-E791 VanDerWaalsContact C-N 3.34Å; E789-E791 PolarHBondContact O-N 3.15Å; E789-T792 WeakPolarHBondContact CA-OG1 3.27Å; E789-T792 PolarHBondContact O-N 2.83Å; E789-T792 PolarHBondContact O-OG1 2.98Å; E789-V793 WeakPolarHBondContact O-CG2 3.44Å; E789-V793 PolarHBondContact O-N 2.99Å; E789-V793 VanDerWaalsContact O-N 3.08Å
790	E	66.6	Low	65	Low	116 Å²	116	108.5 Å²	108.5	54%	0.542	53%	0.527	S	S	.	.	H	α-helix	trans	-60.2	-39.4	173.1	-87.2	-163.6	-153.9	0	0	113.4	K786 R787 V793 K794	K786-E790 PolarHBondContact O-N 2.82Å; R787-E790 PolarHBondContact O-N 3.35Å; E790-V793 PolarHBondContact O-N 2.7Å; E790-K794 WeakPolarHBondContact O-CB 3.29Å; E790-K794 WeakPolarHBondContact O-CD 3.36Å; E790-K794 WeakPolarHBondContact O-CG 3.43Å; E790-K794 PolarHBondContact O-N 3.34Å; E790-K794 IonicContact OE2-NZ 3.4Å; E790-K794 PolarHBondContact OE2-NZ 3.47Å
791	E	66.3	Low	66.2	Low	95 Å²	95	113.6 Å²	113.6	44%	0.444	54%	0.535	S	S	.	.	H	α-helix	trans	-69	-37.5	179.9	-162	-167.2	149.6	0	0	111.3	R787 K788 E789 K794 K795	R787-E791 VanDerWaalsContact O-CB 3.28Å; R787-E791 WeakPolarHBondContact O-CB 3.38Å; R787-E791 PolarHBondContact O-N 3Å; K788-E791 PolarHBondContact O-N 3.1Å; E789-E791 VanDerWaalsContact C-N 3.34Å; E789-E791 PolarHBondContact O-N 3.15Å; E791-K794 PolarHBondContact O-N 2.58Å; E791-K795 HydrophobicContact CG-CD 4.35Å; E791-K795 WeakPolarHBondContact O-CB 3.49Å; E791-K795 WeakPolarHBondContact O-CG 3.46Å; E791-K795 PolarHBondContact O-N 2.88Å; E791-K795 VanDerWaalsContact OE1-CE 3.28Å; E791-K795 WeakPolarHBondContact OE1-CE 3.18Å; E791-K795 IonicContact OE1-NZ 2.58Å; E791-K795 PolarHBondContact OE1-NZ 3.42Å
792	T	62	Low	66.7	Low	81 Å²	81	112.3 Å²	112.3	50%	0.497	53%	0.527	S	S	.	.	H	α-helix	trans	-63	-45.2	171.8	45.8	0	0	0	0	112	K788 E789 K794 K795 E796	K788-T792 WeakPolarHBondContact O-CG2 3.39Å; K788-T792 PolarHBondContact O-N 3.14Å; K788-T792 PolarHBondContact O-OG1 3.07Å; K788-T792 VanDerWaalsContact O-OG1 3.08Å; E789-T792 WeakPolarHBondContact CA-OG1 3.27Å; E789-T792 PolarHBondContact O-N 2.83Å; E789-T792 PolarHBondContact O-OG1 2.98Å; T792-K794 PolarHBondContact O-N 2.61Å; T792-K795 PolarHBondContact O-N 3.18Å; T792-E796 PolarHBondContact O-N 2.82Å
793	V	71	Confident	67.5	Low	75 Å²	75	113.3 Å²	113.3	46%	0.455	53%	0.527	S	S	.	.	H	α-helix	trans	-61.7	-44.9	176.7	173.5	0	0	0	0	111.2	E789 E790 K795 E796 E797	E789-V793 WeakPolarHBondContact O-CG2 3.44Å; E789-V793 PolarHBondContact O-N 2.99Å; E789-V793 VanDerWaalsContact O-N 3.08Å; E790-V793 PolarHBondContact O-N 2.7Å; V793-K795 VanDerWaalsContact C-N 3.32Å; V793-K795 PolarHBondContact O-N 3.47Å; V793-E796 PolarHBondContact O-N 3.06Å; V793-E797 PolarHBondContact O-N 3.2Å
794	K	71.1	Confident	67.9	Low	110 Å²	110	114.3 Å²	114.3	48%	0.478	53%	0.525	S	S	.	.	H	α-helix	trans	-62.6	-37.4	176.9	-75.3	161.9	179.9	160.4	0	112.3	E790 E791 T792 E798	E790-K794 WeakPolarHBondContact O-CB 3.29Å; E790-K794 WeakPolarHBondContact O-CD 3.36Å; E790-K794 WeakPolarHBondContact O-CG 3.43Å; E790-K794 PolarHBondContact O-N 3.34Å; E790-K794 IonicContact OE2-NZ 3.4Å; E790-K794 PolarHBondContact OE2-NZ 3.47Å; E791-K794 PolarHBondContact O-N 2.58Å; T792-K794 PolarHBondContact O-N 2.61Å; K794-E798 WeakPolarHBondContact O-CB 3.24Å; K794-E798 PolarHBondContact O-N 2.93Å
795	K	66.9	Low	68.5	Low	117 Å²	117	116 Å²	116	51%	0.509	53%	0.533	S	S	.	.	H	α-helix	trans	-68.1	-40.4	174.3	-79.9	170.2	168.4	170.1	0	112.2	E791 T792 V793 E798 V799	E791-K795 HydrophobicContact CG-CD 4.35Å; E791-K795 WeakPolarHBondContact O-CB 3.49Å; E791-K795 WeakPolarHBondContact O-CG 3.46Å; E791-K795 PolarHBondContact O-N 2.88Å; E791-K795 VanDerWaalsContact OE1-CE 3.28Å; E791-K795 WeakPolarHBondContact OE1-CE 3.18Å; E791-K795 IonicContact OE1-NZ 2.58Å; E791-K795 PolarHBondContact OE1-NZ 3.42Å; T792-K795 PolarHBondContact O-N 3.18Å; V793-K795 VanDerWaalsContact C-N 3.32Å; V793-K795 PolarHBondContact O-N 3.47Å; K795-E798 PolarHBondContact O-N 3.41Å; K795-V799 WeakPolarHBondContact O-CB 3.39Å; K795-V799 VanDerWaalsContact O-CG2 3.28Å; K795-V799 WeakPolarHBondContact O-CG2 3.38Å; K795-V799 PolarHBondContact O-N 2.65Å
796	E	70.1	Confident	68.7	Low	144 Å²	144	119 Å²	119	67%	0.673	54%	0.539	S	S	*	.	H	α-helix	trans	-65.2	-44	174.1	-71.3	-172.2	151.5	0	0	111.8	T792 V793 E798 V799 E800	T792-E796 PolarHBondContact O-N 2.82Å; V793-E796 PolarHBondContact O-N 3.06Å; E796-E798 VanDerWaalsContact C-N 3.3Å; E796-E798 PolarHBondContact O-N 2.82Å; E796-V799 PolarHBondContact O-N 2.96Å; E796-E800 WeakPolarHBondContact O-CB 3.48Å; E796-E800 PolarHBondContact O-N 2.81Å
797	E	72.6	Confident	68.8	Low	118 Å²	118	119.1 Å²	119.1	55%	0.551	54%	0.542	S	S	*	.	H	α-helix	trans	-64.2	-30.4	174.1	-74.4	-166.8	149.7	0	0	113.6	V793 R801	V793-E797 PolarHBondContact O-N 3.2Å; E797-R801 WeakPolarHBondContact O-CB 3.36Å; E797-R801 WeakPolarHBondContact O-CG 3.3Å; E797-R801 PolarHBondContact O-N 3.31Å; E797-R801 VanDerWaalsContact O-N 3.15Å; E797-R801 PolarHBondContact O-NE 3.07Å
798	E	69.8	Low	68.8	Low	84 Å²	84	117.1 Å²	117.1	39%	0.393	54%	0.539	S	S	.	.	H	α-helix	trans	-75.9	-41.8	173.6	-163.9	-174.7	133.3	0	0	111.9	K794 K795 E796 R801 K802	K794-E798 WeakPolarHBondContact O-CB 3.24Å; K794-E798 PolarHBondContact O-N 2.93Å; K795-E798 PolarHBondContact O-N 3.41Å; E796-E798 VanDerWaalsContact C-N 3.3Å; E796-E798 PolarHBondContact O-N 2.82Å; E798-R801 PolarHBondContact O-N 2.82Å; E798-K802 HydrophobicContact CG-CD 4.34Å; E798-K802 WeakPolarHBondContact O-CB 3.25Å; E798-K802 WeakPolarHBondContact O-CG 3.4Å; E798-K802 PolarHBondContact O-N 3.05Å; E798-K802 VanDerWaalsContact OE1-CE 3.25Å; E798-K802 WeakPolarHBondContact OE1-CE 3.49Å; E798-K802 IonicContact OE1-NZ 2.64Å; E798-K802 PolarHBondContact OE1-NZ 3.2Å
799	V	71.4	Confident	68.7	Low	78 Å²	78	114 Å²	114	47%	0.473	54%	0.535	S	S	.	.	H	α-helix	trans	-63.6	-39.7	174.9	167.5	0	0	0	0	111.2	K795 E796 K802 R803	K795-V799 WeakPolarHBondContact O-CB 3.39Å; K795-V799 VanDerWaalsContact O-CG2 3.28Å; K795-V799 WeakPolarHBondContact O-CG2 3.38Å; K795-V799 PolarHBondContact O-N 2.65Å; E796-V799 PolarHBondContact O-N 2.96Å; V799-K802 PolarHBondContact O-N 3.24Å; V799-R803 WeakPolarHBondContact O-CB 3.4Å; V799-R803 WeakPolarHBondContact O-CG 3.4Å; V799-R803 PolarHBondContact O-N 3.38Å
800	E	72	Confident	68.4	Low	110 Å²	110	114.4 Å²	114.4	51%	0.514	54%	0.536	S	S	.	.	H	α-helix	trans	-72.2	-33.2	176.5	-166.7	172.4	140.7	0	0	112.4	E796 K804	E796-E800 WeakPolarHBondContact O-CB 3.48Å; E796-E800 PolarHBondContact O-N 2.81Å; E800-K804 HydrophobicContact CG-CD 4.31Å; E800-K804 WeakPolarHBondContact O-CB 3.23Å; E800-K804 VanDerWaalsContact O-CG 3.3Å; E800-K804 WeakPolarHBondContact O-CG 3.25Å; E800-K804 PolarHBondContact O-N 3.35Å; E800-K804 VanDerWaalsContact OE1-CE 3.23Å; E800-K804 WeakPolarHBondContact OE1-CE 3.38Å; E800-K804 IonicContact OE1-NZ 2.86Å; E800-K804 PolarHBondContact OE1-NZ 3.32Å
801	R	76.1	Confident	67.8	Low	145 Å²	145	111.1 Å²	111.1	55%	0.547	53%	0.534	S	S	.	.	H	α-helix	trans	-63.9	-49.6	168.7	-84.5	178.1	-70.2	150.8	-1.6	111.7	E797 E798 R803 K804 E805	E797-R801 WeakPolarHBondContact O-CB 3.36Å; E797-R801 WeakPolarHBondContact O-CG 3.3Å; E797-R801 PolarHBondContact O-N 3.31Å; E797-R801 VanDerWaalsContact O-N 3.15Å; E797-R801 PolarHBondContact O-NE 3.07Å; E798-R801 PolarHBondContact O-N 2.82Å; R801-R803 PolarHBondContact O-N 2.93Å; R801-K804 CarbonylContact O-C 3.48Å; R801-K804 PolarHBondContact O-N 3.08Å; R801-E805 PolarHBondContact O-N 3.4Å
