A0A3Q0KC45_SCHMA Loading...

Putative transcription factor IWS1

AlphaFold DB , UniProt , Accession A0A3Q0KC45, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 623 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	46.3	Very low	44.6	Very low	212 Å²	212	147.3 Å²	147.3	100%	1.044	81%	0.811	S	S	*	*				0	62.7	0	-62.1	175.1	-173.5	0	0	106.2
2	E	42.9	Very low	44.2	Very low	163 Å²	163	148 Å²	148	76%	0.762	81%	0.813	S	S	*	*				79.4	134	62.2	-67.2	136.6	-126.5	0	0	110.5
3	D	45.3	Very low	44.5	Very low	156 Å²	156	151.8 Å²	151.8	83%	0.834	82%	0.821	S	S	*	*			cis	-166.2	-172.4	-22	-145.3	-33.6	0	0	0	108.2
4	S	48.7	Very low	44.8	Very low	96 Å²	96	153.8 Å²	153.8	67%	0.671	82%	0.822	S	S	*	*			trans	72.9	95.2	161.7	-162.2	0	0	0	0	117.5
5	S	41.7	Very low	45.1	Very low	102 Å²	102	155 Å²	155	71%	0.713	83%	0.829	S	S	*	*			trans	-18.2	144.3	135.7	51.8	0	0	0	0	117.7
6	F	47.5	Very low	45.2	Very low	186 Å²	186	149.3 Å²	149.3	82%	0.816	82%	0.818	S	S	*	*				-142.9	143.8	126.9	-166.2	-106.3	0	0	0	108.2
7	E	42	Very low	45.2	Very low	175 Å²	175	151.1 Å²	151.1	82%	0.818	81%	0.811	S	S	*	*			trans	-105.6	147	178.3	-63.9	174.4	139.4	0	0	108.5
8	D	48.1	Very low	46.1	Very low	157 Å²	157	147 Å²	147	84%	0.84	79%	0.789	S	S	*	*			trans	-141.8	147.9	167.7	-116.3	-43.6	0	0	0	109.1
9	E	43.4	Very low	46.9	Very low	181 Å²	181	143.4 Å²	143.4	85%	0.846	78%	0.775	S	S	*	*			trans	-107.5	178	-156.2	-150.3	-179.1	158.3	0	0	113
10	S	46.2	Very low	47.5	Very low	121 Å²	121	142.4 Å²	142.4	85%	0.846	77%	0.773	S	S	*	*			trans	70.2	141.6	178.9	74.1	0	0	0	0	116.9
11	G	38.5	Very low	47.4	Very low	71 Å²	71	145.4 Å²	145.4	73%	0.732	77%	0.773	S	S	*	*			cis	135.4	90.4	-9.6	0	0	0	0	0	113.6
12	D	40.2	Very low	47.1	Very low	156 Å²	156	141.1 Å²	141.1	83%	0.834	77%	0.765	S	S	*	*			trans	-163.7	77.5	164.7	-122.2	-16.5	0	0	0	109.4	H14	D12-H14 PolarHBondContact O-N 3.15Å
13	E	47.4	Very low	47.2	Very low	197 Å²	197	144.2 Å²	144.2	92%	0.921	77%	0.769	S	S	*	*			trans	-90.6	94.4	173.4	-70.8	-164.6	142.9	0	0	110	D15	E13-D15 PolarHBondContact O-N 2.99Å; E13-D15 VanDerWaalsContact O-N 3.17Å
14	H	49.4	Very low	47.4	Very low	180 Å²	180	144.2 Å²	144.2	83%	0.833	77%	0.768	S	S	*	*			trans	-67.9	105.1	170	-111.4	-69.9	0	0	0	109.9	D12 G16	D12-H14 PolarHBondContact O-N 3.15Å; H14-G16 PolarHBondContact O-N 3.43Å
15	D	48.8	Very low	47.3	Very low	172 Å²	172	145 Å²	145	92%	0.92	77%	0.768	S	S	*	*			trans	-68.6	78.4	171.6	-109.5	-22.3	0	0	0	110.7	E13	E13-D15 PolarHBondContact O-N 2.99Å; E13-D15 VanDerWaalsContact O-N 3.17Å
16	G	46.7	Very low	47.7	Very low	64 Å²	64	146.2 Å²	146.2	66%	0.66	77%	0.767	S	S	*	*			trans	-81.9	124.6	175.4	0	0	0	0	0	111.7	H14 D18	H14-G16 PolarHBondContact O-N 3.43Å; G16-D18 PolarHBondContact O-N 2.89Å
17	Y	45.5	Very low	48.1	Very low	180 Å²	180	143.5 Å²	143.5	71%	0.706	76%	0.76	S	S	*	*			trans	-63.1	113.4	177.8	-175.6	-94	0	0	0	111.6	P19	Y17-P19 HydrophobicContact CD1-CB 4.39Å; Y17-P19 HydrophobicContact CE1-CB 4.06Å; Y17-P19 VanDerWaalsContact O-CD 3.28Å; Y17-P19 WeakPolarHBondContact O-CD 3.3Å
18	D	61.4	Low	48.9	Very low	77 Å²	77	143.8 Å²	143.8	41%	0.412	76%	0.762	S	S	.	*			trans	-89.8	104	172.3	177.2	-2.8	0	0	0	109.9	G16 V20 R21	G16-D18 PolarHBondContact O-N 2.89Å; D18-V20 PolarHBondContact O-N 3.31Å; D18-V20 VanDerWaalsContact O-N 3.1Å; D18-V20 WeakPolarHBondContact OD1-CB 3.44Å; D18-V20 PolarHBondContact OD1-N 2.93Å; D18-R21 PolarHBondContact O-N 3.2Å; D18-R21 WeakPolarHBondContact OD2-CD 3.49Å; D18-R21 WeakPolarHBondContact OD2-CG 3.34Å; D18-R21 IonicContact OD2-NE 3.48Å
19	P	60.4	Low	49.3	Very low	79 Å²	79	143.9 Å²	143.9	51%	0.513	76%	0.762	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69	-6.6	-177.7	30	-36.2	0	0	0	113.8	Y17	Y17-P19 HydrophobicContact CD1-CB 4.39Å; Y17-P19 HydrophobicContact CE1-CB 4.06Å; Y17-P19 VanDerWaalsContact O-CD 3.28Å; Y17-P19 WeakPolarHBondContact O-CD 3.3Å
20	V	60.5	Low	50	Low	123 Å²	123	141.1 Å²	141.1	75%	0.745	76%	0.758	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.3	-9.3	-174.4	-161.4	0	0	0	0	112.2	D18	D18-V20 PolarHBondContact O-N 3.31Å; D18-V20 VanDerWaalsContact O-N 3.1Å; D18-V20 WeakPolarHBondContact OD1-CB 3.44Å; D18-V20 PolarHBondContact OD1-N 2.93Å
21	R	45.5	Very low	50.3	Low	205 Å²	205	139.6 Å²	139.6	77%	0.774	75%	0.752	S	S	*	*			trans	-106.5	73.6	-175.1	-78.1	-174.3	175.7	-145.3	-2.4	114.6	D18 R23	D18-R21 PolarHBondContact O-N 3.2Å; D18-R21 WeakPolarHBondContact OD2-CD 3.49Å; D18-R21 WeakPolarHBondContact OD2-CG 3.34Å; D18-R21 IonicContact OD2-NE 3.48Å; R21-R23 VanDerWaalsContact C-N 3.28Å; R21-R23 PolarHBondContact O-N 3.35Å
22	S	39	Very low	50.9	Low	123 Å²	123	145.9 Å²	145.9	86%	0.86	76%	0.755	S	S	*	*			trans	-71.6	68.7	174.2	51.6	0	0	0	0	114.4
23	R	44.8	Very low	52	Low	227 Å²	227	147.2 Å²	147.2	86%	0.857	75%	0.754	S	S	*	*			trans	-137.7	103.1	166.8	-70.4	-168.7	-179.7	-177.3	1.3	112	R21 V25	R21-R23 VanDerWaalsContact C-N 3.28Å; R21-R23 PolarHBondContact O-N 3.35Å; R23-V25 PolarHBondContact O-N 3.29Å
24	I	49.3	Very low	52.3	Low	157 Å²	157	142.7 Å²	142.7	81%	0.805	74%	0.741	S	S	*	*			trans	-63.1	128.2	168.3	-62.7	169.7	0	0	0	108.5
25	V	46.8	Very low	52.5	Low	112 Å²	112	145.8 Å²	145.8	68%	0.679	75%	0.746	S	S	*	*			trans	-102	105	172.6	178.5	0	0	0	0	107.9	R23 N27	R23-V25 PolarHBondContact O-N 3.29Å; V25-N27 VanDerWaalsContact C-N 3.35Å; V25-N27 PolarHBondContact O-N 3.1Å
26	D	50.5	Low	52.3	Low	128 Å²	128	147.3 Å²	147.3	68%	0.684	74%	0.74	S	S	*	*			trans	-67.2	89	176.3	-74.2	-34.5	0	0	0	110.8	Q28	D26-Q28 VanDerWaalsContact C-N 3.32Å; D26-Q28 PolarHBondContact O-N 2.9Å
27	N	55.5	Low	52.8	Low	128 Å²	128	150 Å²	150	68%	0.684	74%	0.743	S	S	*	*			trans	-75.9	82.7	173.8	-104.3	-24.7	0	0	0	110.4	V25 N29 V30	V25-N27 VanDerWaalsContact C-N 3.35Å; V25-N27 PolarHBondContact O-N 3.1Å; N27-N29 PolarHBondContact O-N 3.15Å; N27-V30 PolarHBondContact O-N 3.49Å
28	Q	59	Low	53.1	Low	181 Å²	181	145.6 Å²	145.6	85%	0.846	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.4	0	-172.3	-65.4	-178.7	-4.9	0	0	116.3	D26	D26-Q28 VanDerWaalsContact C-N 3.32Å; D26-Q28 PolarHBondContact O-N 2.9Å
29	N	56.1	Low	52.5	Low	159 Å²	159	147.8 Å²	147.8	85%	0.85	76%	0.758	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.7	-2.4	-177.9	-74.9	-15.7	0	0	0	115	N27 A31	N27-N29 PolarHBondContact O-N 3.15Å; N29-A31 PolarHBondContact O-N 2.85Å
30	V	58.9	Low	52.1	Low	124 Å²	124	153.1 Å²	153.1	75%	0.752	78%	0.776	S	S	*	*			trans	-95.8	87.7	-178.6	-172.9	0	0	0	0	111.3	N27 Y32	N27-V30 PolarHBondContact O-N 3.49Å; V30-Y32 PolarHBondContact O-N 3Å
31	A	52.4	Low	51.6	Low	88 Å²	88	151.5 Å²	151.5	73%	0.727	78%	0.776	S	S	*	*			trans	-75.2	111.5	177.6	0	0	0	0	0	112.1	N29 K33	N29-A31 PolarHBondContact O-N 2.85Å; A31-K33 PolarHBondContact O-N 3.35Å
32	Y	51.6	Low	51.6	Low	203 Å²	203	149.9 Å²	149.9	80%	0.796	78%	0.783	S	S	*	*			trans	-59.1	130.5	176.8	179.9	-94.5	0	0	0	112.2	V30 P34	V30-Y32 PolarHBondContact O-N 3Å; Y32-P34 HydrophobicContact CE1-CB 4.03Å; Y32-P34 HydrophobicContact CE1-CG 4.43Å
33	K	62.3	Low	51.9	Low	185 Å²	185	153.3 Å²	153.3	80%	0.804	79%	0.785	S	S	*	*			trans	-124	116.9	171.6	-71.2	-175.3	179.2	178.7	0	109.6	A31	A31-K33 PolarHBondContact O-N 3.35Å
34	P	54.8	Low	52	Low	102 Å²	102	150.1 Å²	150.1	66%	0.662	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-69.8	132.7	175.5	28.3	-33	0	0	0	110.6	Y32	Y32-P34 HydrophobicContact CE1-CB 4.03Å; Y32-P34 HydrophobicContact CE1-CG 4.43Å
35	R	52.5	Low	52	Low	244 Å²	244	148.5 Å²	148.5	92%	0.921	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-84.9	131.9	163	-89.2	-175.7	169.5	176.8	-2.8	109
36	Y	45.1	Very low	52	Low	205 Å²	205	146.8 Å²	146.8	80%	0.804	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-86.5	136	166.3	-174.9	-97.4	0	0	0	109.1	P38	Y36-P38 HydrophobicContact CD1-CG 4.37Å; Y36-P38 HydrophobicContact CE1-CG 4.27Å
37	V	56.9	Low	51.7	Low	120 Å²	120	146.3 Å²	146.3	73%	0.727	80%	0.799	S	S	*	*			trans	-117.5	117.7	173.7	-177.3	0	0	0	0	106.9
38	P	52.5	Low	51.7	Low	88 Å²	88	148.4 Å²	148.4	57%	0.571	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-65.7	147.8	172.2	-17.5	31.6	0	0	0	110.8	Y36 E40	Y36-P38 HydrophobicContact CD1-CG 4.37Å; Y36-P38 HydrophobicContact CE1-CG 4.27Å; P38-E40 PolarHBondContact O-N 3.09Å
39	S	48.2	Very low	51.3	Low	123 Å²	123	145.9 Å²	145.9	86%	0.86	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-63.7	129.9	169.5	-55.5	0	0	0	0	110.4
40	E	51.5	Low	51.3	Low	191 Å²	191	146.8 Å²	146.8	89%	0.893	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-72.3	155.8	165.5	-61.1	-174.6	148.7	0	0	109.6	P38	P38-E40 PolarHBondContact O-N 3.09Å
41	A	49.6	Very low	50.7	Low	89 Å²	89	145.9 Å²	145.9	74%	0.736	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-102.1	142.8	-176	0	0	0	0	0	111.6	E43	A41-E43 PolarHBondContact O-N 3.3Å
42	D	47.1	Very low	50.7	Low	171 Å²	171	149.3 Å²	149.3	91%	0.914	81%	0.812	S	S	*	*			trans	-70.5	81.7	179.3	-66.1	-69.7	0	0	0	112.8	N44	D42-N44 VanDerWaalsContact C-N 3.34Å; D42-N44 PolarHBondContact O-N 2.99Å; D42-N44 VanDerWaalsContact O-N 3.1Å
43	E	44.5	Very low	50.7	Low	194 Å²	194	146.3 Å²	146.3	91%	0.907	81%	0.809	S	S	*	*			trans	-80.7	80.5	166.2	-74.5	-158.2	-164.3	0	0	111.3	A41	A41-E43 PolarHBondContact O-N 3.3Å
44	N	47.4	Very low	50.1	Low	161 Å²	161	145.7 Å²	145.7	86%	0.861	81%	0.814	S	S	*	*			trans	-142.4	59.7	169.8	-149.3	8.7	0	0	0	112.2	D42	D42-N44 VanDerWaalsContact C-N 3.34Å; D42-N44 PolarHBondContact O-N 2.99Å; D42-N44 VanDerWaalsContact O-N 3.1Å
45	S	48.8	Very low	49.7	Very low	122 Å²	122	149 Å²	149	85%	0.853	82%	0.821	S	S	*	*			trans	-107	99	175.4	-165.2	0	0	0	0	110.3
46	G	47.5	Very low	49.4	Very low	76 Å²	76	143 Å²	143	78%	0.784	81%	0.807	S	S	*	*			trans	-73.9	123.6	179.1	0	0	0	0	0	111.9
47	S	43	Very low	49.5	Very low	119 Å²	119	140.3 Å²	140.3	83%	0.832	80%	0.801	S	S	*	*			trans	-77.3	126.3	174.9	57.9	0	0	0	0	111.8
48	D	55.6	Low	48.8	Very low	172 Å²	172	142.4 Å²	142.4	92%	0.92	81%	0.808	S	S	*	*			trans	-120.4	133.4	157.1	-114.8	-33.3	0	0	0	108.8
49	D	51.1	Low	48.2	Very low	128 Å²	128	143.2 Å²	143.2	68%	0.684	82%	0.815	S	S	*	*			trans	-110.3	116.7	-168.6	170.8	24.9	0	0	0	110.6
50	L	56.8	Low	47.9	Very low	178 Å²	178	148 Å²	148	93%	0.932	82%	0.816	S	S	*	*			trans	-138.7	115.4	163.3	-75.7	-179.7	0	0	0	110.2
51	S	45.3	Very low	47.4	Very low	104 Å²	104	143 Å²	143	73%	0.727	80%	0.802	S	S	*	*			trans	-105.9	143.3	176.1	30.7	0	0	0	0	110.8
52	D	53.5	Low	47.1	Very low	161 Å²	161	146.3 Å²	146.3	86%	0.861	80%	0.802	S	S	*	*			trans	-152	147.1	148.8	-148	-10.9	0	0	0	109.7
53	D	51.9	Low	47	Very low	139 Å²	139	144.7 Å²	144.7	74%	0.743	79%	0.793	S	S	*	*			trans	-86.2	152.3	-173.9	-77.6	-60.4	0	0	0	112.2
54	L	49.7	Very low	47.1	Very low	173 Å²	173	141.3 Å²	141.3	91%	0.906	79%	0.788	S	S	*	*				-176	150.8	115.7	-98.5	162.1	0	0	0	113.3
55	E	45.9	Very low	47.7	Very low	172 Å²	172	139.7 Å²	139.7	80%	0.804	79%	0.786	S	S	*	*			trans	-97.2	161.3	-167.5	-47.3	177.4	107.4	0	0	114
56	D	46.2	Very low	47.5	Very low	117 Å²	117	145.6 Å²	145.6	63%	0.626	79%	0.79	S	S	*	*			trans	62.2	117.6	137.3	-142.3	-6.4	0	0	0	120.4
57	H	47.2	Very low	47.4	Very low	149 Å²	149	147.3 Å²	147.3	69%	0.69	79%	0.79	S	S	*	*				169.5	117.4	108.4	-84.1	-27.4	0	0	0	115.4
58	L	41	Very low	48	Very low	164 Å²	164	147 Å²	147	86%	0.859	79%	0.785	S	S	*	*			trans	65.5	160.5	137.2	-58.8	175.9	0	0	0	121
59	S	41	Very low	47.6	Very low	104 Å²	104	144.6 Å²	144.6	73%	0.727	78%	0.776	S	S	*	*			trans	-112.9	155.7	-170.6	55.7	0	0	0	0	113
60	Y	41.4	Very low	47.3	Very low	225 Å²	225	145.2 Å²	145.2	88%	0.882	78%	0.779	S	S	*	*			trans	-162.1	165.7	133.7	-131.4	-103.1	0	0	0	112.9
61	S	40.8	Very low	46.8	Very low	84 Å²	84	141.5 Å²	141.5	59%	0.587	77%	0.768	S	S	*	*			trans	-97.3	145.7	178.7	171	0	0	0	0	111.9