802	K	71.6	Confident	67.3	Low	116 Å²	116	110.9 Å²	110.9	50%	0.504	54%	0.539	S	S	.	.	H	α-helix	trans	-58.1	-45	177.6	-78.3	173.8	171.8	170.4	0	111.4	E798 V799 K804 E805 E806	E798-K802 HydrophobicContact CG-CD 4.34Å; E798-K802 WeakPolarHBondContact O-CB 3.25Å; E798-K802 WeakPolarHBondContact O-CG 3.4Å; E798-K802 PolarHBondContact O-N 3.05Å; E798-K802 VanDerWaalsContact OE1-CE 3.25Å; E798-K802 WeakPolarHBondContact OE1-CE 3.49Å; E798-K802 IonicContact OE1-NZ 2.64Å; E798-K802 PolarHBondContact OE1-NZ 3.2Å; V799-K802 PolarHBondContact O-N 3.24Å; K802-K804 VanDerWaalsContact C-N 3.35Å; K802-K804 PolarHBondContact O-N 3.37Å; K802-E805 PolarHBondContact O-N 3.47Å; K802-E806 VanDerWaalsContact O-CB 3.24Å; K802-E806 WeakPolarHBondContact O-CB 3.44Å; K802-E806 PolarHBondContact O-N 3Å
803	R	71.5	Confident	66.7	Low	172 Å²	172	115.5 Å²	115.5	65%	0.649	55%	0.547	S	S	*	.	H	α-helix	trans	-57.2	-42.9	171.9	-80.4	178.6	168.2	169.7	-1.9	113.1	V799 R801 E805 E806 E807	V799-R803 WeakPolarHBondContact O-CB 3.4Å; V799-R803 WeakPolarHBondContact O-CG 3.4Å; V799-R803 PolarHBondContact O-N 3.38Å; R801-R803 PolarHBondContact O-N 2.93Å; R803-E805 VanDerWaalsContact C-N 3.32Å; R803-E805 PolarHBondContact O-N 3.04Å; R803-E806 PolarHBondContact O-N 3.17Å; R803-E807 VanDerWaalsContact O-CB 3.25Å; R803-E807 WeakPolarHBondContact O-CB 3.31Å; R803-E807 PolarHBondContact O-N 3.44Å
804	K	71	Confident	65.8	Low	101 Å²	101	113.8 Å²	113.8	44%	0.439	55%	0.545	S	S	.	.	H	α-helix	trans	-75.1	-16.1	179.1	-72.6	171.3	-175.4	169.5	0	114.4	E800 R801 K802 K808	E800-K804 HydrophobicContact CG-CD 4.31Å; E800-K804 WeakPolarHBondContact O-CB 3.23Å; E800-K804 VanDerWaalsContact O-CG 3.3Å; E800-K804 WeakPolarHBondContact O-CG 3.25Å; E800-K804 PolarHBondContact O-N 3.35Å; E800-K804 VanDerWaalsContact OE1-CE 3.23Å; E800-K804 WeakPolarHBondContact OE1-CE 3.38Å; E800-K804 IonicContact OE1-NZ 2.86Å; E800-K804 PolarHBondContact OE1-NZ 3.32Å; R801-K804 CarbonylContact O-C 3.48Å; R801-K804 PolarHBondContact O-N 3.08Å; K802-K804 VanDerWaalsContact C-N 3.35Å; K802-K804 PolarHBondContact O-N 3.37Å; K804-K808 WeakPolarHBondContact O-CD 3.27Å; K804-K808 VanDerWaalsContact O-CE 3.26Å; K804-K808 WeakPolarHBondContact O-CE 3.38Å; K804-K808 VanDerWaalsContact O-CG 3.29Å; K804-K808 WeakPolarHBondContact O-CG 3.36Å
805	E	70.8	Confident	65.1	Low	138 Å²	138	115.2 Å²	115.2	65%	0.645	55%	0.553	S	S	*	*	H	α-helix	trans	-87.2	-41.3	167.2	-71.3	-169.7	127.9	0	0	111.2	R801 K802 R803 K808 A809	R801-E805 PolarHBondContact O-N 3.4Å; K802-E805 PolarHBondContact O-N 3.47Å; R803-E805 VanDerWaalsContact C-N 3.32Å; R803-E805 PolarHBondContact O-N 3.04Å; E805-K808 PolarHBondContact O-N 3.35Å; E805-A809 WeakPolarHBondContact O-CB 3.41Å; E805-A809 PolarHBondContact O-N 3.49Å
806	E	66.4	Low	64.6	Low	127 Å²	127	117 Å²	117	59%	0.593	56%	0.561	S	S	*	*	H	α-helix	trans	-63.8	-42.1	177.2	-170.6	165.4	-136.7	0	0	111.7	K802 R803 K808 A809 E810	K802-E806 VanDerWaalsContact O-CB 3.24Å; K802-E806 WeakPolarHBondContact O-CB 3.44Å; K802-E806 PolarHBondContact O-N 3Å; R803-E806 PolarHBondContact O-N 3.17Å; E806-K808 VanDerWaalsContact C-N 3.31Å; E806-K808 PolarHBondContact O-N 3.01Å; E806-A809 CarbonylContact O-C 3.51Å; E806-A809 WeakPolarHBondContact O-CB 3.34Å; E806-A809 PolarHBondContact O-N 2.82Å; E806-A809 VanDerWaalsContact O-N 3.15Å; E806-E810 WeakPolarHBondContact O-CB 3.29Å; E806-E810 WeakPolarHBondContact O-CG 3.5Å; E806-E810 PolarHBondContact O-N 3.33Å
807	E	66.6	Low	64	Low	142 Å²	142	113.7 Å²	113.7	66%	0.664	55%	0.55	S	S	*	*	H	α-helix	trans	-62	-35.5	173.9	-174.3	177.9	-151.5	0	0	112.3	R803 G811	R803-E807 VanDerWaalsContact O-CB 3.25Å; R803-E807 WeakPolarHBondContact O-CB 3.31Å; R803-E807 PolarHBondContact O-N 3.44Å; E807-G811 PolarHBondContact O-N 2.78Å
808	K	66.6	Low	63.5	Low	147 Å²	147	113.5 Å²	113.5	64%	0.639	55%	0.55	S	S	*	.	H	α-helix	trans	-74.9	-35.9	173.6	-67.6	171.3	-168.9	162.8	0	112.1	K804 E805 E806 G811 T812	K804-K808 WeakPolarHBondContact O-CD 3.27Å; K804-K808 VanDerWaalsContact O-CE 3.26Å; K804-K808 WeakPolarHBondContact O-CE 3.38Å; K804-K808 VanDerWaalsContact O-CG 3.29Å; K804-K808 WeakPolarHBondContact O-CG 3.36Å; E805-K808 PolarHBondContact O-N 3.35Å; E806-K808 VanDerWaalsContact C-N 3.31Å; E806-K808 PolarHBondContact O-N 3.01Å; K808-G811 PolarHBondContact O-N 3.33Å; K808-T812 PolarHBondContact O-N 3.43Å; K808-T812 PolarHBondContact O-OG1 3.41Å
809	A	58.9	Low	63.2	Low	51 Å²	51	112.7 Å²	112.7	42%	0.421	55%	0.551	S	S	.	*	H	α-helix	trans	-66.9	-40	173.7	0	0	0	0	0	110.7	E805 E806 T812 R813	E805-A809 WeakPolarHBondContact O-CB 3.41Å; E805-A809 PolarHBondContact O-N 3.49Å; E806-A809 CarbonylContact O-C 3.51Å; E806-A809 WeakPolarHBondContact O-CB 3.34Å; E806-A809 PolarHBondContact O-N 2.82Å; E806-A809 VanDerWaalsContact O-N 3.15Å; A809-T812 PolarHBondContact O-OG1 3.2Å; A809-R813 WeakPolarHBondContact O-CA 3.48Å; A809-R813 WeakPolarHBondContact O-CB 3.33Å; A809-R813 PolarHBondContact O-N 3.38Å
810	E	57.6	Low	62.8	Low	135 Å²	135	114.2 Å²	114.2	63%	0.631	55%	0.551	S	S	*	*	H	α-helix	trans	-67.2	-41	172.9	-74.5	-145.2	118.9	0	0	112.1	E806 R813 G814	E806-E810 WeakPolarHBondContact O-CB 3.29Å; E806-E810 WeakPolarHBondContact O-CG 3.5Å; E806-E810 PolarHBondContact O-N 3.33Å; E810-R813 PolarHBondContact O-N 2.92Å; E810-G814 WeakPolarHBondContact O-CA 3.43Å; E810-G814 PolarHBondContact O-N 3.41Å
811	G	53.7	Low	62.6	Low	48 Å²	48	117.5 Å²	117.5	50%	0.495	56%	0.559	S	S	.	*	H	α-helix	trans	-58.1	-51.8	173.6	0	0	0	0	0	112.4	E807 K808 G814 E815	E807-G811 PolarHBondContact O-N 2.78Å; K808-G811 PolarHBondContact O-N 3.33Å; G811-G814 PolarHBondContact O-N 2.9Å; G811-E815 PolarHBondContact O-N 3.33Å; G811-E815 VanDerWaalsContact O-N 3.09Å
812	T	55.5	Low	62.1	Low	90 Å²	90	116 Å²	116	55%	0.552	56%	0.556	S	S	*	*	H	α-helix	trans	-70.6	-32	178.6	52.2	0	0	0	0	113.2	K808 A809 K816	K808-T812 PolarHBondContact O-N 3.43Å; K808-T812 PolarHBondContact O-OG1 3.41Å; A809-T812 PolarHBondContact O-OG1 3.2Å; T812-K816 VanDerWaalsContact O-CB 3.26Å; T812-K816 WeakPolarHBondContact O-CB 3.35Å; T812-K816 PolarHBondContact O-N 2.65Å
813	R	49.5	Very low	62.1	Low	178 Å²	178	116 Å²	116	67%	0.672	56%	0.557	S	S	*	*	H	α-helix	trans	-70.9	-35.1	172.6	-173.7	178.4	-169.2	171.4	2.9	111.6	A809 E810 K816 V817	A809-R813 WeakPolarHBondContact O-CA 3.48Å; A809-R813 WeakPolarHBondContact O-CB 3.33Å; A809-R813 PolarHBondContact O-N 3.38Å; E810-R813 PolarHBondContact O-N 2.92Å; R813-K816 CarbonylContact O-C 3.54Å; R813-K816 PolarHBondContact O-N 2.83Å; R813-V817 HydrophobicContact CG-CG2 4.39Å; R813-V817 VanDerWaalsContact O-CB 3.28Å; R813-V817 WeakPolarHBondContact O-CB 3.38Å; R813-V817 WeakPolarHBondContact O-CG2 3.34Å; R813-V817 PolarHBondContact O-N 3.21Å
814	G	51.7	Low	61.9	Low	39 Å²	39	113 Å²	113	40%	0.402	55%	0.551	S	S	.	*	H	α-helix	trans	-62.6	-50	173.6	0	0	0	0	0	111.2	E810 G811 K816 V817 E818	E810-G814 WeakPolarHBondContact O-CA 3.43Å; E810-G814 PolarHBondContact O-N 3.41Å; G811-G814 PolarHBondContact O-N 2.9Å; G814-K816 VanDerWaalsContact C-N 3.32Å; G814-K816 PolarHBondContact O-N 3.04Å; G814-V817 PolarHBondContact O-N 2.98Å; G814-E818 WeakPolarHBondContact O-CB 3.36Å; G814-E818 PolarHBondContact O-N 3.3Å
815	E	57.2	Low	61.9	Low	139 Å²	139	113.4 Å²	113.4	65%	0.65	56%	0.555	S	S	*	*	H	α-helix	trans	-60.3	-41.2	174	-170.7	172.2	-152.1	0	0	111.9	G811 V817 E818 T819	G811-E815 PolarHBondContact O-N 3.33Å; G811-E815 VanDerWaalsContact O-N 3.09Å; E815-V817 PolarHBondContact O-N 2.99Å; E815-E818 PolarHBondContact O-N 2.97Å; E815-T819 WeakPolarHBondContact O-CG2 3.44Å; E815-T819 PolarHBondContact O-N 3.15Å; E815-T819 PolarHBondContact O-OG1 2.95Å
816	K	55.5	Low	61.8	Low	154 Å²	154	110.5 Å²	110.5	67%	0.67	55%	0.546	S	S	*	.	H	α-helix	trans	-71.2	-25.1	176.6	-163.4	166.3	-173.8	173.6	0	114.2	T812 R813 G814 T819 K820	T812-K816 VanDerWaalsContact O-CB 3.26Å; T812-K816 WeakPolarHBondContact O-CB 3.35Å; T812-K816 PolarHBondContact O-N 2.65Å; R813-K816 CarbonylContact O-C 3.54Å; R813-K816 PolarHBondContact O-N 2.83Å; G814-K816 VanDerWaalsContact C-N 3.32Å; G814-K816 PolarHBondContact O-N 3.04Å; K816-T819 VanDerWaalsContact CA-OG1 3.29Å; K816-T819 WeakPolarHBondContact CA-OG1 3.3Å; K816-T819 PolarHBondContact O-OG1 2.79Å; K816-T819 VanDerWaalsContact O-OG1 3.14Å; K816-K820 WeakPolarHBondContact O-CB 3.32Å; K816-K820 PolarHBondContact O-N 3.09Å
817	V	58.4	Low	62.2	Low	75 Å²	75	108.2 Å²	108.2	46%	0.455	54%	0.541	S	S	.	.	H	α-helix	trans	-83.5	-36.2	173.7	164.8	0	0	0	0	111.1	R813 G814 E815 K820 R821	R813-V817 HydrophobicContact CG-CG2 4.39Å; R813-V817 VanDerWaalsContact O-CB 3.28Å; R813-V817 WeakPolarHBondContact O-CB 3.38Å; R813-V817 WeakPolarHBondContact O-CG2 3.34Å; R813-V817 PolarHBondContact O-N 3.21Å; G814-V817 PolarHBondContact O-N 2.98Å; E815-V817 PolarHBondContact O-N 2.99Å; V817-K820 PolarHBondContact O-N 3.39Å; V817-R821 WeakPolarHBondContact O-CB 3.4Å; V817-R821 PolarHBondContact O-N 3.46Å
818	E	61.1	Low	62.6	Low	115 Å²	115	107.2 Å²	107.2	54%	0.537	53%	0.534	S	S	.	.	H	α-helix	trans	-71.8	-35.4	177.5	-152.7	-164	-125	0	0	111.9	G814 E815 K822	G814-E818 WeakPolarHBondContact O-CB 3.36Å; G814-E818 PolarHBondContact O-N 3.3Å; E815-E818 PolarHBondContact O-N 2.97Å; E818-K822 WeakPolarHBondContact O-CD 3.34Å; E818-K822 VanDerWaalsContact O-CG 3.3Å; E818-K822 WeakPolarHBondContact O-CG 3.31Å; E818-K822 PolarHBondContact O-N 2.75Å; E818-K822 VanDerWaalsContact O-N 3.15Å; E818-K822 WeakPolarHBondContact OE2-CE 3.5Å; E818-K822 IonicContact OE2-NZ 2.59Å; E818-K822 PolarHBondContact OE2-NZ 2.81Å
819	T	63.4	Low	63	Low	67 Å²	67	105.4 Å²	105.4	41%	0.411	53%	0.526	S	S	.	.	H	α-helix	trans	-63.8	-50.5	168.6	42.4	0	0	0	0	111.4	E815 K816 R821 K822 E823	E815-T819 WeakPolarHBondContact O-CG2 3.44Å; E815-T819 PolarHBondContact O-N 3.15Å; E815-T819 PolarHBondContact O-OG1 2.95Å; K816-T819 VanDerWaalsContact CA-OG1 3.29Å; K816-T819 WeakPolarHBondContact CA-OG1 3.3Å; K816-T819 PolarHBondContact O-OG1 2.79Å; K816-T819 VanDerWaalsContact O-OG1 3.14Å; T819-R821 VanDerWaalsContact C-N 3.29Å; T819-R821 PolarHBondContact O-N 3.22Å; T819-K822 WeakPolarHBondContact O-CB 3.46Å; T819-K822 PolarHBondContact O-N 3.36Å; T819-E823 PolarHBondContact O-N 3.26Å
820	K	63.1	Low	63.9	Low	109 Å²	109	109.5 Å²	109.5	47%	0.474	54%	0.537	S	S	.	.	H	α-helix	trans	-57.2	-38.2	175	-116.7	177.9	155.8	-71.4	0	113.8	K816 V817 K822 E823 E824	K816-K820 WeakPolarHBondContact O-CB 3.32Å; K816-K820 PolarHBondContact O-N 3.09Å; V817-K820 PolarHBondContact O-N 3.39Å; K820-K822 VanDerWaalsContact C-N 3.35Å; K820-E823 PolarHBondContact O-N 3.4Å; K820-E824 IonicContact NZ-OE1 2.73Å; K820-E824 PolarHBondContact NZ-OE1 3.44Å; K820-E824 WeakPolarHBondContact O-CB 3.48Å; K820-E824 WeakPolarHBondContact O-CG 3.41Å; K820-E824 PolarHBondContact O-N 2.92Å
821	R	69	Low	64.7	Low	180 Å²	180	109.2 Å²	109.2	68%	0.679	54%	0.535	S	S	*	.	H	α-helix	trans	-63	-39.3	174	-94.2	-176.3	163.1	175.9	-3.7	112.6	V817 T819 E825	V817-R821 WeakPolarHBondContact O-CB 3.4Å; V817-R821 PolarHBondContact O-N 3.46Å; T819-R821 VanDerWaalsContact C-N 3.29Å; T819-R821 PolarHBondContact O-N 3.22Å; R821-E825 VanDerWaalsContact O-CB 3.31Å; R821-E825 WeakPolarHBondContact O-CB 3.32Å; R821-E825 PolarHBondContact O-N 2.82Å
822	K	65.8	Low	65.9	Low	112 Å²	112	111.1 Å²	111.1	49%	0.487	53%	0.532	S	S	.	.	H	α-helix	trans	-67.7	-39.2	176.1	-69.1	161.6	-169.6	167.3	0	111	E818 T819 K820 E825 T826	E818-K822 WeakPolarHBondContact O-CD 3.34Å; E818-K822 VanDerWaalsContact O-CG 3.3Å; E818-K822 WeakPolarHBondContact O-CG 3.31Å; E818-K822 PolarHBondContact O-N 2.75Å; E818-K822 VanDerWaalsContact O-N 3.15Å; E818-K822 WeakPolarHBondContact OE2-CE 3.5Å; E818-K822 IonicContact OE2-NZ 2.59Å; E818-K822 PolarHBondContact OE2-NZ 2.81Å; T819-K822 WeakPolarHBondContact O-CB 3.46Å; T819-K822 PolarHBondContact O-N 3.36Å; K820-K822 VanDerWaalsContact C-N 3.35Å; K822-E825 PolarHBondContact O-N 3.44Å; K822-T826 PolarHBondContact O-N 3.29Å; K822-T826 PolarHBondContact O-OG1 2.95Å
823	E	70	Confident	67	Low	116 Å²	116	111.3 Å²	111.3	54%	0.542	53%	0.526	S	S	.	.	H	α-helix	trans	-62.1	-51.7	172.8	-68.1	173.8	163.6	0	0	111.4	T819 K820 E825 T826 V827	T819-E823 PolarHBondContact O-N 3.26Å; K820-E823 PolarHBondContact O-N 3.4Å; E823-E825 VanDerWaalsContact C-N 3.34Å; E823-E825 PolarHBondContact O-N 2.63Å; E823-T826 WeakPolarHBondContact CA-OG1 3.19Å; E823-T826 PolarHBondContact O-N 2.58Å; E823-T826 VanDerWaalsContact O-N 3.11Å; E823-T826 PolarHBondContact O-OG1 2.57Å; E823-V827 WeakPolarHBondContact O-CG2 3.11Å; E823-V827 PolarHBondContact O-N 3.3Å
824	E	68.3	Low	68.5	Low	111 Å²	111	106.4 Å²	106.4	52%	0.519	52%	0.516	S	S	.	.	H	α-helix	trans	-60.7	-37.9	177.2	-73.7	168.3	-168.1	0	0	112.4	K820 K828	K820-E824 IonicContact NZ-OE1 2.73Å; K820-E824 PolarHBondContact NZ-OE1 3.44Å; K820-E824 WeakPolarHBondContact O-CB 3.48Å; K820-E824 WeakPolarHBondContact O-CG 3.41Å; K820-E824 PolarHBondContact O-N 2.92Å; E824-K828 WeakPolarHBondContact O-CB 3.5Å; E824-K828 PolarHBondContact O-N 3.09Å
825	E	71.3	Confident	69.7	Low	109 Å²	109	109.4 Å²	109.4	51%	0.509	52%	0.519	S	S	.	.	H	α-helix	trans	-71.7	-28.8	175.2	-156.8	-162.9	142.3	0	0	112.8	R821 K822 E823 K829	R821-E825 VanDerWaalsContact O-CB 3.31Å; R821-E825 WeakPolarHBondContact O-CB 3.32Å; R821-E825 PolarHBondContact O-N 2.82Å; K822-E825 PolarHBondContact O-N 3.44Å; E823-E825 VanDerWaalsContact C-N 3.34Å; E823-E825 PolarHBondContact O-N 2.63Å; E825-K829 WeakPolarHBondContact O-CD 3.48Å; E825-K829 VanDerWaalsContact O-CG 3.31Å; E825-K829 WeakPolarHBondContact O-CG 3.3Å; E825-K829 PolarHBondContact O-N 3.31Å; E825-K829 VanDerWaalsContact OE1-CE 3.29Å; E825-K829 WeakPolarHBondContact OE1-CE 3.49Å; E825-K829 IonicContact OE1-NZ 2.62Å; E825-K829 PolarHBondContact OE1-NZ 3.23Å
826	T	69.3	Low	70.8	Confident	77 Å²	77	109.3 Å²	109.3	47%	0.472	51%	0.513	S	S	.	.	H	α-helix	trans	-74.5	-47.2	171.6	45.2	0	0	0	0	112.5	K822 E823 K828 K829 E830	K822-T826 PolarHBondContact O-N 3.29Å; K822-T826 PolarHBondContact O-OG1 2.95Å; E823-T826 WeakPolarHBondContact CA-OG1 3.19Å; E823-T826 PolarHBondContact O-N 2.58Å; E823-T826 VanDerWaalsContact O-N 3.11Å; E823-T826 PolarHBondContact O-OG1 2.57Å; T826-K828 VanDerWaalsContact C-N 3.3Å; T826-K828 PolarHBondContact O-N 2.99Å; T826-K829 WeakPolarHBondContact O-CB 3.23Å; T826-K829 PolarHBondContact O-N 3.33Å; T826-E830 PolarHBondContact O-N 3.34Å
827	V	73.5	Confident	72.1	Confident	79 Å²	79	107.4 Å²	107.4	48%	0.479	51%	0.505	S	S	.	.	H	α-helix	trans	-56.4	-45.7	176.1	170.6	0	0	0	0	110.5	E823 K829 E830 E831	E823-V827 WeakPolarHBondContact O-CG2 3.11Å; E823-V827 PolarHBondContact O-N 3.3Å; V827-K829 VanDerWaalsContact C-N 3.3Å; V827-K829 PolarHBondContact O-N 3.06Å; V827-E830 PolarHBondContact O-N 3.46Å; V827-E830 VanDerWaalsContact O-N 3.12Å; V827-E831 HydrophobicContact CG1-CG 4.48Å; V827-E831 PolarHBondContact O-N 2.92Å
828	K	74.6	Confident	73.1	Confident	121 Å²	121	112.1 Å²	112.1	53%	0.526	51%	0.514	S	S	.	.	H	α-helix	trans	-61.2	-35.6	177.7	-175.6	173.3	177.1	-178.5	0	113.3	E824 T826 E831 E832	E824-K828 WeakPolarHBondContact O-CB 3.5Å; E824-K828 PolarHBondContact O-N 3.09Å; T826-K828 VanDerWaalsContact C-N 3.3Å; T826-K828 PolarHBondContact O-N 2.99Å; K828-E831 PolarHBondContact O-N 3.04Å; K828-E832 WeakPolarHBondContact CE-OE1 3.35Å; K828-E832 WeakPolarHBondContact O-CB 3.21Å; K828-E832 WeakPolarHBondContact O-CG 3.49Å; K828-E832 PolarHBondContact O-N 3.38Å