62	H	43.3	Very low	47	Very low	160 Å²	160	142.4 Å²	142.4	74%	0.741	77%	0.772	S	S	*	*				177.9	132.6	123.7	-91.7	3.8	0	0	0	116.1
63	N	45.3	Very low	46.6	Very low	136 Å²	136	140.7 Å²	140.7	73%	0.727	77%	0.773	S	S	*	*			trans	33.8	133.4	141.9	-57.1	-21.6	0	0	0	123
64	P	46.4	Very low	46	Very low	123 Å²	123	142.7 Å²	142.7	80%	0.799	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-89.5	157.4	170.7	37	-35.4	0	0	0	114.5
65	P	60.3	Low	45.8	Very low	128 Å²	128	144 Å²	144	83%	0.831	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-96.4	172.1	173.1	37.7	-34.3	0	0	0	114.4
66	R	45.4	Very low	45.3	Very low	246 Å²	246	140.7 Å²	140.7	93%	0.928	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-97.4	165.5	-178.9	-70.9	178	166.7	-164.3	-5.4	113.8
67	S	45.3	Very low	45.4	Very low	111 Å²	111	142.9 Å²	142.9	78%	0.776	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-66.9	169.6	166.7	57.8	0	0	0	0	113.5
68	P	54.1	Low	44.9	Very low	113 Å²	113	141.9 Å²	141.9	73%	0.734	79%	0.789	S	S	*	*				-158	150.2	100.5	39.9	-20.4	0	0	0	119.6
69	V	48.3	Very low	45.2	Very low	121 Å²	121	143.7 Å²	143.7	73%	0.733	79%	0.789	S	S	*	*			trans	78.6	137.3	130.2	168.8	0	0	0	0	124
70	D	44.3	Very low	45	Very low	141 Å²	141	143.5 Å²	143.5	75%	0.754	79%	0.788	S	S	*	*			trans	65.5	149.7	157.7	-82.7	-35.2	0	0	0	121.7
71	S	47.1	Very low	44.8	Very low	100 Å²	100	140.1 Å²	140.1	70%	0.699	78%	0.781	S	S	*	*			cis	-162.6	168	-16.8	-125.6	0	0	0	0	110.3
72	P	48.5	Very low	44.7	Very low	123 Å²	123	143.5 Å²	143.5	80%	0.799	79%	0.787	S	S	*	*			trans	-105.7	161.5	-167.1	39.4	-35.1	0	0	0	117
73	S	44.5	Very low	44.2	Very low	126 Å²	126	142.6 Å²	142.6	88%	0.881	79%	0.788	S	S	*	*			trans	-156.6	152.7	159	62.2	0	0	0	0	113.4
74	E	40	Very low	43.8	Very low	180 Å²	180	144.7 Å²	144.7	84%	0.841	79%	0.793	S	S	*	*			trans	-87.9	158.3	-173.4	-48.8	168.3	130.5	0	0	113.3
75	H	45	Very low	43.3	Very low	202 Å²	202	148.3 Å²	148.3	94%	0.935	80%	0.796	S	S	*	*			trans	-161.2	142	139.1	-94.5	-48.5	0	0	0	112.3
76	S	36.9	Very low	42.2	Very low	102 Å²	102	147.6 Å²	147.6	71%	0.713	79%	0.794	S	S	*	*			trans	-114.5	144.5	178	169.2	0	0	0	0	111.1
77	I	46.8	Very low	41.7	Very low	163 Å²	163	139.3 Å²	139.3	84%	0.836	79%	0.786	S	S	*	*			trans	-148.3	131.9	157.7	-98.1	148.6	0	0	0	108.4
78	V	38.4	Very low	41.4	Very low	128 Å²	128	142.4 Å²	142.4	78%	0.776	79%	0.793	S	S	*	*			trans	-107.7	139.6	170.9	174.8	0	0	0	0	108.6
79	K	45.6	Very low	40.7	Very low	201 Å²	201	144.8 Å²	144.8	87%	0.874	80%	0.799	S	S	*	*			trans	-152	151.5	161.8	-112	175.2	-175.1	-179.1	0	111.1
80	S	37.6	Very low	40.5	Very low	101 Å²	101	146.4 Å²	146.4	71%	0.706	80%	0.804	S	S	*	*			trans	-132.8	173.5	-168.5	51.8	0	0	0	0	111.8
81	E	37	Very low	40.3	Very low	154 Å²	154	150 Å²	150	72%	0.72	81%	0.808	S	S	*	*			trans	94.1	119.1	160.7	-57.5	-154.6	88.8	0	0	120.3
82	Q	38.2	Very low	40.1	Very low	155 Å²	155	153.4 Å²	153.4	72%	0.724	82%	0.818	S	S	*	*			trans	75.5	109.7	137.4	-64.1	177.2	37	0	0	121.1
83	N	33.6	Very low	40	Very low	141 Å²	141	157.8 Å²	157.8	75%	0.754	82%	0.819	S	S	*	*			trans	36.6	124.4	132.7	-60.7	-7.5	0	0	0	120.1
84	H	37.5	Very low	40	Very low	180 Å²	180	159.3 Å²	159.3	83%	0.833	81%	0.812	S	S	*	*				-167.6	156.4	97.8	-103.5	-74.4	0	0	0	113.2
85	F	34.2	Very low	39.9	Very low	198 Å²	198	160.9 Å²	160.9	87%	0.868	81%	0.812	S	S	*	*			trans	-35.5	137.1	169.8	-93.9	-124.6	0	0	0	115.2
86	S	38.2	Very low	39.7	Very low	113 Å²	113	158.8 Å²	158.8	79%	0.79	80%	0.802	S	S	*	*				177.2	129.5	97.2	56.1	0	0	0	0	114.4
87	G	35.5	Very low	40.1	Very low	73 Å²	73	160 Å²	160	75%	0.753	81%	0.806	S	S	*	*			trans	40.5	111.8	146.8	0	0	0	0	0	121.7
88	N	37.6	Very low	39.9	Very low	175 Å²	175	160.1 Å²	160.1	94%	0.936	80%	0.802	S	S	*	*				-143.1	145.3	124.5	-106.3	-21.7	0	0	0	109
89	L	39	Very low	40.7	Very low	163 Å²	163	159.2 Å²	159.2	85%	0.853	80%	0.799	S	S	*	*			trans	-123	123.9	-178.9	-74.5	164.2	0	0	0	108.4
90	D	44	Very low	41	Very low	155 Å²	155	156.5 Å²	156.5	83%	0.829	80%	0.799	S	S	*	*			trans	-178.4	162.4	146.2	-103.8	-29.6	0	0	0	109.2
91	Y	41.6	Very low	41.6	Very low	217 Å²	217	157.5 Å²	157.5	85%	0.851	80%	0.801	S	S	*	*			trans	98.9	16.5	-179.8	-59.2	-65	0	0	0	119.7	R93	Y91-R93 PolarHBondContact O-N 3.49Å; Y91-R93 VanDerWaalsContact O-N 3.15Å
92	D	42.7	Very low	41.9	Very low	171 Å²	171	156.1 Å²	156.1	91%	0.914	80%	0.798	S	S	*	*			trans	-75.1	94.9	150.3	-75	-45.7	0	0	0	109.3
93	R	46.1	Very low	42.6	Very low	216 Å²	216	155.5 Å²	155.5	82%	0.815	81%	0.805	S	S	*	*			trans	-101.9	83.3	164.8	-92.9	-171.5	171.6	179.1	-2.7	109.5	Y91 Y95	Y91-R93 PolarHBondContact O-N 3.49Å; Y91-R93 VanDerWaalsContact O-N 3.15Å; R93-Y95 PolarHBondContact O-N 3.44Å
94	E	44.3	Very low	43	Very low	158 Å²	158	154.2 Å²	154.2	74%	0.738	80%	0.802	S	S	*	*			trans	-62.4	115	171.6	-172.2	167.3	-157.9	0	0	109.9	H96	E94-H96 PolarHBondContact O-N 2.89Å
95	Y	38.8	Very low	43.7	Very low	212 Å²	212	151.2 Å²	151.2	83%	0.831	80%	0.797	S	S	*	*			trans	-76.7	89.5	175.1	-88.6	-103.5	0	0	0	109.4	R93 V97	R93-Y95 PolarHBondContact O-N 3.44Å; Y95-V97 PolarHBondContact O-N 3.03Å
96	H	41.1	Very low	44.6	Very low	158 Å²	158	147.9 Å²	147.9	73%	0.731	80%	0.795	S	S	*	*			trans	-64	99.3	165.7	-91.3	-60	0	0	0	110.2	E94 E98	E94-H96 PolarHBondContact O-N 2.89Å; H96-E98 PolarHBondContact O-N 2.8Å
97	V	44.3	Very low	44.9	Very low	129 Å²	129	146 Å²	146	78%	0.782	79%	0.793	S	S	*	*			trans	-76	109	162.7	-179.3	0	0	0	0	107.4	Y95	Y95-V97 PolarHBondContact O-N 3.03Å
98	E	42.1	Very low	45.3	Very low	164 Å²	164	153.7 Å²	153.7	77%	0.766	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-59	135.5	168.5	-71	-95.4	114.6	0	0	109	H96 V100	H96-E98 PolarHBondContact O-N 2.8Å; E98-V100 PolarHBondContact O-N 3.15Å
99	P	55.2	Low	45.7	Very low	109 Å²	109	149.4 Å²	149.4	71%	0.708	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-66.1	123.9	176	27.7	-33.1	0	0	0	109.7	V101	P99-V101 PolarHBondContact O-N 3.45Å
100	V	51.9	Low	46.1	Very low	145 Å²	145	147.5 Å²	147.5	88%	0.879	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-57.4	124.9	173.1	178.1	0	0	0	0	108.5	E98 D102	E98-V100 PolarHBondContact O-N 3.15Å; V100-D102 PolarHBondContact O-N 3.01Å
101	V	50.9	Low	46.4	Very low	122 Å²	122	146 Å²	146	74%	0.739	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-80.1	118.5	-178.1	-162.9	0	0	0	0	108.5	P99 V103	P99-V101 PolarHBondContact O-N 3.45Å; V101-V103 WeakPolarHBondContact O-CG2 3.22Å; V101-V103 PolarHBondContact O-N 3.06Å
102	D	43.3	Very low	46.6	Very low	125 Å²	125	144.6 Å²	144.6	67%	0.668	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-67.2	118.2	177.9	-125.3	-39	0	0	0	110.8	V100 T104	V100-D102 PolarHBondContact O-N 3.01Å; D102-T104 VanDerWaalsContact C-N 3.35Å; D102-T104 PolarHBondContact OD1-OG1 3.42Å
103	V	53.3	Low	46.3	Very low	141 Å²	141	141.2 Å²	141.2	86%	0.855	79%	0.786	S	S	*	*			trans	-96.4	14.3	-170.2	-158.2	0	0	0	0	112.2	V101	V101-V103 WeakPolarHBondContact O-CG2 3.22Å; V101-V103 PolarHBondContact O-N 3.06Å
104	T	42.1	Very low	46.4	Very low	114 Å²	114	138.8 Å²	138.8	70%	0.699	79%	0.789	S	S	*	*			trans	-118	-6.6	-165.9	56.6	0	0	0	0	115.2	D102 P106	D102-T104 VanDerWaalsContact C-N 3.35Å; D102-T104 PolarHBondContact OD1-OG1 3.42Å; T104-P106 WeakPolarHBondContact O-CD 3.33Å
105	T	52.6	Low	46.6	Very low	118 Å²	118	137.7 Å²	137.7	72%	0.724	79%	0.793	S	S	*	*	S	Bend	trans	-90.1	119.7	177.3	13	0	0	0	0	112.4	G107	T105-G107 PolarHBondContact O-N 3.01Å; T105-G107 VanDerWaalsContact O-N 3.11Å
106	P	53	Low	46.8	Very low	127 Å²	127	133.3 Å²	133.3	83%	0.825	79%	0.79	S	S	*	*			trans	-69.1	108	179.3	-21.6	34.8	0	0	0	113	T104 Y108	T104-P106 WeakPolarHBondContact O-CD 3.33Å; P106-Y108 PolarHBondContact O-N 2.71Å
107	G	44.4	Very low	47.1	Very low	74 Å²	74	135.2 Å²	135.2	76%	0.763	80%	0.799	S	S	*	*			trans	-68.5	115.4	-177.4	0	0	0	0	0	114.4	T105 A109	T105-G107 PolarHBondContact O-N 3.01Å; T105-G107 VanDerWaalsContact O-N 3.11Å; G107-A109 PolarHBondContact O-N 2.71Å; G107-A109 VanDerWaalsContact O-N 3.1Å
108	Y	43.6	Very low	47.1	Very low	235 Å²	235	134.9 Å²	134.9	92%	0.922	80%	0.803	S	S	*	*			trans	-75.6	96.3	179	-143.8	-83.9	0	0	0	111.6	P106	P106-Y108 PolarHBondContact O-N 2.71Å
109	A	46.5	Very low	47.3	Very low	85 Å²	85	132 Å²	132	70%	0.702	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-76.6	124.9	-172	0	0	0	0	0	113.8	G107	G107-A109 PolarHBondContact O-N 2.71Å; G107-A109 VanDerWaalsContact O-N 3.1Å
110	P	47.6	Very low	46.9	Very low	123 Å²	123	132.6 Å²	132.6	80%	0.799	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-78.8	127.3	173.9	30.9	-32.8	0	0	0	111.6
111	S	49.2	Very low	46.4	Very low	122 Å²	122	129.8 Å²	129.8	85%	0.853	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-61.6	133.6	-177.7	-46.6	0	0	0	0	113.4
112	Q	45.1	Very low	45.9	Very low	188 Å²	188	132.2 Å²	132.2	88%	0.879	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-70.6	141.2	175.3	-60.5	-177.6	18.5	0	0	111.5
113	A	37	Very low	45.9	Very low	101 Å²	101	131.4 Å²	131.4	84%	0.835	81%	0.809	S	S	*	*			trans	-96.7	114.6	175.8	0	0	0	0	0	111.1
114	L	47.9	Very low	45.2	Very low	165 Å²	165	134.7 Å²	134.7	86%	0.864	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-93.8	148.3	171.8	-77.1	166.8	0	0	0	111.7
115	T	48.4	Very low	45.1	Very low	134 Å²	134	134.1 Å²	134.1	82%	0.822	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-82.5	142.6	-172.8	48.4	0	0	0	0	113.3
116	P	44.4	Very low	44.4	Very low	121 Å²	121	132.3 Å²	132.3	79%	0.786	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-94.8	143.6	-178.4	35.9	-33.6	0	0	0	113.9
117	E	46.8	Very low	43.8	Very low	197 Å²	197	131.6 Å²	131.6	92%	0.921	81%	0.811	S	S	*	*			trans	-138.6	153	157.6	-78	-147.8	131	0	0	112.3
118	S	43.9	Very low	43.7	Very low	122 Å²	122	136 Å²	136	85%	0.853	81%	0.811	S	S	*	*			trans	52	99	169.5	-153.9	0	0	0	0	120.5
119	S	46.5	Very low	43.5	Very low	105 Å²	105	133.4 Å²	133.4	73%	0.734	81%	0.808	S	S	*	*			trans	-75.5	-159.2	153.2	-37.5	0	0	0	0	110.8
120	P	46.7	Very low	43.1	Very low	121 Å²	121	133.3 Å²	133.3	79%	0.786	81%	0.807	S	S	*	*			cis	-138.5	173.2	-13.5	39.4	-21.6	0	0	0	116.4
121	A	40.9	Very low	42.5	Very low	86 Å²	86	132.2 Å²	132.2	71%	0.711	80%	0.802	S	S	*	*			trans	146.7	109.4	145.4	0	0	0	0	0	110.1
122	L	40.1	Very low	42	Very low	173 Å²	173	133.8 Å²	133.8	91%	0.906	80%	0.801	S	S	*	*				57	123.2	79.2	-58.6	176.3	0	0	0	112.3
123	S	43.4	Very low	41.8	Very low	107 Å²	107	131.3 Å²	131.3	75%	0.748	80%	0.798	S	S	*	*			cis	-154.6	135.4	28.9	58	0	0	0	0	113.3
124	Y	39.5	Very low	41.9	Very low	211 Å²	211	133.5 Å²	133.5	83%	0.827	80%	0.796	S	S	*	*				85.8	106.4	104.6	-170.2	-93.2	0	0	0	118.4
125	S	39.5	Very low	41.2	Very low	102 Å²	102	133 Å²	133	71%	0.713	79%	0.793	S	S	*	*			trans	53	116.2	142.9	-144	0	0	0	0	121.5
126	G	39.1	Very low	40.9	Very low	80 Å²	80	132.6 Å²	132.6	83%	0.825	79%	0.791	S	S	*	*			trans	-168.2	127.6	162.2	0	0	0	0	0	108
127	S	40.5	Very low	40.6	Very low	111 Å²	111	137.8 Å²	137.8	78%	0.776	80%	0.795	S	S	*	*			trans	-110.7	167.9	-167.2	-167.7	0	0	0	0	112.6
128	E	42.1	Very low	40.3	Very low	167 Å²	167	137.7 Å²	137.7	78%	0.78	79%	0.791	S	S	*	*			trans	92.5	113.6	158.6	-57.6	-178.6	-166	0	0	120
129	H	38.3	Very low	40.2	Very low	181 Å²	181	137.7 Å²	137.7	84%	0.838	79%	0.786	S	S	*	*			trans	70.2	119.1	140	-82.7	-72.1	0	0	0	124.3
130	A	38.1	Very low	39.9	Very low	83 Å²	83	140.1 Å²	140.1	69%	0.686	79%	0.791	S	S	*	*			trans	84.4	138.2	130.1	0	0	0	0	0	120.6
131	S	36.2	Very low	40	Very low	99 Å²	99	139.6 Å²	139.6	69%	0.692	79%	0.788	S	S	*	*			trans	28.1	122.1	150	54.5	0	0	0	0	118.2
132	D	38.4	Very low	40.2	Very low	155 Å²	155	142 Å²	142	83%	0.829	79%	0.789	S	S	*	*				-151.8	171.7	58.9	-92.6	-43.9	0	0	0	114.9
133	V	40.7	Very low	40.5	Very low	137 Å²	137	141 Å²	141	83%	0.83	78%	0.782	S	S	*	*			trans	-114.6	138.1	169.7	-75.3	0	0	0	0	110.3
134	D	38.6	Very low	40.3	Very low	147 Å²	147	141.4 Å²	141.4	79%	0.786	78%	0.783	S	S	*	*			trans	-136.4	138.8	179.3	-169.5	11.4	0	0	0	111
135	L	34	Very low	40.2	Very low	153 Å²	153	137.2 Å²	137.2	80%	0.801	78%	0.784	S	S	*	*			trans	-109	127.6	-174.5	-101.4	77.2	0	0	0	111
136	T	40.4	Very low	40.3	Very low	127 Å²	127	141.5 Å²	141.5	78%	0.779	79%	0.79	S	S	*	*			trans	-126	82.7	177.8	43.6	0	0	0	0	115
137	R	38.4	Very low	40.2	Very low	230 Å²	230	142.9 Å²	142.9	87%	0.868	78%	0.782	S	S	*	*			trans	38.6	132.8	131.8	-59.8	178.5	176.4	-166.5	-3.8	120.9
138	K	41.3	Very low	40.4	Very low	195 Å²	195	145.2 Å²	145.2	85%	0.848	78%	0.781	S	S	*	*			trans	177.4	149.3	131	-96.5	151.5	-177.4	175.6	0	111
139	T	40.8	Very low	40.1	Very low	121 Å²	121	145 Å²	145	74%	0.742	78%	0.779	S	S	*	*			cis	-176.6	131.6	-28.3	24.3	0	0	0	0	107.2
140	D	40.3	Very low	40.4	Very low	157 Å²	157	145.3 Å²	145.3	84%	0.84	78%	0.781	S	S	*	*			trans	-80.9	-179.8	172.2	-53.6	-77.6	0	0	0	113.4
141	P	50	Low	40.5	Very low	110 Å²	110	148.6 Å²	148.6	71%	0.714	79%	0.787	S	S	*	*				-153.1	154.4	106.4	38.7	-21.1	0	0	0	119.1
142	D	45.4	Very low	40.6	Very low	137 Å²	137	152.3 Å²	152.3	73%	0.733	79%	0.794	S	S	*	*			trans	60.9	129.9	142.9	-55.6	-16.3	0	0	0	122.6
143	I	45	Very low	40.8	Very low	150 Å²	150	151.2 Å²	151.2	77%	0.769	79%	0.792	S	S	*	*			cis	88.4	147	39.9	-67.2	169.8	0	0	0	112.7
144	P	39.9	Very low	40.6	Very low	117 Å²	117	153 Å²	153	76%	0.76	79%	0.792	S	S	*	*			cis	-129.2	178.6	-1.1	37	-18.9	0	0	0	117.2
145	S	36.4	Very low	40.9	Very low	123 Å²	123	155 Å²	155	86%	0.86	80%	0.796	S	S	*	*			trans	-92.6	176.4	166.6	-52.3	0	0	0	0	114.2
146	K	43.2	Very low	40.9	Very low	192 Å²	192	156.1 Å²	156.1	84%	0.835	80%	0.797	S	S	*	*			trans	-138.8	142.1	162	-173.2	-179.3	177.2	-168.1	0	111.8
147	V	35.5	Very low	41	Very low	109 Å²	109	155.8 Å²	155.8	66%	0.661	80%	0.8	S	S	*	*			trans	-107.1	156.9	-177.5	-177.9	0	0	0	0	111.7
148	H	45	Very low	40.8	Very low	160 Å²	160	152.6 Å²	152.6	74%	0.741	80%	0.8	S	S	*	*			trans	-156	133.1	145.2	-116.9	-76.3	0	0	0	111.4
149	E	35.5	Very low	40.8	Very low	162 Å²	162	149.4 Å²	149.4	76%	0.757	80%	0.803	S	S	*	*			trans	-96	156.4	165.9	-56.1	144.3	124.2	0	0	109.5
150	E	46.1	Very low	40.6	Very low	188 Å²	188	150.8 Å²	150.8	88%	0.879	81%	0.805	S	S	*	*			trans	-154.1	167.5	148	-70.2	-157.5	169.1	0	0	109.2
151	D	38.9	Very low	40.6	Very low	152 Å²	152	148.1 Å²	148.1	81%	0.813	80%	0.799	S	S	*	*			trans	-111.6	169.5	-146	-81.4	-63.8	0	0	0	119.1
152	E	38.8	Very low	40.3	Very low	176 Å²	176	151.7 Å²	151.7	82%	0.822	81%	0.806	S	S	*	*			trans	53.1	137.4	148.6	-74.2	-176.9	175.7	0	0	123.1
153	V	42.5	Very low	39.8	Very low	132 Å²	132	150.6 Å²	150.6	80%	0.8	81%	0.809	S	S	*	*				168.3	141.1	103.6	163.7	0	0	0	0	110.1
154	E	37	Very low	40	Very low	176 Å²	176	149.6 Å²	149.6	82%	0.822	81%	0.81	S	S	*	*			trans	-75.6	161.3	-179.8	-53.7	179.8	148.2	0	0	114.7
155	H	43.6	Very low	39.8	Very low	189 Å²	189	149.2 Å²	149.2	88%	0.875	81%	0.81	S	S	*	*			trans	-164.7	128.5	137.4	-111.3	-64.3	0	0	0	113.6
156	E	35.5	Very low	40.5	Very low	175 Å²	175	151.2 Å²	151.2	82%	0.818	81%	0.811	S	S	*	*			trans	-79.5	154.5	168.5	-60	-172.3	143	0	0	112.7
157	S	42.8	Very low	40.2	Very low	121 Å²	121	151 Å²	151	85%	0.846	81%	0.81	S	S	*	*			trans	-165.3	132.2	138.8	36.5	0	0	0	0	112.7
158	N	33.5	Very low	40.7	Very low	163 Å²	163	152.1 Å²	152.1	87%	0.872	81%	0.812	S	S	*	*			trans	-86.5	151.2	163.8	-72.7	-70	0	0	0	109.8
159	S	41.2	Very low	40.5	Very low	128 Å²	128	151.9 Å²	151.9	90%	0.895	81%	0.812	S	S	*	*			trans	-147.4	149.5	156	-167.3	0	0	0	0	110.9
160	D	36.5	Very low	40.7	Very low	149 Å²	149	152.4 Å²	152.4	80%	0.797	81%	0.814	S	S	*	*			trans	-109.6	-174	-166.3	-148.6	-31.8	0	0	0	111.4
161	S	40.7	Very low	40.4	Very low	102 Å²	102	149.3 Å²	149.3	71%	0.713	80%	0.799	S	S	*	*			trans	75.9	157	168.1	81.7	0	0	0	0	117.2
162	E	43.3	Very low	40.4	Very low	184 Å²	184	150.1 Å²	150.1	86%	0.86	80%	0.796	S	S	*	*			cis	-123.2	167.9	8.5	-71.6	-173.2	122.2	0	0	114
163	S	34.5	Very low	40.3	Very low	114 Å²	114	146.4 Å²	146.4	80%	0.797	78%	0.779	S	S	*	*			trans	-127.2	144	168	61.6	0	0	0	0	110.2
164	V	49.4	Very low	40.1	Very low	130 Å²	130	146.5 Å²	146.5	79%	0.788	77%	0.77	S	S	*	*			trans	-130.7	132.7	172	-178.4	0	0	0	0	108.7
165	S	35.4	Very low	40.2	Very low	109 Å²	109	145 Å²	145	76%	0.762	76%	0.763	S	S	*	*			trans	-122.6	145.3	170	-62.1	0	0	0	0	108.1
166	D	51.7	Low	40.1	Very low	164 Å²	164	144.7 Å²	144.7	88%	0.877	76%	0.762	S	S	*	*			trans	-138.8	157.9	158.8	-108.5	-42.3	0	0	0	110.8
167	K	36.7	Very low	40	Very low	187 Å²	187	140.9 Å²	140.9	81%	0.813	76%	0.761	S	S	*	*			trans	-133.8	158.2	-174.2	-69	178.3	175.4	179.3	0	110.3
168	D	45.9	Very low	40.3	Very low	133 Å²	133	142.9 Å²	142.9	71%	0.711	76%	0.762	S	S	*	*			trans	-170.1	128.8	133.5	-94	-14.2	0	0	0	108.7
169	Q	40.9	Very low	40.3	Very low	155 Å²	155	144.4 Å²	144.4	72%	0.724	76%	0.761	S	S	*	*				67.5	144.7	89.6	-68.8	-175.6	62.8	0	0	114.6
170	E	40.1	Very low	40.2	Very low	174 Å²	174	145.2 Å²	145.2	81%	0.813	76%	0.76	S	S	*	*			cis	-173.4	162.2	-30.5	-123.3	171	-115.7	0	0	106.7
171	E	39.6	Very low	40.1	Very low	122 Å²	122	146.9 Å²	146.9	57%	0.57	76%	0.763	S	S	*	*			cis	-151	-151.2	1.3	-164.9	-108.2	109.1	0	0	107.1	H173	E171-H173 IonicContact OE1-CE1 2.58Å; E171-H173 IonicContact OE1-CG 3.05Å; E171-H173 PolarHBondContact OE1-N 3.39Å; E171-H173 IonicContact OE1-ND1 3.17Å; E171-H173 PolarHBondContact OE1-ND1 3.42Å; E171-H173 IonicContact OE2-CE1 3.7Å; E171-H173 PolarHBondContact OE2-CE1 2.83Å; E171-H173 IonicContact OE2-ND1 2.86Å; E171-H173 PolarHBondContact OE2-ND1 3.31Å
172	F	38.1	Very low	40.1	Very low	169 Å²	169	149 Å²	149	74%	0.741	77%	0.772	S	S	*	*			trans	124.8	78.5	147	-107.9	-95.8	0	0	0	118.8
173	H	37.7	Very low	39.5	Very low	98 Å²	98	147.2 Å²	147.2	45%	0.454	77%	0.768	S	S	.	*				61.1	115.2	129.8	-78.3	45.8	0	0	0	119.4	E171	E171-H173 IonicContact OE1-CE1 2.58Å; E171-H173 IonicContact OE1-CG 3.05Å; E171-H173 PolarHBondContact OE1-N 3.39Å; E171-H173 IonicContact OE1-ND1 3.17Å; E171-H173 PolarHBondContact OE1-ND1 3.42Å; E171-H173 IonicContact OE2-CE1 3.7Å; E171-H173 PolarHBondContact OE2-CE1 2.83Å; E171-H173 IonicContact OE2-ND1 2.86Å; E171-H173 PolarHBondContact OE2-ND1 3.31Å
174	Q	36.9	Very low	39.8	Very low	135 Å²	135	147.5 Å²	147.5	63%	0.631	77%	0.77	S	S	*	*				72.7	149.9	91.2	-75.4	179.3	49.4	0	0	116
175	Q	39.8	Very low	39.2	Very low	143 Å²	143	146.5 Å²	146.5	67%	0.668	76%	0.764	S	S	*	*			cis	-113.6	-170.7	-17	-57.9	81.6	21.2	0	0	108.3
176	E	41.6	Very low	39.7	Very low	184 Å²	184	150.3 Å²	150.3	86%	0.86	77%	0.77	S	S	*	*			cis	-152.8	-169.4	1.6	-154.1	142.2	-103.3	0	0	109.7
177	A	34.3	Very low	39.2	Very low	95 Å²	95	149.6 Å²	149.6	79%	0.785	76%	0.759	S	S	*	*			trans	-150.8	152.1	176.5	0	0	0	0	0	112.9
178	D	49.2	Very low	39.2	Very low	162 Å²	162	150.2 Å²	150.2	87%	0.866	76%	0.758	S	S	*	*			trans	-148	156.5	163.3	-149.3	-15.2	0	0	0	112.6
179	K	33.7	Very low	39	Very low	195 Å²	195	149.7 Å²	149.7	85%	0.848	76%	0.762	S	S	*	*			trans	-142.7	128.8	-175.4	-81.7	-177.6	176.4	175.8	0	111.7
180	T	39	Very low	38.5	Very low	145 Å²	145	148.2 Å²	148.2	89%	0.89	76%	0.763	S	S	*	*			trans	-143.1	137.4	156.6	24.9	0	0	0	0	112.1
181	Q	33.4	Very low	38.6	Very low	184 Å²	184	146.7 Å²	146.7	86%	0.86	77%	0.766	S	S	*	*			trans	-100.5	147.8	166.3	-70.2	178.9	-20.9	0	0	109.3
182	V	40.6	Very low	38.4	Very low	146 Å²	146	149 Å²	149	89%	0.885	77%	0.774	S	S	*	*			trans	-151.6	143.5	156.9	-108.3	0	0	0	0	110.4
183	N	31.5	Very low	38.7	Very low	147 Å²	147	150 Å²	150	79%	0.786	78%	0.78	S	S	*	*			trans	-107.3	144.3	-179.5	-71.5	-46.5	0	0	0	111.6
184	S	40.7	Very low	38.6	Very low	121 Å²	121	151.9 Å²	151.9	85%	0.846	79%	0.794	S	S	*	*			trans	-169.8	126.3	144.9	-86	0	0	0	0	106.8
185	V	36.2	Very low	38.8	Very low	108 Å²	108	150.8 Å²	150.8	66%	0.655	80%	0.801	S	S	*	*			cis	88.6	92.3	28.6	-174.2	0	0	0	0	114.6	K187	V185-K187 HydrophobicContact CG1-CD 4.45Å; V185-K187 HydrophobicContact CG1-CG 4.46Å
186	E	46.4	Very low	38.6	Very low	190 Å²	190	149.8 Å²	149.8	89%	0.888	81%	0.807	S	S	*	*			trans	-165.3	154.2	141.4	-110.4	163.4	-160.6	0	0	107.6
187	K	40.8	Very low	38.4	Very low	149 Å²	149	148.9 Å²	148.9	65%	0.648	81%	0.807	S	S	*	*			cis	138.6	90.4	-28.1	-80.9	-163	178	-169.6	0	112.7	V185	V185-K187 HydrophobicContact CG1-CD 4.45Å; V185-K187 HydrophobicContact CG1-CG 4.46Å
188	Y	37	Very low	38.2	Very low	200 Å²	200	152.5 Å²	152.5	78%	0.784	81%	0.807	S	S	*	*			trans	31.7	154.4	136.3	-28.3	-70.3	0	0	0	121.7
189	P	40.8	Very low	37.4	Very low	122 Å²	122	149.7 Å²	149.7	79%	0.792	80%	0.8	S	S	*	*				-139.2	145.6	80.1	35.7	-21.3	0	0	0	115.5
190	T	31.1	Very low	37.6	Very low	124 Å²	124	148.8 Å²	148.8	76%	0.761	80%	0.804	S	S	*	*			trans	-109.3	135.5	161.3	47.5	0	0	0	0	109.8
191	T	41.9	Very low	37.4	Very low	141 Å²	141	149.4 Å²	149.4	87%	0.865	80%	0.796	S	S	*	*			trans	-102.1	133.7	176.6	-60.6	0	0	0	0	110.1
192	K	36.7	Very low	37.7	Very low	171 Å²	171	151.4 Å²	151.4	74%	0.743	80%	0.798	S	S	*	*			trans	-107.4	152.1	175.9	-59.5	179.7	-179.9	-177.5	0	110.3
193	H	43.5	Very low	37.4	Very low	189 Å²	189	150 Å²	150	88%	0.875	79%	0.785	S	S	*	*			trans	-146.2	146.6	142.2	-139.9	-84.2	0	0	0	111.8
194	N	35	Very low	37.6	Very low	138 Å²	138	149.6 Å²	149.6	74%	0.738	78%	0.783	S	S	*	*			trans	-102.7	146	-179.9	-62.2	-12.6	0	0	0	110.9
195	S	41.5	Very low	37.4	Very low	112 Å²	112	153.9 Å²	153.9	78%	0.783	79%	0.787	S	S	*	*			trans	-164.9	137	135.8	47.8	0	0	0	0	110.9
196	P	36.8	Very low	37.5	Very low	123 Å²	123	154.2 Å²	154.2	80%	0.799	79%	0.791	S	S	*	*			trans	-105	128.5	171.5	35.2	-26.8	0	0	0	111.5
197	I	35.8	Very low	36.9	Very low	164 Å²	164	152.5 Å²	152.5	84%	0.841	79%	0.788	S	S	*	*			trans	-138.2	139.8	169.4	-65.3	-173.7	0	0	0	110.7
198	E	31.8	Very low	36.7	Very low	172 Å²	172	152.9 Å²	152.9	80%	0.804	80%	0.796	S	S	*	*			trans	-60.3	156.6	178.8	-90.4	165.9	126.1	0	0	116.3
199	S	31.3	Very low	37	Very low	102 Å²	102	153.1 Å²	153.1	71%	0.713	80%	0.801	S	S	*	*			trans	37.7	107.5	146.4	68	0	0	0	0	119.6
200	L	39	Very low	37	Very low	177 Å²	177	155.7 Å²	155.7	93%	0.927	80%	0.803	S	S	*	*				-138.5	121.3	129.1	-87.9	-172	0	0	0	111
201	Q	32.9	Very low	37.3	Very low	157 Å²	157	156.3 Å²	156.3	73%	0.734	80%	0.801	S	S	*	*			trans	-90.9	132.6	173.4	168.9	-171.3	3.8	0	0	108.7
202	Y	39.6	Very low	37.1	Very low	227 Å²	227	158.3 Å²	158.3	89%	0.89	80%	0.801	S	S	*	*			trans	-152.3	132.9	155.3	-112.4	-77.6	0	0	0	110.4
203	N	34.8	Very low	37.3	Very low	116 Å²	116	157.2 Å²	157.2	62%	0.62	80%	0.803	S	S	*	*			trans	-104.2	-165.6	-177	-67.4	1.3	0	0	0	110.8
204	D	35.3	Very low	37.3	Very low	138 Å²	138	155.7 Å²	155.7	74%	0.738	80%	0.801	S	S	*	*			trans	78.6	93.3	158.3	-55.9	-4.9	0	0	0	117.3
205	F	37.5	Very low	37.9	Very low	212 Å²	212	156.9 Å²	156.9	93%	0.93	81%	0.807	S	S	*	*				-127.4	148.3	115.9	-83.9	-79.5	0	0	0	108.8
206	P	37.4	Very low	37.7	Very low	115 Å²	115	158 Å²	158	75%	0.747	80%	0.8	S	S	*	*			trans	-100.2	167.5	-144.8	38	-38.5	0	0	0	116.1
207	D	34.6	Very low	38.1	Very low	154 Å²	154	161.6 Å²	161.6	82%	0.824	81%	0.806	S	S	*	*			trans	-56.1	144.2	168.6	-58.1	-72.9	0	0	0	113.7
208	I	37.6	Very low	38.1	Very low	156 Å²	156	160.2 Å²	160.2	80%	0.8	80%	0.796	S	S	*	*			trans	-155.1	102.6	140.3	-89.7	142.6	0	0	0	105.6
209	F	41.6	Very low	38.2	Very low	205 Å²	205	155.7 Å²	155.7	90%	0.899	80%	0.796	S	S	*	*			trans	-172.6	122.1	130.8	-111.1	-72.9	0	0	0	108.7
210	E	40.5	Very low	38.7	Very low	176 Å²	176	158.1 Å²	158.1	82%	0.822	79%	0.794	S	S	*	*			trans	-92.9	151.9	-174.6	-65.2	165.4	133.1	0	0	111.5
211	D	38	Very low	38.5	Very low	138 Å²	138	157.2 Å²	157.2	74%	0.738	79%	0.789	S	S	*	*			trans	49.2	99.3	151.4	-53.9	-5.9	0	0	0	120.3
212	H	38.7	Very low	38.8	Very low	183 Å²	183	154.8 Å²	154.8	85%	0.847	78%	0.781	S	S	*	*				-142.5	128.3	127.3	-117.8	54.4	0	0	0	111.9