829	K	75.6	Confident	73.9	Confident	108 Å²	108	110.9 Å²	110.9	47%	0.47	51%	0.507	S	S	.	.	H	α-helix	trans	-69.4	-36.3	175.6	-75.6	167.4	-171.3	163.1	0	112.1	E825 T826 V827 E833	E825-K829 WeakPolarHBondContact O-CD 3.48Å; E825-K829 VanDerWaalsContact O-CG 3.31Å; E825-K829 WeakPolarHBondContact O-CG 3.3Å; E825-K829 PolarHBondContact O-N 3.31Å; E825-K829 VanDerWaalsContact OE1-CE 3.29Å; E825-K829 WeakPolarHBondContact OE1-CE 3.49Å; E825-K829 IonicContact OE1-NZ 2.62Å; E825-K829 PolarHBondContact OE1-NZ 3.23Å; T826-K829 WeakPolarHBondContact O-CB 3.23Å; T826-K829 PolarHBondContact O-N 3.33Å; V827-K829 VanDerWaalsContact C-N 3.3Å; V827-K829 PolarHBondContact O-N 3.06Å; K829-E833 WeakPolarHBondContact O-CB 3.46Å; K829-E833 PolarHBondContact O-N 3.35Å
830	E	77.7	Confident	74.7	Confident	137 Å²	137	114.3 Å²	114.3	64%	0.64	52%	0.519	S	S	*	.	H	α-helix	trans	-67.2	-43	173.7	-67.2	-172.8	161.2	0	0	111.4	T826 V827 E833 V834	T826-E830 PolarHBondContact O-N 3.34Å; V827-E830 PolarHBondContact O-N 3.46Å; V827-E830 VanDerWaalsContact O-N 3.12Å; E830-E833 PolarHBondContact O-N 3.22Å; E830-E833 VanDerWaalsContact O-N 3.17Å; E830-V834 WeakPolarHBondContact O-CG2 3.33Å; E830-V834 PolarHBondContact O-N 2.94Å
831	E	74.1	Confident	75.4	Confident	129 Å²	129	116 Å²	116	60%	0.603	53%	0.528	S	S	*	.	H	α-helix	trans	-59.8	-47.2	173	-70.9	-172.5	139.3	0	0	112.2	V827 K828 E833 V834 E835	V827-E831 HydrophobicContact CG1-CG 4.48Å; V827-E831 PolarHBondContact O-N 2.92Å; K828-E831 PolarHBondContact O-N 3.04Å; E831-E833 PolarHBondContact O-N 2.75Å; E831-V834 PolarHBondContact O-N 2.85Å; E831-E835 WeakPolarHBondContact O-CB 3.17Å; E831-E835 PolarHBondContact O-N 3.28Å
832	E	78.8	Confident	75.7	Confident	89 Å²	89	113.8 Å²	113.8	42%	0.416	53%	0.526	S	S	.	.	H	α-helix	trans	-63.9	-23.8	176.1	-76.7	-178.1	-163.6	0	0	113.3	K828 R836	K828-E832 WeakPolarHBondContact CE-OE1 3.35Å; K828-E832 WeakPolarHBondContact O-CB 3.21Å; K828-E832 WeakPolarHBondContact O-CG 3.49Å; K828-E832 PolarHBondContact O-N 3.38Å; E832-R836 PolarHBondContact O-N 3.11Å; E832-R836 PolarHBondContact O-NE 2.78Å; E832-R836 PolarHBondContact O-NH2 2.75Å
833	E	79.8	Confident	76.2	Confident	94 Å²	94	115.3 Å²	115.3	44%	0.439	53%	0.532	S	S	.	.	H	α-helix	trans	-83	-40.1	173.3	-168.1	178.1	131.8	0	0	112	K829 E830 E831 R836 K837	K829-E833 WeakPolarHBondContact O-CB 3.46Å; K829-E833 PolarHBondContact O-N 3.35Å; E830-E833 PolarHBondContact O-N 3.22Å; E830-E833 VanDerWaalsContact O-N 3.17Å; E831-E833 PolarHBondContact O-N 2.75Å; E833-R836 PolarHBondContact O-N 3.01Å; E833-K837 WeakPolarHBondContact O-CG 3.08Å; E833-K837 PolarHBondContact O-N 2.63Å; E833-K837 WeakPolarHBondContact OE1-CE 3.49Å; E833-K837 IonicContact OE1-NZ 2.62Å; E833-K837 PolarHBondContact OE1-NZ 3.01Å
834	V	80.1	Confident	76.6	Confident	74 Å²	74	112.5 Å²	112.5	45%	0.448	53%	0.529	S	S	.	.	H	α-helix	trans	-63.2	-41.7	174	169.5	0	0	0	0	111.1	E830 E831 K837 R838	E830-V834 WeakPolarHBondContact O-CG2 3.33Å; E830-V834 PolarHBondContact O-N 2.94Å; E831-V834 PolarHBondContact O-N 2.85Å; V834-K837 PolarHBondContact O-N 3.08Å; V834-R838 PolarHBondContact O-N 3.4Å
835	E	76.3	Confident	76.9	Confident	102 Å²	102	114.2 Å²	114.2	48%	0.477	54%	0.537	S	S	.	.	H	α-helix	trans	-66.4	-37.1	176.5	-154.7	-153.9	-173.4	0	0	111.8	E831 R838 K839	E831-E835 WeakPolarHBondContact O-CB 3.17Å; E831-E835 PolarHBondContact O-N 3.28Å; E835-R838 PolarHBondContact O-N 3.48Å; E835-K839 HydrophobicContact CG-CD 4.46Å; E835-K839 WeakPolarHBondContact O-CB 3.49Å; E835-K839 WeakPolarHBondContact O-CG 3.37Å; E835-K839 PolarHBondContact O-N 3.18Å; E835-K839 WeakPolarHBondContact OE1-CE 3.47Å; E835-K839 IonicContact OE1-NZ 2.6Å; E835-K839 PolarHBondContact OE1-NZ 3.18Å; E835-K839 IonicContact OE2-NZ 3.4Å; E835-K839 PolarHBondContact OE2-NZ 2.68Å
836	R	81.6	Confident	76.8	Confident	137 Å²	137	112.9 Å²	112.9	52%	0.517	54%	0.539	S	S	.	.	H	α-helix	trans	-61.2	-48.1	171.8	-95.6	174.7	-78.6	161.2	-6.9	111.9	E832 E833 R838 K839 E840	E832-R836 PolarHBondContact O-N 3.11Å; E832-R836 PolarHBondContact O-NE 2.78Å; E832-R836 PolarHBondContact O-NH2 2.75Å; E833-R836 PolarHBondContact O-N 3.01Å; R836-R838 PolarHBondContact O-N 3.33Å; R836-K839 PolarHBondContact O-N 3.14Å; R836-K839 VanDerWaalsContact O-N 3.17Å; R836-E840 PolarHBondContact O-N 3.42Å
837	K	81.9	Confident	77	Confident	114 Å²	114	113.1 Å²	113.1	50%	0.496	54%	0.541	S	S	.	.	H	α-helix	trans	-59.8	-44.1	178.2	-72.8	169.2	-175.1	165.1	0	111.8	E833 V834 K839 E840 E841	E833-K837 WeakPolarHBondContact O-CG 3.08Å; E833-K837 PolarHBondContact O-N 2.63Å; E833-K837 WeakPolarHBondContact OE1-CE 3.49Å; E833-K837 IonicContact OE1-NZ 2.62Å; E833-K837 PolarHBondContact OE1-NZ 3.01Å; V834-K837 PolarHBondContact O-N 3.08Å; K837-K839 PolarHBondContact O-N 2.99Å; K837-E840 PolarHBondContact O-N 3.23Å; K837-E841 WeakPolarHBondContact O-CB 3.48Å; K837-E841 PolarHBondContact O-N 3.15Å
838	R	79.9	Confident	77	Confident	174 Å²	174	118.3 Å²	118.3	66%	0.657	55%	0.552	S	S	*	*	H	α-helix	trans	-58	-45.3	173.4	-75.4	-178.9	174.3	174.9	0.5	112.5	V834 E835 R836 E840 E841 E842	V834-R838 PolarHBondContact O-N 3.4Å; E835-R838 PolarHBondContact O-N 3.48Å; R836-R838 PolarHBondContact O-N 3.33Å; R838-E840 VanDerWaalsContact C-N 3.25Å; R838-E840 PolarHBondContact O-N 3.34Å; R838-E841 PolarHBondContact O-N 2.76Å; R838-E842 WeakPolarHBondContact O-CB 3.49Å; R838-E842 PolarHBondContact O-N 3.17Å
839	K	78.1	Confident	76.7	Confident	90 Å²	90	114.5 Å²	114.5	39%	0.391	55%	0.547	S	S	.	.	H	α-helix	trans	-69.7	-16.5	178.4	-73.2	170.3	179.8	168.2	0	114.1	E835 R836 K837 K843	E835-K839 HydrophobicContact CG-CD 4.46Å; E835-K839 WeakPolarHBondContact O-CB 3.49Å; E835-K839 WeakPolarHBondContact O-CG 3.37Å; E835-K839 PolarHBondContact O-N 3.18Å; E835-K839 WeakPolarHBondContact OE1-CE 3.47Å; E835-K839 IonicContact OE1-NZ 2.6Å; E835-K839 PolarHBondContact OE1-NZ 3.18Å; E835-K839 IonicContact OE2-NZ 3.4Å; E835-K839 PolarHBondContact OE2-NZ 2.68Å; R836-K839 PolarHBondContact O-N 3.14Å; R836-K839 VanDerWaalsContact O-N 3.17Å; K837-K839 PolarHBondContact O-N 2.99Å; K839-K843 VanDerWaalsContact O-CD 3.27Å; K839-K843 WeakPolarHBondContact O-CD 3.5Å; K839-K843 WeakPolarHBondContact O-CE 3.24Å; K839-K843 VanDerWaalsContact O-CG 3.31Å; K839-K843 WeakPolarHBondContact O-CG 3.49Å
840	E	80.6	Confident	76.6	Confident	139 Å²	139	115.8 Å²	115.8	65%	0.65	55%	0.554	S	S	*	*	H	α-helix	trans	-86.4	-41	169.3	-71.3	-176	158.2	0	0	111.5	R836 K837 R838 K843 A844	R836-E840 PolarHBondContact O-N 3.42Å; K837-E840 PolarHBondContact O-N 3.23Å; R838-E840 VanDerWaalsContact C-N 3.25Å; R838-E840 PolarHBondContact O-N 3.34Å; E840-K843 PolarHBondContact O-N 3.4Å; E840-A844 PolarHBondContact O-N 3.06Å
841	E	77.8	Confident	76.3	Confident	143 Å²	143	116.4 Å²	116.4	67%	0.668	56%	0.555	S	S	*	*	H	α-helix	trans	-64.1	-43.9	176.7	-170.3	163	-142.9	0	0	112.1	K837 R838 K843 A844 E845	K837-E841 WeakPolarHBondContact O-CB 3.48Å; K837-E841 PolarHBondContact O-N 3.15Å; R838-E841 PolarHBondContact O-N 2.76Å; E841-K843 VanDerWaalsContact C-N 3.3Å; E841-K843 PolarHBondContact O-N 2.73Å; E841-A844 CarbonylContact O-C 3.57Å; E841-A844 WeakPolarHBondContact O-CB 3.42Å; E841-A844 PolarHBondContact O-N 3.09Å; E841-A844 VanDerWaalsContact O-N 3.08Å; E841-E845 PolarHBondContact O-N 2.65Å
842	E	74.4	Confident	76.2	Confident	135 Å²	135	113.8 Å²	113.8	63%	0.631	55%	0.547	S	S	*	.	H	α-helix	trans	-58.8	-38.3	174.5	-175.3	-179.7	-161.2	0	0	112.3	R838 E845 S846	R838-E842 WeakPolarHBondContact O-CB 3.49Å; R838-E842 PolarHBondContact O-N 3.17Å; E842-E845 PolarHBondContact O-N 2.73Å; E842-S846 VanDerWaalsContact O-CB 3.3Å; E842-S846 WeakPolarHBondContact O-CB 3.47Å; E842-S846 PolarHBondContact O-N 3.42Å
843	K	77.2	Confident	75.8	Confident	143 Å²	143	114.3 Å²	114.3	62%	0.622	55%	0.55	S	S	*	.	H	α-helix	trans	-71.8	-36.6	174.4	-71.3	173.1	-172.5	168.4	0	112.3	K839 E840 E841 E845 T847	K839-K843 VanDerWaalsContact O-CD 3.27Å; K839-K843 WeakPolarHBondContact O-CD 3.5Å; K839-K843 WeakPolarHBondContact O-CE 3.24Å; K839-K843 VanDerWaalsContact O-CG 3.31Å; K839-K843 WeakPolarHBondContact O-CG 3.49Å; E840-K843 PolarHBondContact O-N 3.4Å; E841-K843 VanDerWaalsContact C-N 3.3Å; E841-K843 PolarHBondContact O-N 2.73Å; K843-E845 VanDerWaalsContact C-N 3.33Å; K843-T847 WeakPolarHBondContact O-CB 3.18Å; K843-T847 WeakPolarHBondContact O-CG2 3.25Å; K843-T847 PolarHBondContact O-N 3.16Å; K843-T847 PolarHBondContact O-OG1 3.35Å
844	A	76.8	Confident	75.5	Confident	57 Å²	57	112.8 Å²	112.8	47%	0.471	55%	0.55	S	S	.	.	H	α-helix	trans	-66.7	-36.1	174.5	0	0	0	0	0	111.5	E840 E841 T847 R848	E840-A844 PolarHBondContact O-N 3.06Å; E841-A844 CarbonylContact O-C 3.57Å; E841-A844 WeakPolarHBondContact O-CB 3.42Å; E841-A844 PolarHBondContact O-N 3.09Å; E841-A844 VanDerWaalsContact O-N 3.08Å; A844-T847 PolarHBondContact O-OG1 3.32Å; A844-R848 WeakPolarHBondContact O-CB 2.99Å; A844-R848 PolarHBondContact O-N 3Å; A844-R848 VanDerWaalsContact O-N 3.13Å
845	E	74.5	Confident	75.4	Confident	148 Å²	148	114.8 Å²	114.8	69%	0.692	55%	0.552	S	S	*	*	H	α-helix	trans	-72.1	-45.5	174.1	-174.8	157.9	-134.4	0	0	112	E841 E842 K843 T847 R848 G849	E841-E845 PolarHBondContact O-N 2.65Å; E842-E845 PolarHBondContact O-N 2.73Å; K843-E845 VanDerWaalsContact C-N 3.33Å; E845-T847 PolarHBondContact O-N 3.24Å; E845-R848 CarbonylContact O-C 3.56Å; E845-R848 WeakPolarHBondContact O-CA 3.47Å; E845-R848 WeakPolarHBondContact O-CB 3.26Å; E845-R848 PolarHBondContact O-N 2.94Å; E845-R848 VanDerWaalsContact O-N 3.1Å; E845-G849 PolarHBondContact O-N 2.99Å
846	S	70.4	Confident	75.4	Confident	80 Å²	80	118.3 Å²	118.3	56%	0.559	56%	0.561	S	S	*	*	H	α-helix	trans	-54.4	-52.2	175.1	175.4	0	0	0	0	112.4	E842 R848 G849 E850	E842-S846 VanDerWaalsContact O-CB 3.3Å; E842-S846 WeakPolarHBondContact O-CB 3.47Å; E842-S846 PolarHBondContact O-N 3.42Å; S846-R848 VanDerWaalsContact C-N 3.27Å; S846-R848 PolarHBondContact O-N 3.2Å; S846-G849 PolarHBondContact O-N 2.76Å; S846-G849 VanDerWaalsContact O-N 3.14Å; S846-E850 PolarHBondContact O-N 2.71Å
847	T	72.4	Confident	75.1	Confident	83 Å²	83	117.4 Å²	117.4	51%	0.509	56%	0.561	S	S	.	*	H	α-helix	trans	-67.5	-25.4	178	53.1	0	0	0	0	113.1	K843 A844 E845 K851	K843-T847 WeakPolarHBondContact O-CB 3.18Å; K843-T847 WeakPolarHBondContact O-CG2 3.25Å; K843-T847 PolarHBondContact O-N 3.16Å; K843-T847 PolarHBondContact O-OG1 3.35Å; A844-T847 PolarHBondContact O-OG1 3.32Å; E845-T847 PolarHBondContact O-N 3.24Å; T847-K851 VanDerWaalsContact O-CB 3.28Å; T847-K851 WeakPolarHBondContact O-CB 3.34Å; T847-K851 PolarHBondContact O-N 3.27Å
848	R	74.5	Confident	75	Confident	188 Å²	188	118 Å²	118	71%	0.709	57%	0.566	S	S	*	*	H	α-helix	trans	-73.9	-37.9	171.5	-172.7	177.3	-171.9	168.9	0.9	111.8	A844 E845 S846 K851 V852	A844-R848 WeakPolarHBondContact O-CB 2.99Å; A844-R848 PolarHBondContact O-N 3Å; A844-R848 VanDerWaalsContact O-N 3.13Å; E845-R848 CarbonylContact O-C 3.56Å; E845-R848 WeakPolarHBondContact O-CA 3.47Å; E845-R848 WeakPolarHBondContact O-CB 3.26Å; E845-R848 PolarHBondContact O-N 2.94Å; E845-R848 VanDerWaalsContact O-N 3.1Å; S846-R848 VanDerWaalsContact C-N 3.27Å; S846-R848 PolarHBondContact O-N 3.2Å; R848-K851 PolarHBondContact O-N 3.29Å; R848-V852 WeakPolarHBondContact O-CG2 3.49Å; R848-V852 PolarHBondContact O-N 2.82Å; R848-V852 VanDerWaalsContact O-N 3.07Å
849	G	67.7	Low	74.9	Confident	40 Å²	40	115.9 Å²	115.9	41%	0.412	56%	0.563	S	S	.	*	H	α-helix	trans	-61.7	-52.3	173.5	0	0	0	0	0	111.9	E845 S846 K851 V852 E853	E845-G849 PolarHBondContact O-N 2.99Å; S846-G849 PolarHBondContact O-N 2.76Å; S846-G849 VanDerWaalsContact O-N 3.14Å; G849-K851 PolarHBondContact O-N 3.21Å; G849-V852 WeakPolarHBondContact O-CA 3.34Å; G849-V852 PolarHBondContact O-N 3.39Å; G849-E853 PolarHBondContact O-N 2.83Å
850	E	73.6	Confident	74.8	Confident	136 Å²	136	116.5 Å²	116.5	64%	0.636	57%	0.567	S	S	*	*	H	α-helix	trans	-57.3	-37.4	176.5	-170.2	178.7	-147.2	0	0	112	S846 V852 E853 S854	S846-E850 PolarHBondContact O-N 2.71Å; E850-V852 VanDerWaalsContact C-N 3.35Å; E850-V852 PolarHBondContact O-N 3.35Å; E850-E853 PolarHBondContact O-N 3.24Å; E850-S854 WeakPolarHBondContact O-CB 3.31Å; E850-S854 PolarHBondContact O-N 2.86Å; E850-S854 PolarHBondContact O-OG 2.82Å
851	K	71.2	Confident	74.7	Confident	149 Å²	149	113.6 Å²	113.6	65%	0.648	56%	0.56	S	S	*	*	H	α-helix	trans	-73.1	-20	175.4	-167.1	166	-173.7	170.6	0	114.6	T847 R848 G849 S854	T847-K851 VanDerWaalsContact O-CB 3.28Å; T847-K851 WeakPolarHBondContact O-CB 3.34Å; T847-K851 PolarHBondContact O-N 3.27Å; R848-K851 PolarHBondContact O-N 3.29Å; G849-K851 PolarHBondContact O-N 3.21Å; K851-S854 WeakPolarHBondContact CA-OG 3.39Å; K851-S854 PolarHBondContact O-OG 2.71Å
852	V	73.7	Confident	74.9	Confident	74 Å²	74	110.3 Å²	110.3	45%	0.448	55%	0.549	S	S	.	.	H	α-helix	trans	-85.8	-38.8	171	168.1	0	0	0	0	110.8	R848 G849 E850 K855 R856	R848-V852 WeakPolarHBondContact O-CG2 3.49Å; R848-V852 PolarHBondContact O-N 2.82Å; R848-V852 VanDerWaalsContact O-N 3.07Å; G849-V852 WeakPolarHBondContact O-CA 3.34Å; G849-V852 PolarHBondContact O-N 3.39Å; E850-V852 VanDerWaalsContact C-N 3.35Å; E850-V852 PolarHBondContact O-N 3.35Å; V852-K855 PolarHBondContact O-N 3.36Å; V852-R856 PolarHBondContact O-N 3.38Å
853	E	70.1	Confident	75.3	Confident	100 Å²	100	109.7 Å²	109.7	47%	0.467	54%	0.544	S	S	.	.	H	α-helix	trans	-68.8	-42	179.4	-160.9	-166.6	140	0	0	112.3	G849 E850 K855 R856 K857	G849-E853 PolarHBondContact O-N 2.83Å; E850-E853 PolarHBondContact O-N 3.24Å; E853-K855 PolarHBondContact O-N 2.75Å; E853-R856 PolarHBondContact O-N 3.2Å; E853-K857 WeakPolarHBondContact O-CG 3.47Å; E853-K857 PolarHBondContact O-N 3.46Å; E853-K857 WeakPolarHBondContact OE1-CE 3.47Å; E853-K857 IonicContact OE1-NZ 2.7Å; E853-K857 PolarHBondContact OE1-NZ 3.43Å
854	S	73	Confident	75.4	Confident	62 Å²	62	108.4 Å²	108.4	43%	0.434	54%	0.538	S	S	.	.	H	α-helix	trans	-58.7	-44.4	172.3	45.5	0	0	0	0	112.2	E850 K851 K857 E858	E850-S854 WeakPolarHBondContact O-CB 3.31Å; E850-S854 PolarHBondContact O-N 2.86Å; E850-S854 PolarHBondContact O-OG 2.82Å; K851-S854 WeakPolarHBondContact CA-OG 3.39Å; K851-S854 PolarHBondContact O-OG 2.71Å; S854-K857 PolarHBondContact O-N 3.06Å; S854-E858 PolarHBondContact O-N 3.39Å
855	K	76.9	Confident	75.8	Confident	117 Å²	117	112.2 Å²	112.2	51%	0.509	55%	0.546	S	S	.	.	H	α-helix	trans	-60.8	-42.3	172.5	-85.8	-177.5	160.9	-115	0	113.4	V852 E853 K857 E858 E859	V852-K855 PolarHBondContact O-N 3.36Å; E853-K855 PolarHBondContact O-N 2.75Å; K855-K857 VanDerWaalsContact C-N 3.33Å; K855-K857 PolarHBondContact O-N 3.17Å; K855-E858 WeakPolarHBondContact O-CB 3.26Å; K855-E858 PolarHBondContact O-N 3.28Å; K855-E859 WeakPolarHBondContact O-CG 3.44Å; K855-E859 PolarHBondContact O-N 3.04Å
856	R	76.7	Confident	76.2	Confident	176 Å²	176	111.5 Å²	111.5	66%	0.664	54%	0.543	S	S	*	.	H	α-helix	trans	-61.6	-41	175.7	-80.6	179.9	168	-178.1	-2.9	112	V852 E853 E859 E860	V852-R856 PolarHBondContact O-N 3.38Å; E853-R856 PolarHBondContact O-N 3.2Å; R856-E859 PolarHBondContact O-N 3.03Å; R856-E860 WeakPolarHBondContact O-CB 2.96Å; R856-E860 PolarHBondContact O-N 3.48Å
857	K	75.6	Confident	76.8	Confident	117 Å²	117	111.3 Å²	111.3	51%	0.509	53%	0.533	S	S	.	.	H	α-helix	trans	-64.3	-41.3	175.7	-73.6	166.5	172.1	170.2	0	111.4	E853 S854 K855 E860 T861	E853-K857 WeakPolarHBondContact O-CG 3.47Å; E853-K857 PolarHBondContact O-N 3.46Å; E853-K857 WeakPolarHBondContact OE1-CE 3.47Å; E853-K857 IonicContact OE1-NZ 2.7Å; E853-K857 PolarHBondContact OE1-NZ 3.43Å; S854-K857 PolarHBondContact O-N 3.06Å; K855-K857 VanDerWaalsContact C-N 3.33Å; K855-K857 PolarHBondContact O-N 3.17Å; K857-E860 PolarHBondContact O-N 3.09Å; K857-T861 PolarHBondContact O-N 3.37Å; K857-T861 PolarHBondContact O-OG1 3.2Å