213	D	40.3	Very low	38.9	Very low	147 Å²	147	149.7 Å²	149.7	79%	0.786	77%	0.765	S	S	*	*			trans	-85.8	126.2	170.7	-57.7	-75.5	0	0	0	109.4
214	D	43.6	Very low	39.2	Very low	157 Å²	157	150.4 Å²	150.4	84%	0.84	77%	0.769	S	S	*	*			trans	-103.3	98.8	169.3	-86.3	-41.7	0	0	0	109.5
215	D	46.8	Very low	39.4	Very low	163 Å²	163	153.4 Å²	153.4	87%	0.872	78%	0.776	S	S	*	*			trans	-68.2	137.7	169.9	-90.7	-46.5	0	0	0	110.9	E217	D215-E217 PolarHBondContact O-N 3.29Å
216	Q	37.7	Very low	39.8	Very low	137 Å²	137	152 Å²	152	64%	0.64	77%	0.772	S	S	*	*			trans	-82.5	104.5	179	-67.6	-173.1	16.7	0	0	112.3
217	E	44.6	Very low	39.8	Very low	197 Å²	197	149.8 Å²	149.8	92%	0.921	77%	0.771	S	S	*	*			trans	-102.5	109.4	159.5	-167.5	162.1	-144.3	0	0	110.3	D215	D215-E217 PolarHBondContact O-N 3.29Å
218	Q	36.3	Very low	40.1	Very low	136 Å²	136	149.6 Å²	149.6	64%	0.636	76%	0.763	S	S	*	*			trans	-85.7	125.8	-175.6	-62.6	-175.3	9.4	0	0	111.5
219	G	33.7	Very low	40.4	Very low	77 Å²	77	150.2 Å²	150.2	79%	0.794	76%	0.762	S	S	*	*	S	Bend	trans	100.4	59.1	155.3	0	0	0	0	0	118.3
220	K	41.3	Very low	40.6	Very low	153 Å²	153	148.6 Å²	148.6	67%	0.665	75%	0.75	S	S	*	*			trans	-146.3	-2.8	157.5	-123.3	179	-175.2	-95.5	0	118.9	N222 E223	K220-N222 PolarHBondContact O-N 3.23Å; K220-E223 IonicContact NZ-OE2 3.19Å; K220-E223 PolarHBondContact NZ-OE2 3Å
221	L	36.7	Very low	40.9	Very low	157 Å²	157	144 Å²	144	82%	0.822	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	61.9	-176.2	-82.3	165.9	0	0	0	114.5
222	N	37.6	Very low	41.4	Very low	107 Å²	107	144.4 Å²	144.4	57%	0.572	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-144.3	-9	174.8	-83.9	-56.4	0	0	0	115	K220 R451	K220-N222 PolarHBondContact O-N 3.23Å; N222-R451 VanDerWaalsContact OD1-CZ 3.25Å; N222-R451 PolarHBondContact OD1-NH1 3.1Å; N222-R451 PolarHBondContact OD1-NH2 2.85Å
223	E	42.2	Very low	42	Very low	120 Å²	120	140.9 Å²	140.9	56%	0.561	71%	0.713	S	S	*	*	S	Bend	trans	-99.5	-12.1	-169.6	-64.2	174	165.6	0	0	112.9	K220 F225	K220-E223 IonicContact NZ-OE2 3.19Å; K220-E223 PolarHBondContact NZ-OE2 3Å; E223-F225 PolarHBondContact O-N 3.35Å
224	D	41.4	Very low	42.1	Very low	131 Å²	131	137.2 Å²	137.2	70%	0.701	70%	0.697	S	S	*	*	G	3₁₀ helix	trans	-89.4	9.4	-168.7	-51.7	-38.5	0	0	0	115.5
225	F	40.5	Very low	42.5	Very low	200 Å²	200	134.2 Å²	134.2	88%	0.877	68%	0.678	S	S	*	*	G	3₁₀ helix	trans	-90.6	10.7	-178.3	-163.1	-107	0	0	0	114.3	E223 G227	E223-F225 PolarHBondContact O-N 3.35Å; F225-G227 VanDerWaalsContact C-N 3.27Å; F225-G227 PolarHBondContact O-N 3.37Å
226	E	44.3	Very low	43	Very low	182 Å²	182	131.1 Å²	131.1	85%	0.85	67%	0.669	S	S	*	*	G	3₁₀ helix	trans	-84.9	1.8	174.1	-57.8	-166.2	143.8	0	0	113.1	F228	E226-F228 VanDerWaalsContact C-N 3.29Å; E226-F228 PolarHBondContact O-N 3.34Å; E226-F228 VanDerWaalsContact O-N 3.11Å
227	G	38.4	Very low	44	Very low	70 Å²	70	129.6 Å²	129.6	72%	0.722	66%	0.662	S	S	*	*			trans	-75.7	12.1	-170.7	0	0	0	0	0	118.2	F225 E229	F225-G227 VanDerWaalsContact C-N 3.27Å; F225-G227 PolarHBondContact O-N 3.37Å; G227-E229 PolarHBondContact O-N 2.85Å
228	F	39.5	Very low	44.7	Very low	150 Å²	150	122.4 Å²	122.4	66%	0.658	63%	0.631	S	S	*	*			trans	-93.5	84.4	166.7	-115.2	-86.8	0	0	0	109	E226 R230	E226-F228 VanDerWaalsContact C-N 3.29Å; E226-F228 PolarHBondContact O-N 3.34Å; E226-F228 VanDerWaalsContact O-N 3.11Å; F228-R230 PolarHBondContact O-N 2.58Å
229	E	45.5	Very low	46.1	Very low	169 Å²	169	120.3 Å²	120.3	79%	0.79	62%	0.624	S	S	*	*			trans	-64.1	84.9	171.1	-75.8	-166.8	120.5	0	0	110.5	G227 D231	G227-E229 PolarHBondContact O-N 2.85Å; E229-D231 PolarHBondContact O-N 3.17Å
230	R	45.7	Very low	47.9	Very low	171 Å²	171	118 Å²	118	65%	0.645	60%	0.6	S	S	*	*			trans	27.1	89.4	142.8	-176.4	177.6	169.5	172.4	-1.5	114.3	F228 E232 E235	F228-R230 PolarHBondContact O-N 2.58Å; R230-E232 PolarHBondContact O-N 2.86Å; R230-E235 VanDerWaalsContact CZ-CD 3.45Å; R230-E235 IonicContact CZ-OE1 3.95Å; R230-E235 IonicContact CZ-OE2 2.68Å; R230-E235 IonicContact NE-OE1 3.56Å; R230-E235 PolarHBondContact NE-OE1 3.16Å; R230-E235 IonicContact NE-OE2 3.27Å; R230-E235 IonicContact NH1-OE1 2.74Å; R230-E235 IonicContact NH2-OE1 3.75Å; R230-E235 PolarHBondContact NH2-OE1 2.9Å; R230-E235 IonicContact NH2-OE2 2.71Å; R230-E235 PolarHBondContact NH2-OE2 3.14Å
231	D	47	Very low	49.3	Very low	79 Å²	79	113.1 Å²	113.1	42%	0.422	58%	0.581	S	S	.	*			trans	-49.9	128.3	166.5	-67.4	-54.3	0	0	0	109.7	E229 Q233	E229-D231 PolarHBondContact O-N 3.17Å; D231-Q233 HydrophobicContact CB-CG 4.5Å; D231-Q233 PolarHBondContact O-N 2.92Å
232	E	48.7	Very low	51	Low	147 Å²	147	107.6 Å²	107.6	69%	0.687	55%	0.552	S	S	*	*			trans	-75.6	41.9	173.6	-74.9	-178.1	-170.3	0	0	112.4	R230 K493	R230-E232 PolarHBondContact O-N 2.86Å; E232-K493 IonicContact OE1-NZ 3.44Å; E232-K493 PolarHBondContact OE1-NZ 3.05Å; E232-K493 IonicContact OE2-NZ 3.21Å; E232-K493 PolarHBondContact OE2-NZ 3.42Å
233	Q	49.9	Very low	52.8	Low	109 Å²	109	103.4 Å²	103.4	51%	0.509	53%	0.532	S	S	.	.	S	Bend	trans	-60.8	142.5	146.3	-65.5	-59.9	-82.1	0	0	107.7	D231 E235 V238	D231-Q233 HydrophobicContact CB-CG 4.5Å; D231-Q233 PolarHBondContact O-N 2.92Å; Q233-E235 PolarHBondContact O-N 3.24Å; Q233-E235 VanDerWaalsContact O-N 3.11Å; Q233-V238 HydrophobicContact CB-CG2 3.89Å
234	P	42.7	Very low	54.3	Low	69 Å²	69	104 Å²	104	45%	0.448	54%	0.539	S	S	.	.			trans	-61.4	120.3	173.1	25.7	-31.6	0	0	0	108.2	S236 Q237	P234-S236 PolarHBondContact O-N 3.47Å; P234-S236 VanDerWaalsContact O-N 3.12Å; P234-Q237 HydrophobicContact CG-CB 3.97Å; P234-Q237 WeakPolarHBondContact O-CB 3.44Å; P234-Q237 PolarHBondContact O-N 3.4Å
235	E	52.1	Low	55.7	Low	94 Å²	94	98 Å²	98	44%	0.439	51%	0.507	S	S	.	.	H	α-helix	trans	-52.7	-40.1	-173.3	-70.2	175.3	134.5	0	0	111.5	R230 Q233 Q237 V238 D239	R230-E235 VanDerWaalsContact CZ-CD 3.45Å; R230-E235 IonicContact CZ-OE1 3.95Å; R230-E235 IonicContact CZ-OE2 2.68Å; R230-E235 IonicContact NE-OE1 3.56Å; R230-E235 PolarHBondContact NE-OE1 3.16Å; R230-E235 IonicContact NE-OE2 3.27Å; R230-E235 IonicContact NH1-OE1 2.74Å; R230-E235 IonicContact NH2-OE1 3.75Å; R230-E235 PolarHBondContact NH2-OE1 2.9Å; R230-E235 IonicContact NH2-OE2 2.71Å; R230-E235 PolarHBondContact NH2-OE2 3.14Å; Q233-E235 PolarHBondContact O-N 3.24Å; Q233-E235 VanDerWaalsContact O-N 3.11Å; E235-Q237 PolarHBondContact O-N 2.83Å; E235-V238 PolarHBondContact O-N 2.73Å; E235-D239 WeakPolarHBondContact O-CB 3.45Å; E235-D239 PolarHBondContact O-N 3.35Å
236	S	57.8	Low	57.2	Low	98 Å²	98	89 Å²	89	69%	0.685	47%	0.467	S	S	*	.	H	α-helix	trans	-54.8	-22	174.3	56.5	0	0	0	0	115.7	P234 G240	P234-S236 PolarHBondContact O-N 3.47Å; P234-S236 VanDerWaalsContact O-N 3.12Å; S236-G240 WeakPolarHBondContact O-CA 3.31Å; S236-G240 PolarHBondContact O-N 3.05Å; S236-G240 VanDerWaalsContact O-N 3.1Å
237	Q	57.3	Low	58.1	Low	106 Å²	106	81.6 Å²	81.6	50%	0.495	44%	0.441	S	S	.	.	H	α-helix	trans	-86.3	-37.2	172.9	-174.7	173.3	-4.5	0	0	112.1	P234 E235 I241	P234-Q237 HydrophobicContact CG-CB 3.97Å; P234-Q237 WeakPolarHBondContact O-CB 3.44Å; P234-Q237 PolarHBondContact O-N 3.4Å; E235-Q237 PolarHBondContact O-N 2.83Å; Q237-I241 HydrophobicContact CG-CD1 4.12Å; Q237-I241 WeakPolarHBondContact O-CB 3.32Å; Q237-I241 WeakPolarHBondContact O-CD1 3.16Å; Q237-I241 VanDerWaalsContact O-CG1 3.23Å; Q237-I241 WeakPolarHBondContact O-CG1 3.49Å; Q237-I241 PolarHBondContact O-N 3.46Å; Q237-I241 VanDerWaalsContact O-N 3.09Å
238	V	60.1	Low	59	Low	45 Å²	45	86.1 Å²	86.1	27%	0.273	44%	0.443	S	S	.	.	H	α-helix	trans	-72.2	-50.7	176.2	179.5	0	0	0	0	109.8	Q233 E235 G240 I241 I242 F469	Q233-V238 HydrophobicContact CB-CG2 3.89Å; E235-V238 PolarHBondContact O-N 2.73Å; V238-G240 VanDerWaalsContact C-N 3.31Å; V238-G240 PolarHBondContact O-N 2.93Å; V238-I241 PolarHBondContact O-N 3.04Å; V238-I242 HydrophobicContact CG1-CD1 3.97Å; V238-I242 WeakPolarHBondContact O-CB 3.32Å; V238-I242 VanDerWaalsContact O-CG1 3.31Å; V238-I242 WeakPolarHBondContact O-CG1 3.3Å; V238-I242 PolarHBondContact O-N 2.91Å; V238-F469 HydrophobicContact CB-CE1 4.33Å; V238-F469 HydrophobicContact CG1-CE1 3.97Å; V238-F469 HydrophobicContact CG1-CZ 4.01Å; V238-F469 HydrophobicContact CG2-CE1 4.47Å
239	D	66.1	Low	59.5	Low	93 Å²	93	83.4 Å²	83.4	50%	0.497	44%	0.442	S	S	.	.	H	α-helix	trans	-61.4	-38.5	174.1	-69.4	-38.2	0	0	0	111.6	E235 I241 I242 A243	E235-D239 WeakPolarHBondContact O-CB 3.45Å; E235-D239 PolarHBondContact O-N 3.35Å; D239-I241 PolarHBondContact O-N 3.34Å; D239-I242 CarbonylContact O-C 3.48Å; D239-I242 WeakPolarHBondContact O-CB 2.99Å; D239-I242 PolarHBondContact O-N 3.32Å; D239-A243 VanDerWaalsContact O-CB 3.3Å; D239-A243 WeakPolarHBondContact O-CB 3.21Å; D239-A243 PolarHBondContact O-N 3.03Å
240	G	71.1	Confident	59.6	Low	28 Å²	28	81.6 Å²	81.6	29%	0.289	44%	0.438	S	S	.	.	H	α-helix	trans	-61.4	-42.5	174.2	0	0	0	0	0	113.2	S236 V238 A243 D244	S236-G240 WeakPolarHBondContact O-CA 3.31Å; S236-G240 PolarHBondContact O-N 3.05Å; S236-G240 VanDerWaalsContact O-N 3.1Å; V238-G240 VanDerWaalsContact C-N 3.31Å; V238-G240 PolarHBondContact O-N 2.93Å; G240-A243 WeakPolarHBondContact O-CB 3.49Å; G240-A243 PolarHBondContact O-N 3.07Å; G240-D244 PolarHBondContact O-N 3.01Å
241	I	69.9	Low	59.7	Low	51 Å²	51	77 Å²	77	26%	0.262	44%	0.436	S	S	.	.	H	α-helix	trans	-73.8	-33.9	176	-67.2	164.5	0	0	0	111.2	Q237 V238 D239 A243 D244 I245 F469	Q237-I241 HydrophobicContact CG-CD1 4.12Å; Q237-I241 WeakPolarHBondContact O-CB 3.32Å; Q237-I241 WeakPolarHBondContact O-CD1 3.16Å; Q237-I241 VanDerWaalsContact O-CG1 3.23Å; Q237-I241 WeakPolarHBondContact O-CG1 3.49Å; Q237-I241 PolarHBondContact O-N 3.46Å; Q237-I241 VanDerWaalsContact O-N 3.09Å; V238-I241 PolarHBondContact O-N 3.04Å; D239-I241 PolarHBondContact O-N 3.34Å; I241-A243 VanDerWaalsContact C-N 3.28Å; I241-A243 PolarHBondContact O-N 3.43Å; I241-D244 PolarHBondContact O-N 3Å; I241-I245 HydrophobicContact CG2-CD1 3.57Å; I241-I245 HydrophobicContact CG2-CG1 4.31Å; I241-I245 WeakPolarHBondContact O-CB 3.11Å; I241-I245 WeakPolarHBondContact O-CD1 3.44Å; I241-I245 WeakPolarHBondContact O-CG1 3.25Å; I241-I245 PolarHBondContact O-N 2.93Å; I241-F469 HydrophobicContact CB-CE1 3.61Å; I241-F469 HydrophobicContact CB-CZ 3.77Å; I241-F469 HydrophobicContact CD1-CD1 4.41Å; I241-F469 HydrophobicContact CD1-CE1 3.89Å; I241-F469 HydrophobicContact CG1-CE1 4.35Å; I241-F469 HydrophobicContact CG2-CD1 4.46Å; I241-F469 HydrophobicContact CG2-CE1 3.54Å; I241-F469 HydrophobicContact CG2-CE2 4.41Å; I241-F469 HydrophobicContact CG2-CZ 3.49Å; I241-F469 VanDerWaalsContact CG2-CZ 3.49Å
242	I	73	Confident	59.7	Low	41 Å²	41	81.8 Å²	81.8	21%	0.21	46%	0.456	C	S	.	.	H	α-helix	trans	-61.1	-39.1	169.6	-75.5	174.9	0	0	0	110.1	V238 D239 F246 F469	V238-I242 HydrophobicContact CG1-CD1 3.97Å; V238-I242 WeakPolarHBondContact O-CB 3.32Å; V238-I242 VanDerWaalsContact O-CG1 3.31Å; V238-I242 WeakPolarHBondContact O-CG1 3.3Å; V238-I242 PolarHBondContact O-N 2.91Å; D239-I242 CarbonylContact O-C 3.48Å; D239-I242 WeakPolarHBondContact O-CB 2.99Å; D239-I242 PolarHBondContact O-N 3.32Å; I242-F246 HydrophobicContact CB-CD2 4.42Å; I242-F246 HydrophobicContact CG2-CD2 3.93Å; I242-F246 WeakPolarHBondContact O-CA 3.44Å; I242-F246 VanDerWaalsContact O-CB 3.31Å; I242-F246 WeakPolarHBondContact O-CB 3.26Å; I242-F246 WeakPolarHBondContact O-CD2 3.24Å; I242-F246 PolarHBondContact O-N 3.3Å; I242-F469 HydrophobicContact CG1-CE2 4.24Å; I242-F469 HydrophobicContact CG1-CZ 3.93Å