858	E	78.9	Confident	77.3	Confident	127 Å²	127	112.2 Å²	112.2	59%	0.593	53%	0.532	S	S	*	.	H	α-helix	trans	-61.9	-50.4	174.6	-168.5	173.4	-153.9	0	0	111.6	S854 K855 E860 T861 V862	S854-E858 PolarHBondContact O-N 3.39Å; K855-E858 WeakPolarHBondContact O-CB 3.26Å; K855-E858 PolarHBondContact O-N 3.28Å; E858-E860 VanDerWaalsContact C-N 3.34Å; E858-E860 PolarHBondContact O-N 2.8Å; E858-T861 WeakPolarHBondContact CA-OG1 3.48Å; E858-T861 PolarHBondContact O-N 3.46Å; E858-T861 PolarHBondContact O-OG1 3.4Å; E858-V862 WeakPolarHBondContact O-CG2 3.39Å; E858-V862 PolarHBondContact O-N 3.17Å
859	E	78.4	Confident	77.8	Confident	130 Å²	130	106.7 Å²	106.7	61%	0.607	52%	0.519	S	S	*	.	H	α-helix	trans	-59.3	-39.7	174.9	-73.2	174.3	179.5	0	0	112.6	K855 R856 K863	K855-E859 WeakPolarHBondContact O-CG 3.44Å; K855-E859 PolarHBondContact O-N 3.04Å; R856-E859 PolarHBondContact O-N 3.03Å; E859-K863 WeakPolarHBondContact O-CB 3.25Å; E859-K863 PolarHBondContact O-N 2.6Å
860	E	77.2	Confident	78.6	Confident	102 Å²	102	109.6 Å²	109.6	48%	0.477	52%	0.522	S	S	.	.	H	α-helix	trans	-68.7	-35.4	176.6	-156.5	-159.6	155.8	0	0	112.3	R856 K857 E858 K864	R856-E860 WeakPolarHBondContact O-CB 2.96Å; R856-E860 PolarHBondContact O-N 3.48Å; K857-E860 PolarHBondContact O-N 3.09Å; E858-E860 VanDerWaalsContact C-N 3.34Å; E858-E860 PolarHBondContact O-N 2.8Å; E860-K864 VanDerWaalsContact CD-NZ 3.28Å; E860-K864 WeakPolarHBondContact O-CG 3.26Å; E860-K864 PolarHBondContact O-N 3.43Å; E860-K864 VanDerWaalsContact O-N 3.15Å; E860-K864 WeakPolarHBondContact OE1-CE 3.39Å; E860-K864 IonicContact OE1-NZ 2.59Å; E860-K864 PolarHBondContact OE1-NZ 3.44Å; E860-K864 IonicContact OE2-NZ 4Å
861	T	77.8	Confident	79.1	Confident	79 Å²	79	110.1 Å²	110.1	49%	0.485	52%	0.518	S	S	.	.	H	α-helix	trans	-67.3	-45.9	173.2	47.2	0	0	0	0	112.2	K857 E858 K863 K864 E865	K857-T861 PolarHBondContact O-N 3.37Å; K857-T861 PolarHBondContact O-OG1 3.2Å; E858-T861 WeakPolarHBondContact CA-OG1 3.48Å; E858-T861 PolarHBondContact O-N 3.46Å; E858-T861 PolarHBondContact O-OG1 3.4Å; T861-K863 VanDerWaalsContact C-N 3.31Å; T861-K863 PolarHBondContact O-N 2.7Å; T861-K864 PolarHBondContact O-N 2.96Å; T861-K864 VanDerWaalsContact O-N 3.12Å; T861-E865 PolarHBondContact O-N 3.26Å
862	V	82.9	Confident	79.7	Confident	73 Å²	73	108.1 Å²	108.1	44%	0.442	51%	0.509	S	S	.	.	H	α-helix	trans	-57.9	-44.7	176.1	172.1	0	0	0	0	110.7	E858 K864 E865 E866	E858-V862 WeakPolarHBondContact O-CG2 3.39Å; E858-V862 PolarHBondContact O-N 3.17Å; V862-K864 VanDerWaalsContact C-N 3.33Å; V862-K864 PolarHBondContact O-N 3.28Å; V862-E865 PolarHBondContact O-N 3.13Å; V862-E866 PolarHBondContact O-N 3.1Å
863	K	81.6	Confident	80.2	Confident	123 Å²	123	112.6 Å²	112.6	54%	0.535	52%	0.518	S	S	.	.	H	α-helix	trans	-61.5	-38.2	177.4	-173.1	-177.9	173.7	-170.5	0	112.9	E859 T861 E866 E867	E859-K863 WeakPolarHBondContact O-CB 3.25Å; E859-K863 PolarHBondContact O-N 2.6Å; T861-K863 VanDerWaalsContact C-N 3.31Å; T861-K863 PolarHBondContact O-N 2.7Å; K863-E866 PolarHBondContact O-N 3.37Å; K863-E867 WeakPolarHBondContact CE-OE1 3.42Å; K863-E867 PolarHBondContact O-N 2.97Å
864	K	80.6	Confident	80.8	Confident	115 Å²	115	112.2 Å²	112.2	50%	0.5	52%	0.515	S	S	.	.	H	α-helix	trans	-66.3	-39.4	176.1	-74.5	167.6	-174.1	165.9	0	111.8	E860 T861 V862 E867 E868	E860-K864 VanDerWaalsContact CD-NZ 3.28Å; E860-K864 WeakPolarHBondContact O-CG 3.26Å; E860-K864 PolarHBondContact O-N 3.43Å; E860-K864 VanDerWaalsContact O-N 3.15Å; E860-K864 WeakPolarHBondContact OE1-CE 3.39Å; E860-K864 IonicContact OE1-NZ 2.59Å; E860-K864 PolarHBondContact OE1-NZ 3.44Å; E860-K864 IonicContact OE2-NZ 4Å; T861-K864 PolarHBondContact O-N 2.96Å; T861-K864 VanDerWaalsContact O-N 3.12Å; V862-K864 VanDerWaalsContact C-N 3.33Å; V862-K864 PolarHBondContact O-N 3.28Å; K864-E867 PolarHBondContact O-N 3.36Å; K864-E868 PolarHBondContact O-N 3.35Å
865	E	83.4	Confident	81.3	Confident	137 Å²	137	115.6 Å²	115.6	64%	0.64	52%	0.524	S	S	*	.	H	α-helix	trans	-65.6	-42.8	174	-67.6	-171.1	160.6	0	0	111.9	T861 V862 E867 E868 V869	T861-E865 PolarHBondContact O-N 3.26Å; V862-E865 PolarHBondContact O-N 3.13Å; E865-E867 PolarHBondContact O-N 3Å; E865-E868 PolarHBondContact O-N 3.07Å; E865-V869 WeakPolarHBondContact O-CG2 3.18Å; E865-V869 PolarHBondContact O-N 2.59Å
866	E	82.9	Confident	81.5	Confident	134 Å²	134	116.5 Å²	116.5	63%	0.626	53%	0.53	S	S	*	.	H	α-helix	trans	-60.1	-45	174.4	-73	-167.1	139.7	0	0	112.2	V862 K863 E868 V869 E870	V862-E866 PolarHBondContact O-N 3.1Å; K863-E866 PolarHBondContact O-N 3.37Å; E866-E868 VanDerWaalsContact C-N 3.35Å; E866-E868 PolarHBondContact O-N 3.21Å; E866-V869 PolarHBondContact O-N 3.24Å; E866-E870 WeakPolarHBondContact O-CB 3.19Å; E866-E870 PolarHBondContact O-N 3.43Å
867	E	83.1	Confident	81.8	Confident	75 Å²	75	115 Å²	115	35%	0.35	53%	0.53	S	S	.	.	H	α-helix	trans	-62.3	-38.5	174.9	-78.7	-169.7	-147.9	0	0	112.5	K863 K864 E865 E870 R871	K863-E867 WeakPolarHBondContact CE-OE1 3.42Å; K863-E867 PolarHBondContact O-N 2.97Å; K864-E867 PolarHBondContact O-N 3.36Å; E865-E867 PolarHBondContact O-N 3Å; E867-E870 PolarHBondContact O-N 3.26Å; E867-R871 WeakPolarHBondContact O-CB 3.46Å; E867-R871 WeakPolarHBondContact O-CD 3.34Å; E867-R871 WeakPolarHBondContact O-CG 3.26Å; E867-R871 PolarHBondContact O-N 3.01Å; E867-R871 IonicContact OE2-CZ 2.68Å; E867-R871 IonicContact OE2-NH2 3.81Å; E867-R871 PolarHBondContact OE2-NH2 2.99Å
868	E	84	Confident	82	Confident	102 Å²	102	116.3 Å²	116.3	48%	0.477	54%	0.536	S	S	.	.	H	α-helix	trans	-69.2	-40	177.2	-164.2	-176.3	139.4	0	0	111.9	K864 E865 E866 R871 K872	K864-E868 PolarHBondContact O-N 3.35Å; E865-E868 PolarHBondContact O-N 3.07Å; E866-E868 VanDerWaalsContact C-N 3.35Å; E866-E868 PolarHBondContact O-N 3.21Å; E868-R871 PolarHBondContact O-N 3.07Å; E868-K872 WeakPolarHBondContact O-CG 3.37Å; E868-K872 PolarHBondContact O-N 2.92Å; E868-K872 WeakPolarHBondContact OE1-CE 3.42Å; E868-K872 IonicContact OE1-NZ 2.88Å; E868-K872 PolarHBondContact OE1-NZ 3.08Å
869	V	85.2	Confident	81.9	Confident	73 Å²	73	113 Å²	113	44%	0.442	53%	0.53	S	S	.	.	H	α-helix	trans	-63.5	-40.9	173.9	169.7	0	0	0	0	111.2	E865 E866 K872 R873	E865-V869 WeakPolarHBondContact O-CG2 3.18Å; E865-V869 PolarHBondContact O-N 2.59Å; E866-V869 PolarHBondContact O-N 3.24Å; V869-K872 PolarHBondContact O-N 2.7Å; V869-R873 WeakPolarHBondContact O-CG 3.39Å; V869-R873 PolarHBondContact O-N 2.81Å
870	E	83.5	Confident	81.9	Confident	100 Å²	100	113.3 Å²	113.3	47%	0.467	53%	0.532	S	S	.	.	H	α-helix	trans	-68.2	-38.6	177.4	-153.1	-148	-173.9	0	0	112.1	E866 E867 R873 K874	E866-E870 WeakPolarHBondContact O-CB 3.19Å; E866-E870 PolarHBondContact O-N 3.43Å; E867-E870 PolarHBondContact O-N 3.26Å; E870-R873 PolarHBondContact O-N 3.27Å; E870-K874 WeakPolarHBondContact O-CG 3.18Å; E870-K874 PolarHBondContact O-N 3.43Å; E870-K874 WeakPolarHBondContact OE1-CE 3.39Å; E870-K874 IonicContact OE1-NZ 2.69Å; E870-K874 PolarHBondContact OE1-NZ 3.37Å; E870-K874 IonicContact OE2-NZ 2.66Å; E870-K874 PolarHBondContact OE2-NZ 3.38Å
871	R	83.5	Confident	81.8	Confident	147 Å²	147	110.5 Å²	110.5	56%	0.555	53%	0.53	S	S	*	.	H	α-helix	trans	-60.3	-48.3	172.6	-71.1	166.4	-155.6	-169.4	7.9	111.3	E867 E868 R873 K874 E875	E867-R871 WeakPolarHBondContact O-CB 3.46Å; E867-R871 WeakPolarHBondContact O-CD 3.34Å; E867-R871 WeakPolarHBondContact O-CG 3.26Å; E867-R871 PolarHBondContact O-N 3.01Å; E867-R871 IonicContact OE2-CZ 2.68Å; E867-R871 IonicContact OE2-NH2 3.81Å; E867-R871 PolarHBondContact OE2-NH2 2.99Å; E868-R871 PolarHBondContact O-N 3.07Å; R871-R873 PolarHBondContact O-N 3.24Å; R871-K874 PolarHBondContact O-N 3.24Å; R871-K874 VanDerWaalsContact O-N 3.15Å; R871-E875 PolarHBondContact O-N 3.4Å
872	K	84.8	Confident	81.6	Confident	107 Å²	107	110.3 Å²	110.3	47%	0.465	53%	0.529	S	S	.	.	H	α-helix	trans	-58.6	-45.6	177.5	-74.1	170.1	-175.7	166.8	0	112	E868 V869 K874 E875 E876	E868-K872 WeakPolarHBondContact O-CG 3.37Å; E868-K872 PolarHBondContact O-N 2.92Å; E868-K872 WeakPolarHBondContact OE1-CE 3.42Å; E868-K872 IonicContact OE1-NZ 2.88Å; E868-K872 PolarHBondContact OE1-NZ 3.08Å; V869-K872 PolarHBondContact O-N 2.7Å; K872-K874 VanDerWaalsContact C-N 3.34Å; K872-K874 PolarHBondContact O-N 3.17Å; K872-E875 PolarHBondContact O-N 3.44Å; K872-E875 VanDerWaalsContact O-N 3.09Å; K872-E876 PolarHBondContact O-N 3.24Å
873	R	84.5	Confident	81.2	Confident	169 Å²	169	115.1 Å²	115.1	64%	0.638	54%	0.539	S	S	*	.	H	α-helix	trans	-57.8	-44.3	174.1	-74.4	177.9	176.6	176.8	2	112.5	V869 E870 R871 E875 E876 E877	V869-R873 WeakPolarHBondContact O-CG 3.39Å; V869-R873 PolarHBondContact O-N 2.81Å; E870-R873 PolarHBondContact O-N 3.27Å; R871-R873 PolarHBondContact O-N 3.24Å; R873-E875 PolarHBondContact O-N 3.15Å; R873-E876 PolarHBondContact O-N 2.77Å; R873-E877 WeakPolarHBondContact O-CB 3.4Å; R873-E877 PolarHBondContact O-N 2.93Å
874	K	82.9	Confident	80.8	Confident	91 Å²	91	111.1 Å²	111.1	40%	0.396	53%	0.533	S	S	.	.	H	α-helix	trans	-67.8	-20.2	177.3	-72.5	169.3	179.6	171.2	0	113.5	E870 R871 K872 K878	E870-K874 WeakPolarHBondContact O-CG 3.18Å; E870-K874 PolarHBondContact O-N 3.43Å; E870-K874 WeakPolarHBondContact OE1-CE 3.39Å; E870-K874 IonicContact OE1-NZ 2.69Å; E870-K874 PolarHBondContact OE1-NZ 3.37Å; E870-K874 IonicContact OE2-NZ 2.66Å; E870-K874 PolarHBondContact OE2-NZ 3.38Å; R871-K874 PolarHBondContact O-N 3.24Å; R871-K874 VanDerWaalsContact O-N 3.15Å; K872-K874 VanDerWaalsContact C-N 3.34Å; K872-K874 PolarHBondContact O-N 3.17Å; K874-K878 WeakPolarHBondContact O-CD 3.13Å; K874-K878 WeakPolarHBondContact O-CE 3.11Å; K874-K878 VanDerWaalsContact O-CG 3.23Å; K874-K878 WeakPolarHBondContact O-CG 3.41Å
875	E	82.8	Confident	80.5	Confident	134 Å²	134	112.1 Å²	112.1	63%	0.626	54%	0.539	S	S	*	.	H	α-helix	trans	-84.8	-41.9	171.7	-71.2	-175.2	161.5	0	0	112	R871 K872 R873 K878 A879	R871-E875 PolarHBondContact O-N 3.4Å; K872-E875 PolarHBondContact O-N 3.44Å; K872-E875 VanDerWaalsContact O-N 3.09Å; R873-E875 PolarHBondContact O-N 3.15Å; E875-K878 PolarHBondContact O-N 2.83Å; E875-A879 PolarHBondContact O-N 3.45Å
876	E	81.9	Confident	80	Confident	135 Å²	135	112.7 Å²	112.7	63%	0.631	54%	0.539	S	S	*	.	H	α-helix	trans	-60.3	-44	173.2	-71.3	-172.3	131.9	0	0	111.8	K872 R873 K878 A879 E880	K872-E876 PolarHBondContact O-N 3.24Å; R873-E876 PolarHBondContact O-N 2.77Å; E876-K878 VanDerWaalsContact C-N 3.33Å; E876-K878 PolarHBondContact O-N 2.73Å; E876-A879 CarbonylContact O-C 3.57Å; E876-A879 WeakPolarHBondContact O-CB 3.46Å; E876-A879 PolarHBondContact O-N 3.12Å; E876-A879 VanDerWaalsContact O-N 3.09Å; E876-E880 WeakPolarHBondContact O-CG 3.31Å; E876-E880 PolarHBondContact O-N 3.27Å
877	E	81.4	Confident	79.8	Confident	145 Å²	145	109.7 Å²	109.7	68%	0.678	53%	0.53	S	S	*	.	H	α-helix	trans	-61.2	-38.7	177.4	-171.7	177.1	-159.4	0	0	112.3	R873 E880 G881	R873-E877 WeakPolarHBondContact O-CB 3.4Å; R873-E877 PolarHBondContact O-N 2.93Å; E877-E880 PolarHBondContact O-N 3.33Å; E877-G881 PolarHBondContact O-N 3.16Å
878	K	79.8	Confident	79.4	Confident	145 Å²	145	111.4 Å²	111.4	63%	0.63	54%	0.538	S	S	*	.	H	α-helix	trans	-68.2	-37.5	172.9	-70.2	168.4	-169.7	168.4	0	112.1	K874 E875 E876 T882	K874-K878 WeakPolarHBondContact O-CD 3.13Å; K874-K878 WeakPolarHBondContact O-CE 3.11Å; K874-K878 VanDerWaalsContact O-CG 3.23Å; K874-K878 WeakPolarHBondContact O-CG 3.41Å; E875-K878 PolarHBondContact O-N 2.83Å; E876-K878 VanDerWaalsContact C-N 3.33Å; E876-K878 PolarHBondContact O-N 2.73Å; K878-T882 WeakPolarHBondContact O-CG2 3.38Å; K878-T882 PolarHBondContact O-N 3.02Å; K878-T882 PolarHBondContact O-OG1 2.76Å
879	A	78.3	Confident	79	Confident	57 Å²	57	109.7 Å²	109.7	47%	0.471	54%	0.538	S	S	.	.	H	α-helix	trans	-66.6	-40.4	175.6	0	0	0	0	0	111.6	E875 E876 T882 R883	E875-A879 PolarHBondContact O-N 3.45Å; E876-A879 CarbonylContact O-C 3.57Å; E876-A879 WeakPolarHBondContact O-CB 3.46Å; E876-A879 PolarHBondContact O-N 3.12Å; E876-A879 VanDerWaalsContact O-N 3.09Å; A879-T882 PolarHBondContact O-OG1 3.5Å; A879-R883 WeakPolarHBondContact O-CB 3.35Å; A879-R883 PolarHBondContact O-N 3.2Å
880	E	77.4	Confident	78.6	Confident	136 Å²	136	113.4 Å²	113.4	64%	0.636	55%	0.548	S	S	*	.	H	α-helix	trans	-64	-47.4	172.7	-70.6	-112.2	109.7	0	0	111.5	E876 E877 T882 R883 G884	E876-E880 WeakPolarHBondContact O-CG 3.31Å; E876-E880 PolarHBondContact O-N 3.27Å; E877-E880 PolarHBondContact O-N 3.33Å; E880-T882 PolarHBondContact O-N 2.64Å; E880-R883 CarbonylContact O-C 3.59Å; E880-R883 WeakPolarHBondContact O-CB 3.29Å; E880-R883 PolarHBondContact O-N 3.45Å; E880-G884 PolarHBondContact O-N 3.07Å
881	G	75.2	Confident	78.3	Confident	43 Å²	43	116.6 Å²	116.6	44%	0.443	56%	0.555	S	S	.	*	H	α-helix	trans	-57.8	-50.7	178.2	0	0	0	0	0	113	E877 R883 G884 E885	E877-G881 PolarHBondContact O-N 3.16Å; G881-R883 VanDerWaalsContact C-N 3.28Å; G881-R883 PolarHBondContact O-N 3.14Å; G881-G884 WeakPolarHBondContact O-CA 3.32Å; G881-G884 PolarHBondContact O-N 3.19Å; G881-G884 VanDerWaalsContact O-N 3.09Å; G881-E885 PolarHBondContact O-N 2.69Å
882	T	74.5	Confident	78	Confident	75 Å²	75	116 Å²	116	46%	0.46	56%	0.557	S	S	.	*	H	α-helix	trans	-67.6	-26.5	177.4	57.3	0	0	0	0	113.2	K878 A879 E880 K886	K878-T882 WeakPolarHBondContact O-CG2 3.38Å; K878-T882 PolarHBondContact O-N 3.02Å; K878-T882 PolarHBondContact O-OG1 2.76Å; A879-T882 PolarHBondContact O-OG1 3.5Å; E880-T882 PolarHBondContact O-N 2.64Å; T882-K886 WeakPolarHBondContact O-CB 3.15Å; T882-K886 PolarHBondContact O-N 3.34Å; T882-K886 VanDerWaalsContact O-N 3.15Å
883	R	73	Confident	77.6	Confident	175 Å²	175	120.2 Å²	120.2	66%	0.66	57%	0.57	S	S	*	*	H	α-helix	trans	-70.7	-39.6	169.9	-169.6	178.5	-168.6	172	3.6	111.1	A879 E880 G881 K886 V887	A879-R883 WeakPolarHBondContact O-CB 3.35Å; A879-R883 PolarHBondContact O-N 3.2Å; E880-R883 CarbonylContact O-C 3.59Å; E880-R883 WeakPolarHBondContact O-CB 3.29Å; E880-R883 PolarHBondContact O-N 3.45Å; G881-R883 VanDerWaalsContact C-N 3.28Å; G881-R883 PolarHBondContact O-N 3.14Å; R883-K886 PolarHBondContact O-N 3.39Å; R883-V887 WeakPolarHBondContact O-CG2 3.08Å; R883-V887 PolarHBondContact O-N 2.74Å
884	G	73.6	Confident	77.1	Confident	38 Å²	38	121.5 Å²	121.5	39%	0.392	58%	0.575	S	S	.	*	H	α-helix	trans	-57.1	-54.9	171.5	0	0	0	0	0	112.1	E880 G881 K886 V887 E888	E880-G884 PolarHBondContact O-N 3.07Å; G881-G884 WeakPolarHBondContact O-CA 3.32Å; G881-G884 PolarHBondContact O-N 3.19Å; G881-G884 VanDerWaalsContact O-N 3.09Å; G884-K886 VanDerWaalsContact C-N 3.3Å; G884-K886 PolarHBondContact O-N 3.18Å; G884-V887 CarbonylContact O-C 3.49Å; G884-V887 WeakPolarHBondContact O-CA 3.1Å; G884-V887 PolarHBondContact O-N 2.98Å; G884-E888 PolarHBondContact O-N 3.12Å
885	E	74.6	Confident	76.7	Confident	136 Å²	136	123.4 Å²	123.4	64%	0.636	58%	0.579	S	S	*	*	H	α-helix	trans	-57.2	-40	176.1	-73.1	-162.8	116.4	0	0	113	G881 V887 S889	G881-E885 PolarHBondContact O-N 2.69Å; E885-V887 VanDerWaalsContact C-N 3.33Å; E885-V887 PolarHBondContact O-N 2.98Å; E885-S889 WeakPolarHBondContact O-CB 3.46Å; E885-S889 PolarHBondContact O-N 3.04Å; E885-S889 PolarHBondContact O-OG 3.47Å
886	K	74	Confident	76.2	Confident	149 Å²	149	121.6 Å²	121.6	65%	0.648	57%	0.574	S	S	*	*	H	α-helix	trans	-64.7	-35.2	174.5	-87	172.3	177.6	162.9	0	112.3	T882 R883 G884 K890	T882-K886 WeakPolarHBondContact O-CB 3.15Å; T882-K886 PolarHBondContact O-N 3.34Å; T882-K886 VanDerWaalsContact O-N 3.15Å; R883-K886 PolarHBondContact O-N 3.39Å; G884-K886 VanDerWaalsContact C-N 3.3Å; G884-K886 PolarHBondContact O-N 3.18Å; K886-K890 WeakPolarHBondContact O-CB 3.06Å; K886-K890 VanDerWaalsContact O-CG 3.28Å; K886-K890 WeakPolarHBondContact O-CG 3.43Å; K886-K890 PolarHBondContact O-N 2.77Å; K886-K890 VanDerWaalsContact O-N 3.13Å