243	A	75.6	Confident	59.6	Low	19 Å²	19	83.2 Å²	83.2	16%	0.157	46%	0.463	C	S	.	.	H	α-helix	trans	-70.7	-41.9	174.8	0	0	0	0	0	112.6	D239 G240 I241 I245 G247 E248	D239-A243 VanDerWaalsContact O-CB 3.3Å; D239-A243 WeakPolarHBondContact O-CB 3.21Å; D239-A243 PolarHBondContact O-N 3.03Å; G240-A243 WeakPolarHBondContact O-CB 3.49Å; G240-A243 PolarHBondContact O-N 3.07Å; I241-A243 VanDerWaalsContact C-N 3.28Å; I241-A243 PolarHBondContact O-N 3.43Å; A243-I245 PolarHBondContact O-N 3.36Å; A243-G247 WeakPolarHBondContact O-CA 3.03Å; A243-G247 PolarHBondContact O-N 2.92Å; A243-E248 HydrophobicContact CB-CG 3.79Å
244	D	74.3	Confident	59.1	Low	131 Å²	131	87 Å²	87	70%	0.701	48%	0.481	S	S	*	.	H	α-helix	trans	-61.8	-43.3	175.2	-77.1	-28.6	0	0	0	111.6	G240 I241	G240-D244 PolarHBondContact O-N 3.01Å; I241-D244 PolarHBondContact O-N 3Å
245	I	70.7	Confident	58.8	Low	5 Å²	5	91 Å²	91	3%	0.026	49%	0.491	C	S	.	.	H	α-helix	trans	-78.9	-48.9	-177.5	-59.2	162.9	0	0	0	111.2	I241 A243 L431 Q432 K438 L465 I468	I241-I245 HydrophobicContact CG2-CD1 3.57Å; I241-I245 HydrophobicContact CG2-CG1 4.31Å; I241-I245 WeakPolarHBondContact O-CB 3.11Å; I241-I245 WeakPolarHBondContact O-CD1 3.44Å; I241-I245 WeakPolarHBondContact O-CG1 3.25Å; I241-I245 PolarHBondContact O-N 2.93Å; A243-I245 PolarHBondContact O-N 3.36Å; I245-L431 HydrophobicContact CG2-CD2 4.02Å; I245-L431 HydrophobicContact CG2-CG 4.13Å; I245-Q432 HydrophobicContact CG1-CG 4.5Å; I245-Q432 HydrophobicContact CG2-CG 4.09Å; I245-K438 WeakPolarHBondContact O-CE 3.32Å; I245-L465 HydrophobicContact CD1-CD2 4.22Å; I245-I468 HydrophobicContact CD1-CD1 4.02Å; I245-I468 HydrophobicContact CD1-CG2 3.81Å
246	F	71.5	Confident	58.3	Low	11 Å²	11	95 Å²	95	5%	0.048	51%	0.51	C	S	.	.	H	α-helix	trans	-102.8	-9.3	-172.1	-49	-50.5	0	0	0	114.8	I242 L431 G437 K438 M441 L465	I242-F246 HydrophobicContact CB-CD2 4.42Å; I242-F246 HydrophobicContact CG2-CD2 3.93Å; I242-F246 WeakPolarHBondContact O-CA 3.44Å; I242-F246 VanDerWaalsContact O-CB 3.31Å; I242-F246 WeakPolarHBondContact O-CB 3.26Å; I242-F246 WeakPolarHBondContact O-CD2 3.24Å; I242-F246 PolarHBondContact O-N 3.3Å; F246-L431 HydrophobicContact CE1-CD1 4.34Å; F246-L431 HydrophobicContact CE1-CD2 4.09Å; F246-L431 HydrophobicContact CE1-CG 4.27Å; F246-L431 HydrophobicContact CZ-CD2 4.49Å; F246-G437 VanDerWaalsContact CD1-C 3.46Å; F246-K438 VanDerWaalsContact C-CE 3.43Å; F246-K438 HydrophobicContact CB-CG 4.39Å; F246-K438 WeakPolarHBondContact O-CD 3.5Å; F246-K438 WeakPolarHBondContact O-CE 3.22Å; F246-K438 WeakPolarHBondContact O-CG 3.47Å; F246-K438 PolarHBondContact O-NZ 3.04Å; F246-M441 HydrophobicContact CD2-CE 4.13Å; F246-M441 HydrophobicContact CE2-CE 4.18Å; F246-L465 HydrophobicContact CE1-CD2 4.47Å; F246-L465 HydrophobicContact CE2-CD1 3.83Å; F246-L465 HydrophobicContact CE2-CD2 3.66Å; F246-L465 HydrophobicContact CE2-CG 4.06Å; F246-L465 HydrophobicContact CZ-CD1 4.06Å; F246-L465 HydrophobicContact CZ-CD2 3.38Å; F246-L465 HydrophobicContact CZ-CG 3.8Å
247	G	64.1	Low	57.3	Low	28 Å²	28	93.7 Å²	93.7	29%	0.289	51%	0.512	S	S	.	.			trans	73.6	144.2	-167	0	0	0	0	0	111.7	A243 S249 K438	A243-G247 WeakPolarHBondContact O-CA 3.03Å; A243-G247 PolarHBondContact O-N 2.92Å; G247-S249 PolarHBondContact O-N 3.01Å; G247-K438 VanDerWaalsContact N-NZ 3.1Å
248	E	57.4	Low	56.3	Low	164 Å²	164	97.6 Å²	97.6	77%	0.766	53%	0.528	S	S	*	.			trans	-62.4	108	154.5	-77.9	164.4	157	0	0	107.6	A243 D250	A243-E248 HydrophobicContact CB-CG 3.79Å; E248-D250 PolarHBondContact O-N 2.82Å
249	S	48.9	Very low	55.3	Low	93 Å²	93	99.9 Å²	99.9	65%	0.65	55%	0.552	S	S	*	*			trans	-78.5	46.5	167.5	178.2	0	0	0	0	109.8	G247 A251	G247-S249 PolarHBondContact O-N 3.01Å; S249-A251 PolarHBondContact O-N 3.04Å
250	D	47.5	Very low	54.1	Low	132 Å²	132	103.4 Å²	103.4	71%	0.706	57%	0.565	S	S	*	*			trans	-77.6	101.2	171.6	-166.1	1.8	0	0	0	107.8	E248	E248-D250 PolarHBondContact O-N 2.82Å
251	A	47.4	Very low	52.4	Low	73 Å²	73	108.4 Å²	108.4	60%	0.603	59%	0.585	S	S	*	*			trans	-104	34.5	-167.8	0	0	0	0	0	112	S249	S249-A251 PolarHBondContact O-N 3.04Å
252	E	46.8	Very low	51.1	Low	180 Å²	180	115 Å²	115	84%	0.841	62%	0.615	S	S	*	*			trans	-116.6	34.7	176.6	-65	-164.9	-169.9	0	0	113.5	E254	E252-E254 PolarHBondContact O-N 3.46Å
253	E	47.2	Very low	49.3	Very low	177 Å²	177	120.5 Å²	120.5	83%	0.827	64%	0.644	S	S	*	*			trans	-85.8	100.4	161.1	-77.4	-151.9	145.8	0	0	111.8	F255	E253-F255 PolarHBondContact O-N 2.69Å
254	E	39.4	Very low	47.4	Very low	188 Å²	188	125.3 Å²	125.3	88%	0.879	67%	0.667	S	S	*	*			trans	-69.5	70.5	171.6	-171.1	173.4	-141.8	0	0	111.4	E252 E256	E252-E254 PolarHBondContact O-N 3.46Å; E254-E256 PolarHBondContact O-N 2.7Å
255	F	37.2	Very low	45.7	Very low	154 Å²	154	127.8 Å²	127.8	68%	0.675	67%	0.672	S	S	*	*			trans	-77	89.5	-176.5	-167.4	-97.3	0	0	0	112.9	E253 G257 F258	E253-F255 PolarHBondContact O-N 2.69Å; F255-G257 PolarHBondContact O-N 2.85Å; F255-G257 VanDerWaalsContact O-N 3.15Å; F255-F258 HydrophobicContact CE1-CB 4.45Å; F255-F258 HydrophobicContact CE1-CD2 4.31Å; F255-F258 AromaticContact CZ-CD2 3.81Å; F255-F258 HydrophobicContact CZ-CD2 3.81Å
256	E	40.1	Very low	44.2	Very low	177 Å²	177	131 Å²	131	83%	0.827	71%	0.706	S	S	*	*			trans	-63.9	109.7	170	-73.9	-159.9	121.7	0	0	112.5	E254	E254-E256 PolarHBondContact O-N 2.7Å
257	G	38.6	Very low	42.7	Very low	71 Å²	71	138.3 Å²	138.3	73%	0.732	74%	0.744	S	S	*	*			trans	38.4	91	146.2	0	0	0	0	0	119.4	F255	F255-G257 PolarHBondContact O-N 2.85Å; F255-G257 VanDerWaalsContact O-N 3.15Å
258	F	36.4	Very low	41.6	Very low	188 Å²	188	146.1 Å²	146.1	83%	0.825	77%	0.773	S	S	*	*			trans	-84.7	132.8	149	-104.7	-98.1	0	0	0	111	F255	F255-F258 HydrophobicContact CE1-CB 4.45Å; F255-F258 HydrophobicContact CE1-CD2 4.31Å; F255-F258 AromaticContact CZ-CD2 3.81Å; F255-F258 HydrophobicContact CZ-CD2 3.81Å
259	A	38	Very low	40.8	Very low	94 Å²	94	147.4 Å²	147.4	78%	0.777	78%	0.779	S	S	*	*			trans	-82.9	156.6	-166.4	0	0	0	0	0	114.4
260	E	40.4	Very low	40.7	Very low	166 Å²	166	151.2 Å²	151.2	78%	0.776	79%	0.787	S	S	*	*	S	Bend	trans	-37.3	149.2	163.2	-105.2	-174.2	111.3	0	0	116.9
261	N	35.8	Very low	40.5	Very low	133 Å²	133	152.1 Å²	152.1	71%	0.711	80%	0.796	S	S	*	*			trans	75.4	78.9	146.9	-61.9	-39.5	0	0	0	121
262	E	42.3	Very low	40.1	Very low	191 Å²	191	156.4 Å²	156.4	89%	0.893	80%	0.804	S	S	*	*			trans	-154.4	155	136.9	-86.6	-163.9	150.3	0	0	109.3
263	L	35.7	Very low	39.7	Very low	155 Å²	155	154 Å²	154	81%	0.812	80%	0.796	S	S	*	*			cis	-162.5	124.8	-35.4	-173.4	82.5	0	0	0	108.6
264	D	36.2	Very low	39.4	Very low	121 Å²	121	154.9 Å²	154.9	65%	0.647	80%	0.8	S	S	*	*			trans	-31.8	118.5	167.2	169.6	41.6	0	0	0	117.9
265	K	38.9	Very low	39	Very low	183 Å²	183	152.2 Å²	152.2	80%	0.796	80%	0.796	S	S	*	*				169	142.2	125.8	-94.5	151.2	-145	-176.8	0	118.4
266	G	38.4	Very low	39.3	Very low	73 Å²	73	150.7 Å²	150.7	75%	0.753	81%	0.805	S	S	*	*			trans	96.4	146	159.8	0	0	0	0	0	114.8
267	I	39.9	Very low	39.3	Very low	164 Å²	164	147.5 Å²	147.5	84%	0.841	80%	0.802	S	S	*	*			cis	-137.9	142.6	6.6	-68	171.9	0	0	0	109.5
268	E	40.4	Very low	39.5	Very low	191 Å²	191	152.7 Å²	152.7	89%	0.893	81%	0.807	S	S	*	*			trans	-96.1	131.5	166.3	-57.3	171.7	136.5	0	0	109.3
269	E	42.3	Very low	39.9	Very low	191 Å²	191	150.2 Å²	150.2	89%	0.893	80%	0.802	S	S	*	*			trans	-155	156.7	153.7	-144.2	165.7	-161.2	0	0	112.4
270	E	45.5	Very low	40.1	Very low	174 Å²	174	151.9 Å²	151.9	81%	0.813	80%	0.802	S	S	*	*			trans	-94.4	153.2	-158.2	-50.2	164.5	136.3	0	0	114.1
271	V	43	Very low	40	Very low	150 Å²	150	149.9 Å²	149.9	91%	0.909	80%	0.801	S	S	*	*			trans	-144.4	131.6	137.6	-171.1	0	0	0	0	109.8
272	E	39.8	Very low	40.7	Very low	164 Å²	164	153.1 Å²	153.1	77%	0.766	81%	0.809	S	S	*	*			trans	-85.2	142	-177.7	-67.8	-174.8	103.6	0	0	115.3
273	I	38.4	Very low	40.7	Very low	130 Å²	130	154 Å²	154	67%	0.667	81%	0.81	S	S	*	*			trans	16.3	123.2	132.4	-52.4	164	0	0	0	117.2
274	Q	40.1	Very low	40.7	Very low	195 Å²	195	149.9 Å²	149.9	91%	0.911	81%	0.805	S	S	*	*			trans	-147.3	92.5	142	-136.2	161.7	109.5	0	0	112.8
275	T	31.8	Very low	40.8	Very low	132 Å²	132	150.6 Å²	150.6	81%	0.81	82%	0.816	S	S	*	*			trans	-89.9	123.1	174.1	46.7	0	0	0	0	111
276	S	43.6	Very low	40.7	Very low	121 Å²	121	149.6 Å²	149.6	85%	0.846	82%	0.819	S	S	*	*			trans	-128.7	91.7	173.3	51.3	0	0	0	0	111.1
277	S	40.2	Very low	40.9	Very low	111 Å²	111	152.1 Å²	152.1	78%	0.776	82%	0.82	S	S	*	*			trans	-90.5	126.1	170.4	-176.5	0	0	0	0	109.9
278	E	43.4	Very low	40.8	Very low	180 Å²	180	150.1 Å²	150.1	84%	0.841	82%	0.815	S	S	*	*			trans	-124.7	116.6	168	-169	170	177.1	0	0	110.8
279	L	44.9	Very low	40.6	Very low	136 Å²	136	145.8 Å²	145.8	71%	0.712	81%	0.812	S	S	*	*			trans	-81.2	126.1	-179.4	-76.3	70.3	0	0	0	110.7
280	V	41.8	Very low	40.6	Very low	128 Å²	128	139.8 Å²	139.8	78%	0.776	80%	0.802	S	S	*	*			trans	-116.8	86.5	162.5	-174	0	0	0	0	110.1
281	T	37.2	Very low	40.2	Very low	124 Å²	124	139.9 Å²	139.9	76%	0.761	80%	0.802	S	S	*	*			trans	-98.7	121.2	167.2	52.6	0	0	0	0	110.3
282	K	50.4	Low	40	Very low	202 Å²	202	138.7 Å²	138.7	88%	0.878	79%	0.791	S	S	*	*			trans	-135.8	125.1	164.1	-81.2	-172.1	175.5	173.3	0	110.2
283	K	42.3	Very low	40	Very low	209 Å²	209	137.9 Å²	137.9	91%	0.909	79%	0.787	S	S	*	*			trans	-78.8	155.2	178.5	-61.7	-179.5	177.7	-177.6	0	110.4
284	G	35.6	Very low	40.2	Very low	69 Å²	69	138.6 Å²	138.6	71%	0.711	79%	0.792	S	S	*	*			trans	-68.4	-175.2	167.6	0	0	0	0	0	113
285	P	39.7	Very low	40.2	Very low	135 Å²	135	136 Å²	136	88%	0.877	78%	0.784	S	S	*	*				-141.7	160.2	91.7	39.2	-26.5	0	0	0	117.5
286	L	36.4	Very low	40.8	Very low	163 Å²	163	138.1 Å²	138.1	85%	0.853	79%	0.785	S	S	*	*			trans	-46.3	140	165.6	176.7	78.6	0	0	0	116.7
287	T	41.4	Very low	40.5	Very low	125 Å²	125	141.9 Å²	141.9	77%	0.767	79%	0.789	S	S	*	*			trans	-153.8	127.3	145.3	49.1	0	0	0	0	112.4
288	T	37.8	Very low	40.5	Very low	123 Å²	123	142 Å²	142	76%	0.755	79%	0.79	S	S	*	*			trans	35.1	123.9	145.9	57.5	0	0	0	0	120.9
289	A	37.5	Very low	40.2	Very low	100 Å²	100	142 Å²	142	83%	0.826	79%	0.79	S	S	*	*			cis	92.2	147.9	47.1	0	0	0	0	0	114.5
290	G	40.9	Very low	39.8	Very low	65 Å²	65	143 Å²	143	67%	0.67	79%	0.791	S	S	*	*			trans	104.3	94.4	-162.3	0	0	0	0	0	109.9
291	E	37.1	Very low	39.8	Very low	175 Å²	175	144.2 Å²	144.2	82%	0.818	79%	0.793	S	S	*	*			cis	78	132.6	40.3	-56.1	-174.9	152.5	0	0	114.3
292	N	40.4	Very low	40.3	Very low	126 Å²	126	145.5 Å²	145.5	67%	0.674	80%	0.795	S	S	*	*			trans	69.1	152	164.6	-61.8	24.3	0	0	0	117.1
293	E	39.5	Very low	40.6	Very low	147 Å²	147	144 Å²	144	69%	0.687	79%	0.791	S	S	*	*			cis	-164.6	177.7	-19.7	-113	160.3	166.3	0	0	106.5
294	D	42.4	Very low	41.4	Very low	144 Å²	144	142.9 Å²	142.9	77%	0.77	79%	0.787	S	S	*	*			trans	64	159.4	160.1	-55	-17.7	0	0	0	119.3
295	D	40.2	Very low	43	Very low	141 Å²	141	143.1 Å²	143.1	75%	0.754	77%	0.774	S	S	*	*			cis	-161.2	-176.1	-45.8	-152.3	-14.9	0	0	0	108
296	E	43.8	Very low	44.8	Very low	177 Å²	177	139 Å²	139	83%	0.827	75%	0.749	S	S	*	*			trans	73	139.5	159.6	-69.8	-176.2	-171.3	0	0	120.4
297	E	37.4	Very low	46.8	Very low	200 Å²	200	136.5 Å²	136.5	94%	0.935	74%	0.736	S	S	*	*			trans	-79.4	135.5	-178.5	-56.3	168.1	132.1	0	0	111.1
298	S	39.4	Very low	48.8	Very low	112 Å²	112	136.9 Å²	136.9	78%	0.783	73%	0.727	S	S	*	*			trans	-140.2	97.2	170.2	-171.9	0	0	0	0	111.1
299	E	37.8	Very low	51.2	Low	181 Å²	181	135 Å²	135	85%	0.846	71%	0.713	S	S	*	*			trans	-65.9	153.1	161.9	-63.4	-171.2	131	0	0	110.1
300	H	36.9	Very low	53.4	Low	158 Å²	158	137.5 Å²	137.5	73%	0.731	70%	0.701	S	S	*	*			trans	58.5	105.4	-177.9	-74.8	-94.2	0	0	0	116.3
301	D	42.6	Very low	55.6	Low	153 Å²	153	139.7 Å²	139.7	82%	0.818	70%	0.696	S	S	*	*				-151.1	152.4	106.7	-129.2	-28.8	0	0	0	113.3	E303	D301-E303 VanDerWaalsContact C-N 3.33Å; D301-E303 PolarHBondContact O-N 3.44Å
302	N	46.2	Very low	58	Low	150 Å²	150	135.6 Å²	135.6	80%	0.802	68%	0.678	S	S	*	*			trans	-93.6	64.1	176.9	-77.7	-98.2	0	0	0	110