887	V	77	Confident	75.7	Confident	71 Å²	71	119.3 Å²	119.3	43%	0.43	57%	0.572	S	S	.	*	H	α-helix	trans	-73.8	-44.5	175.7	169.8	0	0	0	0	111.4	R883 G884 E885 K890 R891	R883-V887 WeakPolarHBondContact O-CG2 3.08Å; R883-V887 PolarHBondContact O-N 2.74Å; G884-V887 CarbonylContact O-C 3.49Å; G884-V887 WeakPolarHBondContact O-CA 3.1Å; G884-V887 PolarHBondContact O-N 2.98Å; E885-V887 VanDerWaalsContact C-N 3.33Å; E885-V887 PolarHBondContact O-N 2.98Å; V887-K890 PolarHBondContact O-N 2.99Å; V887-R891 WeakPolarHBondContact O-CG 3.48Å; V887-R891 PolarHBondContact O-N 2.74Å
888	E	76.2	Confident	75.1	Confident	112 Å²	112	118.7 Å²	118.7	52%	0.523	57%	0.569	S	S	.	*	H	α-helix	trans	-59.2	-49.4	173.8	180	97.8	-117.6	0	0	110.7	G884 K890 R891 K892	G884-E888 PolarHBondContact O-N 3.12Å; E888-K890 VanDerWaalsContact C-N 3.3Å; E888-K890 PolarHBondContact O-N 2.63Å; E888-R891 CarbonylContact O-C 3.52Å; E888-R891 WeakPolarHBondContact O-CA 3.43Å; E888-R891 WeakPolarHBondContact O-CB 3.13Å; E888-R891 PolarHBondContact O-N 3.05Å; E888-K892 WeakPolarHBondContact O-CB 3.45Å; E888-K892 PolarHBondContact O-N 3.41Å
889	S	75	Confident	74.6	Confident	66 Å²	66	117.1 Å²	117.1	46%	0.462	56%	0.564	S	S	.	*	H	α-helix	trans	-58.9	-39.6	177.1	-66.6	0	0	0	0	112.2	E885 R893	E885-S889 WeakPolarHBondContact O-CB 3.46Å; E885-S889 PolarHBondContact O-N 3.04Å; E885-S889 PolarHBondContact O-OG 3.47Å; S889-R893 WeakPolarHBondContact O-CB 3.03Å; S889-R893 WeakPolarHBondContact O-CG 3.45Å; S889-R893 PolarHBondContact O-N 3.31Å
890	K	77.1	Confident	74.1	Confident	150 Å²	150	117.1 Å²	117.1	65%	0.652	57%	0.569	S	S	*	*	H	α-helix	trans	-67.3	-38.7	172.4	-78.9	176.3	177.8	-178.9	0	112.4	K886 V887 E888 R894	K886-K890 WeakPolarHBondContact O-CB 3.06Å; K886-K890 VanDerWaalsContact O-CG 3.28Å; K886-K890 WeakPolarHBondContact O-CG 3.43Å; K886-K890 PolarHBondContact O-N 2.77Å; K886-K890 VanDerWaalsContact O-N 3.13Å; V887-K890 PolarHBondContact O-N 2.99Å; E888-K890 VanDerWaalsContact C-N 3.3Å; E888-K890 PolarHBondContact O-N 2.63Å; K890-R894 WeakPolarHBondContact O-CB 3.45Å; K890-R894 WeakPolarHBondContact O-CG 3.48Å; K890-R894 PolarHBondContact O-N 2.62Å
891	R	77.1	Confident	73.5	Confident	167 Å²	167	121 Å²	121	63%	0.63	58%	0.578	S	S	*	*	H	α-helix	trans	-65.9	-40.9	174.4	-78.3	176.2	168.7	175.9	-2.9	112	V887 E888 R894 R895	V887-R891 WeakPolarHBondContact O-CG 3.48Å; V887-R891 PolarHBondContact O-N 2.74Å; E888-R891 CarbonylContact O-C 3.52Å; E888-R891 WeakPolarHBondContact O-CA 3.43Å; E888-R891 WeakPolarHBondContact O-CB 3.13Å; E888-R891 PolarHBondContact O-N 3.05Å; R891-R894 PolarHBondContact O-N 2.79Å; R891-R895 PolarHBondContact O-N 3.26Å
892	K	77	Confident	72.7	Confident	135 Å²	135	130.1 Å²	130.1	59%	0.587	60%	0.599	S	S	*	*	H	α-helix	trans	-65.6	-50.8	177	-162.5	168.8	-175.3	174.3	0	110.5	E888 R894 R895 N896	E888-K892 WeakPolarHBondContact O-CB 3.45Å; E888-K892 PolarHBondContact O-N 3.41Å; K892-R894 VanDerWaalsContact C-N 3.29Å; K892-R894 PolarHBondContact O-N 3.47Å; K892-R895 PolarHBondContact O-N 3.24Å; K892-R895 VanDerWaalsContact O-N 3.07Å; K892-N896 PolarHBondContact O-N 2.69Å; K892-N896 PolarHBondContact O-OD1 3.29Å
893	R	75.8	Confident	71.5	Confident	196 Å²	196	134 Å²	134	74%	0.74	63%	0.629	S	S	*	*	H	α-helix	trans	-55	-40.8	171.6	-73	-177.6	-177.7	-169.4	1.5	112.7	S889 C897	S889-R893 WeakPolarHBondContact O-CB 3.03Å; S889-R893 WeakPolarHBondContact O-CG 3.45Å; S889-R893 PolarHBondContact O-N 3.31Å; R893-C897 WeakPolarHBondContact O-CB 3.46Å; R893-C897 PolarHBondContact O-N 3.31Å; R893-C897 PolarHBondContact O-SG 2.69Å
894	R	74.7	Confident	71.5	Confident	196 Å²	196	131.9 Å²	131.9	74%	0.74	63%	0.628	S	S	*	*	H	α-helix	trans	-64.8	-40.2	175	-84.5	-174.3	169.6	-171.7	-3	113.5	K890 R891 K892 C897 Q898	K890-R894 WeakPolarHBondContact O-CB 3.45Å; K890-R894 WeakPolarHBondContact O-CG 3.48Å; K890-R894 PolarHBondContact O-N 2.62Å; R891-R894 PolarHBondContact O-N 2.79Å; K892-R894 VanDerWaalsContact C-N 3.29Å; K892-R894 PolarHBondContact O-N 3.47Å; R894-C897 PolarHBondContact O-N 2.9Å; R894-Q898 WeakPolarHBondContact O-CG 3.23Å; R894-Q898 PolarHBondContact O-N 2.96Å; R894-Q898 VanDerWaalsContact O-N 3.16Å
895	R	74.1	Confident	71.4	Confident	131 Å²	131	136.8 Å²	136.8	49%	0.494	64%	0.64	S	S	.	*	H	α-helix	trans	-61.9	-52.7	174.3	-93.4	-175.9	-86.2	172.9	-5.8	111.4	R891 K892 C897 Q898 E899	R891-R895 PolarHBondContact O-N 3.26Å; K892-R895 PolarHBondContact O-N 3.24Å; K892-R895 VanDerWaalsContact O-N 3.07Å; R895-C897 VanDerWaalsContact C-N 3.26Å; R895-C897 PolarHBondContact O-N 3.41Å; R895-Q898 WeakPolarHBondContact O-CA 3.44Å; R895-Q898 PolarHBondContact O-N 3.31Å; R895-E899 PolarHBondContact O-N 3.46Å
896	N	73.4	Confident	71.2	Confident	96 Å²	96	136.9 Å²	136.9	51%	0.513	64%	0.64	S	S	.	*	H	α-helix	trans	-55.5	-39.7	176.9	-69.3	58.5	0	0	0	112.3	K892 Q898 E899 G900	K892-N896 PolarHBondContact O-N 2.69Å; K892-N896 PolarHBondContact O-OD1 3.29Å; N896-Q898 VanDerWaalsContact C-N 3.31Å; N896-Q898 PolarHBondContact O-N 3.33Å; N896-E899 PolarHBondContact O-N 3.07Å; N896-G900 PolarHBondContact O-N 3.36Å
897	C	70.7	Confident	71	Confident	86 Å²	86	136.2 Å²	136.2	58%	0.581	64%	0.64	S	S	*	*	H	α-helix	trans	-73.6	-13	175.8	-69.6	0	0	0	0	115.1	R893 R894 R895 R901	R893-C897 WeakPolarHBondContact O-CB 3.46Å; R893-C897 PolarHBondContact O-N 3.31Å; R893-C897 PolarHBondContact O-SG 2.69Å; R894-C897 PolarHBondContact O-N 2.9Å; R895-C897 VanDerWaalsContact C-N 3.26Å; R895-C897 PolarHBondContact O-N 3.41Å; C897-R901 WeakPolarHBondContact O-CG 3.39Å
898	Q	69.6	Low	70.6	Confident	132 Å²	132	140.3 Å²	140.3	62%	0.617	65%	0.653	S	S	*	*	H	α-helix	trans	-92.2	-34.2	170.9	-75.2	-177.1	-46.6	0	0	111.7	R894 R895 N896 R901 R902	R894-Q898 WeakPolarHBondContact O-CG 3.23Å; R894-Q898 PolarHBondContact O-N 2.96Å; R894-Q898 VanDerWaalsContact O-N 3.16Å; R895-Q898 WeakPolarHBondContact O-CA 3.44Å; R895-Q898 PolarHBondContact O-N 3.31Å; N896-Q898 VanDerWaalsContact C-N 3.31Å; N896-Q898 PolarHBondContact O-N 3.33Å; Q898-R901 PolarHBondContact O-N 2.77Å; Q898-R902 PolarHBondContact O-N 3.17Å
899	E	68.7	Low	70.3	Confident	113 Å²	113	142.1 Å²	142.1	53%	0.528	66%	0.662	S	S	.	*	H	α-helix	trans	-68.6	-46.3	173.8	-71.7	159.9	-178.6	0	0	110.6	R895 N896 R901 R902 S903	R895-E899 PolarHBondContact O-N 3.46Å; N896-E899 PolarHBondContact O-N 3.07Å; E899-R901 PolarHBondContact O-N 2.77Å; E899-R902 PolarHBondContact O-N 3.48Å; E899-S903 PolarHBondContact O-N 2.81Å; E899-S903 VanDerWaalsContact O-N 3.09Å
900	G	67.5	Low	69.9	Low	57 Å²	57	147.6 Å²	147.6	59%	0.588	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	18.8	170.2	0	0	0	0	0	115.6	N896	N896-G900 PolarHBondContact O-N 3.36Å
901	R	64.6	Low	69.4	Low	218 Å²	218	147.4 Å²	147.4	82%	0.823	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128	8.1	164.9	-76	-174.7	174.4	-154	-0.1	112.2	C897 Q898 E899	C897-R901 WeakPolarHBondContact O-CG 3.39Å; Q898-R901 PolarHBondContact O-N 2.77Å; E899-R901 PolarHBondContact O-N 2.77Å
902	R	58.1	Low	68.7	Low	233 Å²	233	145.8 Å²	145.8	88%	0.879	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.1	-26.3	178.5	-80.5	-178.9	164.5	-170.7	-4.8	112	Q898 E899	Q898-R902 PolarHBondContact O-N 3.17Å; E899-R902 PolarHBondContact O-N 3.48Å
903	S	50.8	Low	68	Low	156 Å²	156	146.7 Å²	146.7	100%	1.091	69%	0.69	S	S	*	*			trans	-76.1	0	143.1	-54.4	0	0	0	0	109.9	E899	E899-S903 PolarHBondContact O-N 2.81Å; E899-S903 VanDerWaalsContact O-N 3.09Å

Retrieved 903 of 903 residues in 334.8 ms (Link to these results)

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