303	E	56.7	Low	60.3	Low	170 Å²	170	136 Å²	136	79%	0.794	68%	0.676	S	S	*	*			trans	-65.3	141.6	-170.8	-168.1	163.6	-148.2	0	0	113.1	D301 V305	D301-E303 VanDerWaalsContact C-N 3.33Å; D301-E303 PolarHBondContact O-N 3.44Å; E303-V305 VanDerWaalsContact C-N 3.33Å; E303-V305 PolarHBondContact O-N 3.26Å
304	F	59.5	Low	62.7	Low	187 Å²	187	136.9 Å²	136.9	82%	0.82	68%	0.677	S	S	*	*			trans	-73.9	81.6	-177.5	-179.7	-98.9	0	0	0	110.7	S306	F304-S306 PolarHBondContact O-N 3.14Å
305	V	69	Low	64.9	Low	73 Å²	73	136.5 Å²	136.5	44%	0.442	67%	0.669	S	S	.	*			trans	-60.1	112.8	174.7	-170.3	0	0	0	0	109.5	E303 D309 R310	E303-V305 VanDerWaalsContact C-N 3.33Å; E303-V305 PolarHBondContact O-N 3.26Å; V305-D309 HydrophobicContact CG1-CB 4.09Å; V305-R310 HydrophobicContact CB-CG 4.43Å; V305-R310 HydrophobicContact CG1-CG 3.84Å
306	S	78.3	Confident	67.3	Low	50 Å²	50	136 Å²	136	35%	0.35	66%	0.66	S	S	.	*			trans	-56.6	143.4	179	-176.2	0	0	0	0	111.1	F304 F308 D309 R310	F304-S306 PolarHBondContact O-N 3.14Å; S306-F308 PolarHBondContact O-N 2.85Å; S306-F308 VanDerWaalsContact O-N 3.12Å; S306-D309 VanDerWaalsContact CB-OD2 3.32Å; S306-D309 WeakPolarHBondContact CB-OD2 3.46Å; S306-D309 PolarHBondContact O-N 2.81Å; S306-R310 PolarHBondContact O-N 3.34Å
307	D	77.3	Confident	69.4	Low	110 Å²	110	130.9 Å²	130.9	59%	0.588	64%	0.636	S	S	*	*	H	α-helix	trans	-58.9	-27.3	176.6	-74.6	-39.2	0	0	0	112.1	I311	D307-I311 WeakPolarHBondContact O-CB 3.42Å; D307-I311 WeakPolarHBondContact O-CD1 3.36Å; D307-I311 WeakPolarHBondContact O-CG1 3.32Å; D307-I311 PolarHBondContact O-N 3.37Å
308	F	84.7	Confident	71.8	Confident	133 Å²	133	128 Å²	128	58%	0.583	62%	0.622	S	S	*	*	H	α-helix	trans	-62.8	-44.9	171.9	-178.9	-99.8	0	0	0	112.1	S306 I311 M312	S306-F308 PolarHBondContact O-N 2.85Å; S306-F308 VanDerWaalsContact O-N 3.12Å; F308-I311 PolarHBondContact O-N 2.79Å; F308-M312 HydrophobicContact CD1-CG 4.08Å; F308-M312 HydrophobicContact CD2-CG 4.48Å; F308-M312 HydrophobicContact CE1-CG 3.64Å; F308-M312 HydrophobicContact CE2-CG 4.08Å; F308-M312 HydrophobicContact CG-CG 4.49Å; F308-M312 HydrophobicContact CZ-CG 3.64Å; F308-M312 HydrophobicContact CZ-SD 4.11Å; F308-M312 WeakPolarHBondContact O-CB 3.46Å; F308-M312 WeakPolarHBondContact O-CG 3.4Å; F308-M312 PolarHBondContact O-N 2.97Å
309	D	88	Confident	74	Confident	83 Å²	83	125 Å²	125	44%	0.444	60%	0.602	S	S	.	*	H	α-helix	trans	-71.6	-38.5	-178.2	-61.2	-49.5	0	0	0	111	V305 S306 I311 M312 E313	V305-D309 HydrophobicContact CG1-CB 4.09Å; S306-D309 VanDerWaalsContact CB-OD2 3.32Å; S306-D309 WeakPolarHBondContact CB-OD2 3.46Å; S306-D309 PolarHBondContact O-N 2.81Å; D309-I311 VanDerWaalsContact C-N 3.33Å; D309-I311 PolarHBondContact O-N 3.39Å; D309-M312 PolarHBondContact O-N 2.76Å; D309-E313 VanDerWaalsContact O-CB 3.29Å; D309-E313 WeakPolarHBondContact O-CB 3.49Å; D309-E313 PolarHBondContact O-N 3.17Å
310	R	83.1	Confident	76.4	Confident	153 Å²	153	122 Å²	122	58%	0.577	58%	0.583	S	S	*	*	H	α-helix	trans	-58.1	-41.9	168.4	-77.5	177.9	163.9	175.3	-2.7	112.7	V305 S306 K314	V305-R310 HydrophobicContact CB-CG 4.43Å; V305-R310 HydrophobicContact CG1-CG 3.84Å; S306-R310 PolarHBondContact O-N 3.34Å; R310-K314 VanDerWaalsContact O-CB 3.24Å; R310-K314 WeakPolarHBondContact O-CB 3.44Å; R310-K314 PolarHBondContact O-N 2.91Å
311	I	87.3	Confident	78.8	Confident	110 Å²	110	122.6 Å²	122.6	56%	0.564	58%	0.578	S	S	*	*	H	α-helix	trans	-68.3	-42.3	176.7	-73	165.5	0	0	0	110.9	D307 F308 D309 K314 K315	D307-I311 WeakPolarHBondContact O-CB 3.42Å; D307-I311 WeakPolarHBondContact O-CD1 3.36Å; D307-I311 WeakPolarHBondContact O-CG1 3.32Å; D307-I311 PolarHBondContact O-N 3.37Å; F308-I311 PolarHBondContact O-N 2.79Å; D309-I311 VanDerWaalsContact C-N 3.33Å; D309-I311 PolarHBondContact O-N 3.39Å; I311-K314 PolarHBondContact O-N 3.26Å; I311-K315 VanDerWaalsContact O-CB 3.28Å; I311-K315 WeakPolarHBondContact O-CB 3.47Å; I311-K315 PolarHBondContact O-N 3.26Å
312	M	88.5	Confident	80.7	Confident	90 Å²	90	123.6 Å²	123.6	44%	0.443	57%	0.571	S	S	.	*	H	α-helix	trans	-68.5	-39.4	179.2	-76.2	-64.5	-70.7	0	0	112.3	F308 D309 K315 K316	F308-M312 HydrophobicContact CD1-CG 4.08Å; F308-M312 HydrophobicContact CD2-CG 4.48Å; F308-M312 HydrophobicContact CE1-CG 3.64Å; F308-M312 HydrophobicContact CE2-CG 4.08Å; F308-M312 HydrophobicContact CG-CG 4.49Å; F308-M312 HydrophobicContact CZ-CG 3.64Å; F308-M312 HydrophobicContact CZ-SD 4.11Å; F308-M312 WeakPolarHBondContact O-CB 3.46Å; F308-M312 WeakPolarHBondContact O-CG 3.4Å; F308-M312 PolarHBondContact O-N 2.97Å; D309-M312 PolarHBondContact O-N 2.76Å; M312-K315 PolarHBondContact O-N 3.36Å; M312-K316 WeakPolarHBondContact O-CB 3.37Å; M312-K316 PolarHBondContact O-N 3.09Å
313	E	87.8	Confident	82.5	Confident	135 Å²	135	123.9 Å²	123.9	63%	0.631	56%	0.561	S	S	*	*	H	α-helix	trans	-64.6	-48.3	172.6	-178.5	166.7	-121.7	0	0	111.4	D309 K315 K316 E317	D309-E313 VanDerWaalsContact O-CB 3.29Å; D309-E313 WeakPolarHBondContact O-CB 3.49Å; D309-E313 PolarHBondContact O-N 3.17Å; E313-K315 VanDerWaalsContact C-N 3.28Å; E313-K315 PolarHBondContact O-N 3.12Å; E313-K316 WeakPolarHBondContact O-CB 3.46Å; E313-K316 PolarHBondContact O-N 3.39Å; E313-K316 VanDerWaalsContact O-N 3.09Å; E313-E317 PolarHBondContact O-N 3.38Å
314	K	88.8	Confident	83.7	Confident	164 Å²	164	121.3 Å²	121.3	71%	0.713	54%	0.543	S	S	*	.	H	α-helix	trans	-56.1	-42.8	174.6	-176.7	174.5	179.4	178	0	111.9	R310 I311 E317 E318	R310-K314 VanDerWaalsContact O-CB 3.24Å; R310-K314 WeakPolarHBondContact O-CB 3.44Å; R310-K314 PolarHBondContact O-N 2.91Å; I311-K314 PolarHBondContact O-N 3.26Å; K314-E317 PolarHBondContact O-N 2.96Å; K314-E318 VanDerWaalsContact O-CB 3.32Å; K314-E318 WeakPolarHBondContact O-CB 3.18Å; K314-E318 PolarHBondContact O-N 2.86Å
315	K	90.6	Very high	84.6	Confident	137 Å²	137	118.7 Å²	118.7	60%	0.596	53%	0.528	S	S	*	.	H	α-helix	trans	-68.7	-36.4	176.5	-171.9	175.2	-177.3	177.7	0	112.6	I311 M312 E313 S319	I311-K315 VanDerWaalsContact O-CB 3.28Å; I311-K315 WeakPolarHBondContact O-CB 3.47Å; I311-K315 PolarHBondContact O-N 3.26Å; M312-K315 PolarHBondContact O-N 3.36Å; E313-K315 VanDerWaalsContact C-N 3.28Å; E313-K315 PolarHBondContact O-N 3.12Å; K315-S319 WeakPolarHBondContact O-CB 3.39Å; K315-S319 PolarHBondContact O-N 3.15Å
316	K	90.2	Very high	85	Confident	130 Å²	130	118.5 Å²	118.5	57%	0.565	53%	0.525	S	S	*	.	H	α-helix	trans	-65.9	-43.2	175.1	-175.3	179.3	-178.7	-177.8	0	110.9	M312 E313 S319 R320	M312-K316 WeakPolarHBondContact O-CB 3.37Å; M312-K316 PolarHBondContact O-N 3.09Å; E313-K316 WeakPolarHBondContact O-CB 3.46Å; E313-K316 PolarHBondContact O-N 3.39Å; E313-K316 VanDerWaalsContact O-N 3.09Å; K316-S319 PolarHBondContact O-N 3.49Å; K316-R320 WeakPolarHBondContact O-CG 3.02Å; K316-R320 PolarHBondContact O-N 3.09Å
317	E	88.1	Confident	84.7	Confident	70 Å²	70	123.5 Å²	123.5	33%	0.327	54%	0.536	S	S	.	.	H	α-helix	trans	-77.3	-33.1	178.9	-161.8	54.5	-136.8	0	0	112.8	E313 K314 S319 R320 R321 R324	E313-E317 PolarHBondContact O-N 3.38Å; K314-E317 PolarHBondContact O-N 2.96Å; E317-S319 VanDerWaalsContact C-N 3.34Å; E317-R320 PolarHBondContact O-N 3.09Å; E317-R320 WeakPolarHBondContact OE2-CD 3.36Å; E317-R320 IonicContact OE2-CZ 3.58Å; E317-R320 IonicContact OE2-NE 3.56Å; E317-R320 IonicContact OE2-NH1 3.24Å; E317-R320 PolarHBondContact OE2-NH1 3.26Å; E317-R321 WeakPolarHBondContact O-CB 3.33Å; E317-R321 PolarHBondContact O-N 3.49Å; E317-R324 IonicContact OE1-CZ 2.99Å; E317-R324 IonicContact OE1-NH1 2.93Å; E317-R324 PolarHBondContact OE1-NH1 2.98Å; E317-R324 IonicContact OE1-NH2 3.83Å; E317-R324 PolarHBondContact OE1-NH2 3.24Å
318	E	87.1	Confident	84.6	Confident	138 Å²	138	122.4 Å²	122.4	65%	0.645	53%	0.53	S	S	*	.	H	α-helix	trans	-60.2	-44.6	166.8	-179.5	174	-140.3	0	0	111.3	K314 R320 R321 R322	K314-E318 VanDerWaalsContact O-CB 3.32Å; K314-E318 WeakPolarHBondContact O-CB 3.18Å; K314-E318 PolarHBondContact O-N 2.86Å; E318-R320 VanDerWaalsContact C-N 3.32Å; E318-R320 PolarHBondContact O-N 3.3Å; E318-R321 PolarHBondContact O-N 2.98Å; E318-R322 PolarHBondContact O-N 2.95Å
319	S	85.2	Confident	84.1	Confident	51 Å²	51	120 Å²	120	36%	0.357	52%	0.522	S	S	.	.	H	α-helix	trans	-64.5	-33.8	175.9	-166.7	0	0	0	0	112.7	K315 K316 E317 R323	K315-S319 WeakPolarHBondContact O-CB 3.39Å; K315-S319 PolarHBondContact O-N 3.15Å; K316-S319 PolarHBondContact O-N 3.49Å; E317-S319 VanDerWaalsContact C-N 3.34Å; S319-R323 WeakPolarHBondContact O-CG 3.23Å; S319-R323 PolarHBondContact O-N 3.05Å; S319-R323 VanDerWaalsContact O-N 3.14Å; S319-R323 PolarHBondContact O-NH1 3.11Å; S319-R323 VanDerWaalsContact O-NH1 3.08Å; S319-R323 PolarHBondContact OG-NH1 3.37Å
320	R	87.7	Confident	83.5	Confident	118 Å²	118	120.4 Å²	120.4	45%	0.445	52%	0.522	S	S	.	.	H	α-helix	trans	-69.9	-46.5	170.5	-76.2	165	162.3	-177.9	-5.9	111.7	K316 E317 E318 R322 R323 R324	K316-R320 WeakPolarHBondContact O-CG 3.02Å; K316-R320 PolarHBondContact O-N 3.09Å; E317-R320 PolarHBondContact O-N 3.09Å; E317-R320 WeakPolarHBondContact OE2-CD 3.36Å; E317-R320 IonicContact OE2-CZ 3.58Å; E317-R320 IonicContact OE2-NE 3.56Å; E317-R320 IonicContact OE2-NH1 3.24Å; E317-R320 PolarHBondContact OE2-NH1 3.26Å; E318-R320 VanDerWaalsContact C-N 3.32Å; E318-R320 PolarHBondContact O-N 3.3Å; R320-R322 VanDerWaalsContact C-N 3.28Å; R320-R322 PolarHBondContact O-N 3.13Å; R320-R323 CarbonylContact O-C 3.56Å; R320-R323 PolarHBondContact O-N 3.35Å; R320-R323 VanDerWaalsContact O-N 3.12Å; R320-R324 WeakPolarHBondContact O-CG 3.39Å; R320-R324 PolarHBondContact O-N 3.5Å
321	R	87.2	Confident	83.1	Confident	169 Å²	169	118.9 Å²	118.9	64%	0.638	52%	0.519	S	S	*	.	H	α-helix	trans	-61.3	-35.2	177.7	-169.1	174.5	-174.3	177.7	2.7	112	E317 E318 R325	E317-R321 WeakPolarHBondContact O-CB 3.33Å; E317-R321 PolarHBondContact O-N 3.49Å; E318-R321 PolarHBondContact O-N 2.98Å; R321-R325 PolarHBondContact O-N 2.68Å; R321-R325 VanDerWaalsContact O-N 3.08Å
322	R	84.1	Confident	82.4	Confident	175 Å²	175	118.5 Å²	118.5	66%	0.66	52%	0.518	S	S	*	.	H	α-helix	trans	-66.8	-46.9	170.7	-169.3	169.4	-177	152.1	1.1	112	E318 R320 R324 R325 N326	E318-R322 PolarHBondContact O-N 2.95Å; R320-R322 VanDerWaalsContact C-N 3.28Å; R320-R322 PolarHBondContact O-N 3.13Å; R322-R324 VanDerWaalsContact C-N 3.31Å; R322-R324 PolarHBondContact O-N 2.95Å; R322-R325 PolarHBondContact O-N 3.11Å; R322-N326 WeakPolarHBondContact O-CB 3.23Å; R322-N326 PolarHBondContact O-N 3.1Å; R322-N326 PolarHBondContact O-OD1 3.44Å
323	R	82.6	Confident	82.1	Confident	156 Å²	156	118.5 Å²	118.5	59%	0.589	52%	0.519	S	S	*	.	H	α-helix	trans	-64.3	-28.3	174.7	-75.6	-171.7	-165.1	79	-4.7	114.5	S319 R320 R327	S319-R323 WeakPolarHBondContact O-CG 3.23Å; S319-R323 PolarHBondContact O-N 3.05Å; S319-R323 VanDerWaalsContact O-N 3.14Å; S319-R323 PolarHBondContact O-NH1 3.11Å; S319-R323 VanDerWaalsContact O-NH1 3.08Å; S319-R323 PolarHBondContact OG-NH1 3.37Å; R320-R323 CarbonylContact O-C 3.56Å; R320-R323 PolarHBondContact O-N 3.35Å; R320-R323 VanDerWaalsContact O-N 3.12Å; R323-R327 WeakPolarHBondContact O-CG 3.42Å; R323-R327 PolarHBondContact O-N 3.36Å; R323-R327 PolarHBondContact O-NE 2.85Å
324	R	81.6	Confident	82.1	Confident	115 Å²	115	117.4 Å²	117.4	43%	0.434	52%	0.518	S	S	.	.	H	α-helix	trans	-64.9	-64.6	168.8	-68	-174.9	-167	103.2	-6.3	108.4	E317 R320 R322 N326 R327 D328	E317-R324 IonicContact OE1-CZ 2.99Å; E317-R324 IonicContact OE1-NH1 2.93Å; E317-R324 PolarHBondContact OE1-NH1 2.98Å; E317-R324 IonicContact OE1-NH2 3.83Å; E317-R324 PolarHBondContact OE1-NH2 3.24Å; R320-R324 WeakPolarHBondContact O-CG 3.39Å; R320-R324 PolarHBondContact O-N 3.5Å; R322-R324 VanDerWaalsContact C-N 3.31Å; R322-R324 PolarHBondContact O-N 2.95Å; R324-N326 PolarHBondContact O-N 3.12Å; R324-R327 PolarHBondContact O-N 2.96Å; R324-D328 VanDerWaalsContact C-CG 3.43Å; R324-D328 PolarHBondContact O-N 2.76Å; R324-D328 VanDerWaalsContact O-OD1 3.11Å; R324-D328 VanDerWaalsContact O-OD2 3.13Å
325	R	79.2	Confident	82.2	Confident	133 Å²	133	110 Å²	110	50%	0.502	49%	0.487	S	S	.	.	H	α-helix	trans	-51.3	-39.5	-179.7	-166.9	-170.4	-67.2	110.7	-9.9	114	R321 R322 D328 I329	R321-R325 PolarHBondContact O-N 2.68Å; R321-R325 VanDerWaalsContact O-N 3.08Å; R322-R325 PolarHBondContact O-N 3.11Å; R325-D328 WeakPolarHBondContact CA-OD2 3.36Å; R325-D328 PolarHBondContact N-OD2 2.94Å; R325-D328 PolarHBondContact O-N 3.02Å; R325-I329 HydrophobicContact CG-CD1 3.99Å; R325-I329 HydrophobicContact CG-CG1 4.49Å; R325-I329 VanDerWaalsContact O-CG1 3.28Å; R325-I329 WeakPolarHBondContact O-CG1 3.19Å; R325-I329 PolarHBondContact O-N 2.83Å
326	N	76.7	Confident	82.4	Confident	68 Å²	68	105.7 Å²	105.7	36%	0.364	47%	0.47	S	S	.	.	H	α-helix	trans	-59.8	-50.4	176	-102.1	90.3	0	0	0	112	R322 R324 D328 I329 E330	R322-N326 WeakPolarHBondContact O-CB 3.23Å; R322-N326 PolarHBondContact O-N 3.1Å; R322-N326 PolarHBondContact O-OD1 3.44Å; R324-N326 PolarHBondContact O-N 3.12Å; N326-D328 VanDerWaalsContact C-N 3.3Å; N326-D328 PolarHBondContact O-N 2.77Å; N326-I329 PolarHBondContact O-N 3.29Å; N326-E330 VanDerWaalsContact C-CD 3.49Å; N326-E330 WeakPolarHBondContact CB-OE1 3.38Å; N326-E330 PolarHBondContact ND2-OE1 3.14Å; N326-E330 WeakPolarHBondContact O-CB 3.48Å; N326-E330 WeakPolarHBondContact O-CG 3.42Å; N326-E330 PolarHBondContact O-N 2.86Å
327	R	73.8	Confident	82.5	Confident	156 Å²	156	105.1 Å²	105.1	59%	0.589	47%	0.474	S	S	*	.	H	α-helix	trans	-66.6	-31.9	175	-66.1	-178.4	-50.5	142.1	24.8	112.9	R323 R324 I329 E330 F331	R323-R327 WeakPolarHBondContact O-CG 3.42Å; R323-R327 PolarHBondContact O-N 3.36Å; R323-R327 PolarHBondContact O-NE 2.85Å; R324-R327 PolarHBondContact O-N 2.96Å; R327-I329 VanDerWaalsContact C-N 3.29Å; R327-E330 PolarHBondContact O-N 2.96Å; R327-F331 VanDerWaalsContact O-CB 3.25Å; R327-F331 WeakPolarHBondContact O-CB 3.44Å; R327-F331 PolarHBondContact O-N 3.25Å
328	D	74.4	Confident	82.8	Confident	86 Å²	86	104.9 Å²	104.9	46%	0.46	47%	0.474	S	S	.	.	H	α-helix	trans	-65.5	-36.6	176.2	-47.8	-29.1	0	0	0	110.1	R324 R325 N326 L332	R324-D328 VanDerWaalsContact C-CG 3.43Å; R324-D328 PolarHBondContact O-N 2.76Å; R324-D328 VanDerWaalsContact O-OD1 3.11Å; R324-D328 VanDerWaalsContact O-OD2 3.13Å; R325-D328 WeakPolarHBondContact CA-OD2 3.36Å; R325-D328 PolarHBondContact N-OD2 2.94Å; R325-D328 PolarHBondContact O-N 3.02Å; N326-D328 VanDerWaalsContact C-N 3.3Å; N326-D328 PolarHBondContact O-N 2.77Å; D328-L332 WeakPolarHBondContact O-CD1 3.46Å; D328-L332 VanDerWaalsContact O-CG 3.28Å; D328-L332 WeakPolarHBondContact O-CG 3.42Å; D328-L332 PolarHBondContact O-N 2.81Å
329	I	73.3	Confident	83.3	Confident	82 Å²	82	98.3 Å²	98.3	42%	0.421	44%	0.443	S	S	.	.	H	α-helix	trans	-73.8	-45.6	172.4	-66.9	162.2	0	0	0	111.4	R325 N326 R327 F331 L332 N333	R325-I329 HydrophobicContact CG-CD1 3.99Å; R325-I329 HydrophobicContact CG-CG1 4.49Å; R325-I329 VanDerWaalsContact O-CG1 3.28Å; R325-I329 WeakPolarHBondContact O-CG1 3.19Å; R325-I329 PolarHBondContact O-N 2.83Å; N326-I329 PolarHBondContact O-N 3.29Å; R327-I329 VanDerWaalsContact C-N 3.29Å; I329-F331 VanDerWaalsContact C-N 3.28Å; I329-F331 PolarHBondContact O-N 2.68Å; I329-L332 PolarHBondContact O-N 3.35Å; I329-L332 VanDerWaalsContact O-N 3.12Å; I329-N333 PolarHBondContact O-N 2.91Å; I329-N333 PolarHBondContact O-OD1 2.85Å
330	E	75.6	Confident	83.8	Confident	93 Å²	93	99.3 Å²	99.3	44%	0.435	45%	0.448	S	S	.	.	H	α-helix	trans	-56.9	-42.8	178	-69.5	146.2	-153.2	0	0	110.6	N326 R327 N333 D334	N326-E330 VanDerWaalsContact C-CD 3.49Å; N326-E330 WeakPolarHBondContact CB-OE1 3.38Å; N326-E330 PolarHBondContact ND2-OE1 3.14Å; N326-E330 WeakPolarHBondContact O-CB 3.48Å; N326-E330 WeakPolarHBondContact O-CG 3.42Å; N326-E330 PolarHBondContact O-N 2.86Å; R327-E330 PolarHBondContact O-N 2.96Å; E330-N333 PolarHBondContact O-N 3.44Å; E330-D334 WeakPolarHBondContact O-CB 3.45Å; E330-D334 VanDerWaalsContact O-CG 3.23Å; E330-D334 PolarHBondContact O-N 3.22Å
331	F	74.9	Confident	84.2	Confident	121 Å²	121	98.7 Å²	98.7	53%	0.531	45%	0.449	S	S	.	.	H	α-helix	trans	-69.7	-29.8	176.1	180	-96.8	0	0	0	114.6	R327 I329 S335	R327-F331 VanDerWaalsContact O-CB 3.25Å; R327-F331 WeakPolarHBondContact O-CB 3.44Å; R327-F331 PolarHBondContact O-N 3.25Å; I329-F331 VanDerWaalsContact C-N 3.28Å; I329-F331 PolarHBondContact O-N 2.68Å; F331-S335 WeakPolarHBondContact O-CB 3.28Å; F331-S335 PolarHBondContact O-N 3.44Å; F331-S335 PolarHBondContact O-OG 3.01Å
332	L	72.7	Confident	84.7	Confident	101 Å²	101	90.6 Å²	90.6	53%	0.529	42%	0.419	S	S	.	.	H	α-helix	trans	-69.6	-49.5	172.8	-76.3	166.8	0	0	0	110	D328 I329 D334 S335 D336	D328-L332 WeakPolarHBondContact O-CD1 3.46Å; D328-L332 VanDerWaalsContact O-CG 3.28Å; D328-L332 WeakPolarHBondContact O-CG 3.42Å; D328-L332 PolarHBondContact O-N 2.81Å; I329-L332 PolarHBondContact O-N 3.35Å; I329-L332 VanDerWaalsContact O-N 3.12Å; L332-D334 PolarHBondContact O-N 3.19Å; L332-S335 CarbonylContact O-C 3.57Å; L332-S335 WeakPolarHBondContact O-CA 3.26Å; L332-S335 VanDerWaalsContact O-CB 3.3Å; L332-S335 WeakPolarHBondContact O-CB 3.28Å; L332-S335 PolarHBondContact O-N 3.07Å; L332-D336 PolarHBondContact O-N 3.19Å
333	N	82.5	Confident	85.4	Confident	90 Å²	90	83.2 Å²	83.2	48%	0.481	39%	0.392	S	S	.	.	H	α-helix	trans	-56.5	-46.4	175.2	-68.8	25.2	0	0	0	112.1	I329 E330 S335 D336 D337	I329-N333 PolarHBondContact O-N 2.91Å; I329-N333 PolarHBondContact O-OD1 2.85Å; E330-N333 PolarHBondContact O-N 3.44Å; N333-S335 PolarHBondContact O-N 2.99Å; N333-S335 VanDerWaalsContact O-N 3.17Å; N333-D336 PolarHBondContact O-N 2.83Å; N333-D337 PolarHBondContact O-N 2.93Å
334	D	88.3	Confident	86.1	Confident	112 Å²	112	79.6 Å²	79.6	60%	0.599	39%	0.391	S	S	*	.	H	α-helix	trans	-57.7	-27.8	174.6	-72.5	-13.3	0	0	0	112.4	E330 L332	E330-D334 WeakPolarHBondContact O-CB 3.45Å; E330-D334 VanDerWaalsContact O-CG 3.23Å; E330-D334 PolarHBondContact O-N 3.22Å; L332-D334 PolarHBondContact O-N 3.19Å
335	S	90.7	Very high	86.9	Confident	9 Å²	9	77.6 Å²	77.6	6%	0.063	38%	0.383	C	S	.	.	H	α-helix	trans	-84.6	-37.1	177.5	-59.1	0	0	0	0	112.5	F331 L332 N333 L338 I339	F331-S335 WeakPolarHBondContact O-CB 3.28Å; F331-S335 PolarHBondContact O-N 3.44Å; F331-S335 PolarHBondContact O-OG 3.01Å; L332-S335 CarbonylContact O-C 3.57Å; L332-S335 WeakPolarHBondContact O-CA 3.26Å; L332-S335 VanDerWaalsContact O-CB 3.3Å; L332-S335 WeakPolarHBondContact O-CB 3.28Å; L332-S335 PolarHBondContact O-N 3.07Å; N333-S335 PolarHBondContact O-N 2.99Å; N333-S335 VanDerWaalsContact O-N 3.17Å; S335-L338 PolarHBondContact O-N 3.01Å; S335-I339 WeakPolarHBondContact O-CD1 3.42Å; S335-I339 VanDerWaalsContact O-CG1 3.26Å; S335-I339 WeakPolarHBondContact O-CG1 3.49Å; S335-I339 PolarHBondContact O-N 3.35Å
336	D	93.4	Very high	87.8	Confident	46 Å²	46	71.2 Å²	71.2	25%	0.246	36%	0.359	C	S	.	.	H	α-helix	trans	-66	-45.6	175.2	-72.4	-47.3	0	0	0	111.4	L332 N333 L338 I339 V340 A385 N389	L332-D336 PolarHBondContact O-N 3.19Å; N333-D336 PolarHBondContact O-N 2.83Å; D336-L338 VanDerWaalsContact C-N 3.29Å; D336-L338 PolarHBondContact O-N 3.45Å; D336-I339 WeakPolarHBondContact O-CB 3.45Å; D336-I339 PolarHBondContact O-N 3.32Å; D336-V340 WeakPolarHBondContact O-CG2 3.31Å; D336-V340 PolarHBondContact O-N 2.78Å; D336-A385 WeakPolarHBondContact OD1-CB 3.48Å; D336-N389 PolarHBondContact OD1-ND2 3.09Å
337	D	94.2	Very high	88.7	Confident	119 Å²	119	71.2 Å²	71.2	64%	0.636	36%	0.356	S	S	*	.	H	α-helix	trans	-57	-43.1	175.5	-81	-20.3	0	0	0	111.3	N333 I339 V340 E341	N333-D337 PolarHBondContact O-N 2.93Å; D337-I339 PolarHBondContact O-N 2.67Å; D337-V340 PolarHBondContact O-N 2.94Å; D337-E341 WeakPolarHBondContact O-CB 3.44Å; D337-E341 PolarHBondContact O-N 2.93Å
338	L	94.5	Very high	89.9	Confident	64 Å²	64	66.4 Å²	66.4	34%	0.335	35%	0.346	S	S	.	.	H	α-helix	trans	-63.4	-38.8	174.7	175.2	64.2	0	0	0	112.4	S335 D336 T342	S335-L338 PolarHBondContact O-N 3.01Å; D336-L338 VanDerWaalsContact C-N 3.29Å; D336-L338 PolarHBondContact O-N 3.45Å; L338-T342 WeakPolarHBondContact O-CB 3.4Å; L338-T342 PolarHBondContact O-N 2.92Å; L338-T342 PolarHBondContact O-OG1 3.47Å
339	I	96.4	Very high	91	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-67.4	-46.9	177.4	-73.2	165.4	0	0	0	110.3	S335 D336 D337 E341 T342 I343 L382 A385 L386 N389 M391	S335-I339 WeakPolarHBondContact O-CD1 3.42Å; S335-I339 VanDerWaalsContact O-CG1 3.26Å; S335-I339 WeakPolarHBondContact O-CG1 3.49Å; S335-I339 PolarHBondContact O-N 3.35Å; D336-I339 WeakPolarHBondContact O-CB 3.45Å; D336-I339 PolarHBondContact O-N 3.32Å; D337-I339 PolarHBondContact O-N 2.67Å; I339-E341 PolarHBondContact O-N 3.43Å; I339-T342 WeakPolarHBondContact O-CB 3.31Å; I339-T342 PolarHBondContact O-N 2.89Å; I339-I343 HydrophobicContact CG2-CD1 3.72Å; I339-I343 HydrophobicContact CG2-CG1 4.4Å; I339-I343 VanDerWaalsContact O-CG1 3.29Å; I339-I343 WeakPolarHBondContact O-CG1 3.48Å; I339-I343 PolarHBondContact O-N 3.46Å; I339-L382 HydrophobicContact CD1-CB 4.39Å; I339-L382 HydrophobicContact CD1-CD1 4.33Å; I339-L382 HydrophobicContact CD1-CD2 4.3Å; I339-A385 HydrophobicContact CD1-CB 3.57Å; I339-L386 HydrophobicContact CD1-CD2 4.08Å; I339-L386 HydrophobicContact CD1-CG 4.14Å; I339-L386 HydrophobicContact CG1-CD2 3.9Å; I339-L386 HydrophobicContact CG2-CD2 4Å; I339-N389 HydrophobicContact CG2-CB 3.66Å; I339-M391 HydrophobicContact CG2-CE 4.4Å
340	V	96.4	Very high	92.1	Very high	73 Å²	73	58.7 Å²	58.7	44%	0.442	31%	0.307	S	S	.	.	H	α-helix	trans	-63	-42	178.5	173.5	0	0	0	0	111.4	D336 D337 T342 I343 S344 N389	D336-V340 WeakPolarHBondContact O-CG2 3.31Å; D336-V340 PolarHBondContact O-N 2.78Å; D337-V340 PolarHBondContact O-N 2.94Å; V340-T342 PolarHBondContact O-N 3.41Å; V340-I343 PolarHBondContact O-N 2.91Å; V340-S344 WeakPolarHBondContact O-CB 3.43Å; V340-S344 PolarHBondContact O-N 3Å; V340-N389 HydrophobicContact CG2-CB 4.26Å; V340-N389 WeakPolarHBondContact CG2-OD1 3.37Å
341	E	96.6	Very high	93	Very high	104 Å²	104	57.6 Å²	57.6	49%	0.486	30%	0.304	S	S	.	.	H	α-helix	trans	-61.3	-44	173.5	-163.5	-146.6	107.1	0	0	111.4	D337 I339 S344 R345	D337-E341 WeakPolarHBondContact O-CB 3.44Å; D337-E341 PolarHBondContact O-N 2.93Å; I339-E341 PolarHBondContact O-N 3.43Å; E341-S344 PolarHBondContact O-N 3.17Å; E341-R345 WeakPolarHBondContact O-CG 3.43Å; E341-R345 PolarHBondContact O-N 2.98Å; E341-R345 IonicContact OE1-CZ 2.71Å; E341-R345 IonicContact OE1-NE 3.04Å; E341-R345 PolarHBondContact OE1-NE 3.03Å; E341-R345 IonicContact OE1-NH2 3.86Å; E341-R345 PolarHBondContact OE1-NH2 3.25Å
342	T	97.2	Very high	94	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-62.2	-44.1	177	-58.1	0	0	0	0	111.4	L338 I339 V340 R345 M346 M369 I376 M391	L338-T342 WeakPolarHBondContact O-CB 3.4Å; L338-T342 PolarHBondContact O-N 2.92Å; L338-T342 PolarHBondContact O-OG1 3.47Å; I339-T342 WeakPolarHBondContact O-CB 3.31Å; I339-T342 PolarHBondContact O-N 2.89Å; V340-T342 PolarHBondContact O-N 3.41Å; T342-R345 PolarHBondContact O-N 2.98Å; T342-M346 HydrophobicContact CG2-SD 4.43Å; T342-M346 WeakPolarHBondContact O-CB 3.42Å; T342-M346 WeakPolarHBondContact O-CG 3.48Å; T342-M346 PolarHBondContact O-N 3.47Å; T342-M369 HydrophobicContact CG2-CE 4.01Å; T342-M369 WeakPolarHBondContact O-CE 3.15Å; T342-I376 HydrophobicContact CG2-CD1 3.77Å; T342-I376 WeakPolarHBondContact OG1-CD1 3.41Å; T342-M391 HydrophobicContact CG2-CE 4.12Å
343	I	97.7	Very high	95.1	Very high	19 Å²	19	50 Å²	50	10%	0.097	27%	0.268	C	S	.	.	H	α-helix	trans	-61.2	-46.4	177.1	-72.3	169.9	0	0	0	110.5	I339 V340 R345 M346 K347 N389 M391 A394	I339-I343 HydrophobicContact CG2-CD1 3.72Å; I339-I343 HydrophobicContact CG2-CG1 4.4Å; I339-I343 VanDerWaalsContact O-CG1 3.29Å; I339-I343 WeakPolarHBondContact O-CG1 3.48Å; I339-I343 PolarHBondContact O-N 3.46Å; V340-I343 PolarHBondContact O-N 2.91Å; I343-R345 PolarHBondContact O-N 3.3Å; I343-M346 WeakPolarHBondContact O-CB 3.48Å; I343-M346 PolarHBondContact O-N 3.08Å; I343-K347 WeakPolarHBondContact O-CG 3.5Å; I343-K347 PolarHBondContact O-N 2.66Å; I343-N389 HydrophobicContact CD1-CB 4.07Å; I343-N389 WeakPolarHBondContact CD1-O 3.23Å; I343-M391 HydrophobicContact CD1-CB 4.06Å; I343-M391 HydrophobicContact CD1-CE 4.16Å; I343-M391 HydrophobicContact CG1-CB 4.36Å; I343-M391 HydrophobicContact CG1-CE 3.52Å; I343-M391 HydrophobicContact CG1-SD 3.79Å; I343-A394 HydrophobicContact CG2-CB 4.32Å
344	S	97.8	Very high	95.6	Very high	80 Å²	80	48.5 Å²	48.5	56%	0.559	26%	0.255	S	S	*	.	H	α-helix	trans	-57.8	-47.1	176.1	-175.3	0	0	0	0	111.7	V340 E341 M346 K347 S348	V340-S344 WeakPolarHBondContact O-CB 3.43Å; V340-S344 PolarHBondContact O-N 3Å; E341-S344 PolarHBondContact O-N 3.17Å; S344-M346 PolarHBondContact O-N 2.86Å; S344-K347 PolarHBondContact O-N 2.95Å; S344-S348 PolarHBondContact O-N 2.99Å
345	R	97.9	Very high	95.9	Very high	73 Å²	73	49 Å²	49	28%	0.275	25%	0.254	S	S	.	.	H	α-helix	trans	-65	-35.4	175.8	-72.1	-171.4	-71.5	114	-7.5	113.1	E341 T342 I343 A349 M369 E372	E341-R345 WeakPolarHBondContact O-CG 3.43Å; E341-R345 PolarHBondContact O-N 2.98Å; E341-R345 IonicContact OE1-CZ 2.71Å; E341-R345 IonicContact OE1-NE 3.04Å; E341-R345 PolarHBondContact OE1-NE 3.03Å; E341-R345 IonicContact OE1-NH2 3.86Å; E341-R345 PolarHBondContact OE1-NH2 3.25Å; T342-R345 PolarHBondContact O-N 2.98Å; I343-R345 PolarHBondContact O-N 3.3Å; R345-A349 WeakPolarHBondContact O-CB 3.34Å; R345-A349 PolarHBondContact O-N 3.28Å; R345-M369 HydrophobicContact CB-CE 3.62Å; R345-M369 HydrophobicContact CB-SD 4.09Å; R345-E372 IonicContact CZ-OE1 2.91Å; R345-E372 VanDerWaalsContact CZ-OE1 3.22Å; R345-E372 IonicContact NH1-OE1 2.79Å; R345-E372 PolarHBondContact NH1-OE1 3.45Å; R345-E372 IonicContact NH1-OE2 2.98Å; R345-E372 PolarHBondContact NH1-OE2 3.33Å; R345-E372 IonicContact NH2-OE1 2.69Å; R345-E372 PolarHBondContact NH2-OE1 3.34Å
346	M	98	Very high	96.1	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-63.4	-43.8	174.2	-78.9	-177.5	67.1	0	0	111.8	T342 I343 S344 A349 A350 M369 V373 M391 A394 I395 W398	T342-M346 HydrophobicContact CG2-SD 4.43Å; T342-M346 WeakPolarHBondContact O-CB 3.42Å; T342-M346 WeakPolarHBondContact O-CG 3.48Å; T342-M346 PolarHBondContact O-N 3.47Å; I343-M346 WeakPolarHBondContact O-CB 3.48Å; I343-M346 PolarHBondContact O-N 3.08Å; S344-M346 PolarHBondContact O-N 2.86Å; M346-A349 PolarHBondContact O-N 3.46Å; M346-A350 PolarHBondContact O-N 3.35Å; M346-M369 HydrophobicContact CB-CE 4.38Å; M346-M369 HydrophobicContact CG-CE 3.54Å; M346-M369 HydrophobicContact CG-SD 4.02Å; M346-V373 HydrophobicContact CE-CG1 3.86Å; M346-V373 HydrophobicContact CE-CG2 4.38Å; M346-V373 HydrophobicContact CG-CG2 3.65Å; M346-V373 HydrophobicContact SD-CB 4.33Å; M346-V373 HydrophobicContact SD-CG1 3.66Å; M346-V373 HydrophobicContact SD-CG2 3.64Å; M346-M391 HydrophobicContact CE-SD 4.23Å; M346-M391 HydrophobicContact SD-CE 4.25Å; M346-M391 HydrophobicContact SD-SD 3.46Å; M346-A394 HydrophobicContact CB-CB 4.03Å; M346-A394 HydrophobicContact CE-CB 3.96Å; M346-A394 HydrophobicContact SD-CB 4.25Å; M346-I395 HydrophobicContact CE-CG1 4.31Å; M346-W398 HydrophobicContact CB-CZ2 4.16Å; M346-W398 HydrophobicContact CE-CD2 3.77Å; M346-W398 HydrophobicContact CE-CE3 4.2Å; M346-W398 HydrophobicContact CE-CG 4.09Å; M346-W398 HydrophobicContact CE-CZ2 4.17Å; M346-W398 HydrophobicContact CG-CZ2 3.79Å; M346-W398 PolarHBondContact O-NE1 2.85Å
347	K	97.4	Very high	96	Very high	67 Å²	67	52.2 Å²	52.2	29%	0.291	27%	0.27	S	S	.	.	H	α-helix	trans	-66.7	-45.4	177.8	-63.2	-162.2	168.5	-168.5	0	111.5	I343 S344 A349 A350 D351 S393 A394 E397	I343-K347 WeakPolarHBondContact O-CG 3.5Å; I343-K347 PolarHBondContact O-N 2.66Å; S344-K347 PolarHBondContact O-N 2.95Å; K347-A349 VanDerWaalsContact C-N 3.32Å; K347-A349 PolarHBondContact O-N 3.32Å; K347-A350 WeakPolarHBondContact O-CA 3.36Å; K347-A350 WeakPolarHBondContact O-CB 3.48Å; K347-A350 PolarHBondContact O-N 2.97Å; K347-D351 PolarHBondContact O-N 3.18Å; K347-S393 PolarHBondContact NZ-OG 2.92Å; K347-A394 HydrophobicContact CG-CB 4.3Å; K347-E397 VanDerWaalsContact CD-OE2 3.26Å; K347-E397 WeakPolarHBondContact CD-OE2 3.5Å; K347-E397 WeakPolarHBondContact CE-OE2 3.31Å; K347-E397 VanDerWaalsContact CG-OE2 3.24Å; K347-E397 WeakPolarHBondContact CG-OE2 3.19Å
348	S	97.5	Very high	95.9	Very high	55 Å²	55	51.8 Å²	51.8	39%	0.385	27%	0.271	S	S	.	.	H	α-helix	trans	-54.4	-45.9	171.2	-166	0	0	0	0	112.1	S344 A350 D351 E352	S344-S348 PolarHBondContact O-N 2.99Å; S348-A350 VanDerWaalsContact C-N 3.27Å; S348-A350 PolarHBondContact O-N 3.18Å; S348-D351 PolarHBondContact O-N 2.88Å; S348-E352 WeakPolarHBondContact O-CB 3.36Å; S348-E352 WeakPolarHBondContact O-CG 3.5Å; S348-E352 PolarHBondContact O-N 3.27Å; S348-E352 PolarHBondContact OG-OE1 3.22Å
349	A	97.2	Very high	95.9	Very high	5 Å²	5	51.5 Å²	51.5	4%	0.041	28%	0.278	C	S	.	.	H	α-helix	trans	-64.7	-28.4	177.6	0	0	0	0	0	113.5	R345 M346 K347 D353 K365 K366 M369 W398	R345-A349 WeakPolarHBondContact O-CB 3.34Å; R345-A349 PolarHBondContact O-N 3.28Å; M346-A349 PolarHBondContact O-N 3.46Å; K347-A349 VanDerWaalsContact C-N 3.32Å; K347-A349 PolarHBondContact O-N 3.32Å; A349-D353 WeakPolarHBondContact O-CB 3.43Å; A349-D353 PolarHBondContact O-N 3.34Å; A349-K365 HydrophobicContact CB-CB 3.95Å; A349-K366 HydrophobicContact CB-CG 4.27Å; A349-M369 HydrophobicContact CB-SD 4.19Å; A349-W398 HydrophobicContact CB-CZ2 4.4Å
350	A	96.3	Very high	95.6	Very high	1 Å²	1	57 Å²	57	1%	0.008	32%	0.317	C	S	.	.	H	α-helix	trans	-73.9	-47.3	173.2	0	0	0	0	0	111.4	M346 K347 S348 D353 R354 K366 E397	M346-A350 PolarHBondContact O-N 3.35Å; K347-A350 WeakPolarHBondContact O-CA 3.36Å; K347-A350 WeakPolarHBondContact O-CB 3.48Å; K347-A350 PolarHBondContact O-N 2.97Å; S348-A350 VanDerWaalsContact C-N 3.27Å; S348-A350 PolarHBondContact O-N 3.18Å; A350-D353 PolarHBondContact O-N 3.3Å; A350-R354 WeakPolarHBondContact O-CG 3.38Å; A350-R354 PolarHBondContact O-N 2.94Å; A350-K366 HydrophobicContact CB-CD 4.15Å; A350-E397 HydrophobicContact CB-CG 4.29Å; A350-E397 WeakPolarHBondContact CB-OE1 3.27Å
351	D	95.5	Very high	95.5	Very high	70 Å²	70	61.5 Å²	61.5	37%	0.374	33%	0.326	S	S	.	.	H	α-helix	trans	-59.2	-49.3	174.9	-97.2	-42.8	0	0	0	112.9	K347 S348 D353 R354 Q355	K347-D351 PolarHBondContact O-N 3.18Å; S348-D351 PolarHBondContact O-N 2.88Å; D351-D353 VanDerWaalsContact C-N 3.28Å; D351-D353 PolarHBondContact O-N 2.87Å; D351-R354 WeakPolarHBondContact O-CB 3.34Å; D351-R354 PolarHBondContact O-N 3.38Å; D351-R354 VanDerWaalsContact O-N 3.1Å; D351-R354 IonicContact OD1-CZ 3.46Å; D351-R354 IonicContact OD1-NE 2.7Å; D351-R354 PolarHBondContact OD1-NE 3.32Å; D351-R354 IonicContact OD1-NH2 2.71Å; D351-R354 PolarHBondContact OD1-NH2 3.03Å; D351-R354 IonicContact OD2-NH2 3.39Å; D351-R354 PolarHBondContact OD2-NH2 3.33Å; D351-Q355 VanDerWaalsContact O-CG 3.3Å; D351-Q355 WeakPolarHBondContact O-CG 3.49Å; D351-Q355 PolarHBondContact O-N 2.94Å
352	E	96	Very high	95.4	Very high	59 Å²	59	61.7 Å²	61.7	28%	0.276	34%	0.336	S	S	.	.	H	α-helix	trans	-61.7	-37	179.7	-71.5	172.9	-112	0	0	111.7	S348 Q355 L356 K365	S348-E352 WeakPolarHBondContact O-CB 3.36Å; S348-E352 WeakPolarHBondContact O-CG 3.5Å; S348-E352 PolarHBondContact O-N 3.27Å; S348-E352 PolarHBondContact OG-OE1 3.22Å; E352-Q355 PolarHBondContact O-N 3.5Å; E352-L356 WeakPolarHBondContact O-CB 3.48Å; E352-L356 WeakPolarHBondContact O-CD1 3.49Å; E352-L356 WeakPolarHBondContact O-CG 3.37Å; E352-L356 PolarHBondContact O-N 3.24Å; E352-K365 HydrophobicContact CB-CG 3.9Å; E352-K365 IonicContact OE2-NZ 3.42Å; E352-K365 PolarHBondContact OE2-NZ 3.41Å
353	D	95.5	Very high	95.2	Very high	4 Å²	4	63 Å²	63	2%	0.021	35%	0.347	C	S	.	.	H	α-helix	trans	-69.6	-37.8	173.6	-84.5	-13.4	0	0	0	112.5	A349 A350 D351 L356 L357 A363 T364 K365 K366	A349-D353 WeakPolarHBondContact O-CB 3.43Å; A349-D353 PolarHBondContact O-N 3.34Å; A350-D353 PolarHBondContact O-N 3.3Å; D351-D353 VanDerWaalsContact C-N 3.28Å; D351-D353 PolarHBondContact O-N 2.87Å; D353-L356 PolarHBondContact O-N 3.44Å; D353-L357 WeakPolarHBondContact O-CG 3.25Å; D353-L357 PolarHBondContact O-N 2.65Å; D353-A363 HydrophobicContact CB-CB 3.73Å; D353-A363 VanDerWaalsContact OD1-CA 3.32Å; D353-A363 WeakPolarHBondContact OD1-CA 3.28Å; D353-A363 WeakPolarHBondContact OD1-CB 3.32Å; D353-T364 PolarHBondContact OD1-N 2.7Å; D353-K365 WeakPolarHBondContact OD1-CB 3.49Å; D353-K365 PolarHBondContact OD1-N 3.13Å; D353-K366 WeakPolarHBondContact OD2-CB 3.19Å; D353-K366 WeakPolarHBondContact OD2-CG 3.5Å; D353-K366 PolarHBondContact OD2-N 3.24Å; D353-K366 IonicContact OD2-NZ 3.92Å; D353-K366 PolarHBondContact OD2-NZ 3.03Å
354	R	93.5	Very high	95.1	Very high	59 Å²	59	64.6 Å²	64.6	22%	0.223	36%	0.358	C	S	.	.	H	α-helix	trans	-60.3	-48.1	171.9	-72	-175.2	-68.1	-103	5.4	110.2	A350 D351 L356 L357 T358 E397	A350-R354 WeakPolarHBondContact O-CG 3.38Å; A350-R354 PolarHBondContact O-N 2.94Å; D351-R354 WeakPolarHBondContact O-CB 3.34Å; D351-R354 PolarHBondContact O-N 3.38Å; D351-R354 VanDerWaalsContact O-N 3.1Å; D351-R354 IonicContact OD1-CZ 3.46Å; D351-R354 IonicContact OD1-NE 2.7Å; D351-R354 PolarHBondContact OD1-NE 3.32Å; D351-R354 IonicContact OD1-NH2 2.71Å; D351-R354 PolarHBondContact OD1-NH2 3.03Å; D351-R354 IonicContact OD2-NH2 3.39Å; D351-R354 PolarHBondContact OD2-NH2 3.33Å; R354-L356 PolarHBondContact O-N 3.47Å; R354-L357 PolarHBondContact O-N 2.93Å; R354-T358 PolarHBondContact O-N 2.86Å; R354-T358 PolarHBondContact O-OG1 3.49Å; R354-T358 VanDerWaalsContact O-OG1 3.09Å; R354-E397 IonicContact CZ-OE1 3.29Å; R354-E397 VanDerWaalsContact CZ-OE1 3.29Å; R354-E397 IonicContact NH1-OE1 3.06Å; R354-E397 PolarHBondContact NH1-OE1 3.05Å; R354-E397 IonicContact NH2-OE1 2.71Å; R354-E397 PolarHBondContact NH2-OE1 3.48Å
355	Q	94.5	Very high	95.1	Very high	122 Å²	122	64.5 Å²	64.5	57%	0.57	35%	0.347	S	S	*	.	H	α-helix	trans	-62.3	-41.7	177.5	-67.8	170	32.6	0	0	112.6	D351 E352 T358 A359	D351-Q355 VanDerWaalsContact O-CG 3.3Å; D351-Q355 WeakPolarHBondContact O-CG 3.49Å; D351-Q355 PolarHBondContact O-N 2.94Å; E352-Q355 PolarHBondContact O-N 3.5Å; Q355-T358 PolarHBondContact O-N 2.87Å; Q355-A359 WeakPolarHBondContact O-CB 3.41Å; Q355-A359 PolarHBondContact O-N 2.99Å
356	L	94.4	Very high	95	Very high	42 Å²	42	61.6 Å²	61.6	22%	0.22	34%	0.337	C	S	.	.	H	α-helix	trans	-61.9	-43.2	176.1	-77.2	166.9	0	0	0	111.4	E352 D353 R354 A359 S360 R361 A363 K365	E352-L356 WeakPolarHBondContact O-CB 3.48Å; E352-L356 WeakPolarHBondContact O-CD1 3.49Å; E352-L356 WeakPolarHBondContact O-CG 3.37Å; E352-L356 PolarHBondContact O-N 3.24Å; D353-L356 PolarHBondContact O-N 3.44Å; R354-L356 PolarHBondContact O-N 3.47Å; L356-A359 CarbonylContact O-C 3.37Å; L356-A359 WeakPolarHBondContact O-CA 3.36Å; L356-A359 PolarHBondContact O-N 3.02Å; L356-S360 PolarHBondContact O-N 2.96Å; L356-S360 VanDerWaalsContact O-N 3.15Å; L356-R361 CarbonylContact C-O 3.56Å; L356-R361 HydrophobicContact CB-CB 4.38Å; L356-R361 HydrophobicContact CD2-CB 3.78Å; L356-R361 PolarHBondContact O-N 3.46Å; L356-A363 HydrophobicContact CB-CB 4.46Å; L356-K365 HydrophobicContact CD1-CG 4.26Å
357	L	92.2	Very high	95	Very high	80 Å²	80	64.4 Å²	64.4	42%	0.419	35%	0.351	S	S	.	.	H	α-helix	trans	-66.4	-43	176.8	-77.6	159.9	0	0	0	112.5	D353 R354 A359 S360 A363 L402	D353-L357 WeakPolarHBondContact O-CG 3.25Å; D353-L357 PolarHBondContact O-N 2.65Å; R354-L357 PolarHBondContact O-N 2.93Å; L357-A359 PolarHBondContact O-N 2.7Å; L357-S360 WeakPolarHBondContact O-CA 3.35Å; L357-S360 PolarHBondContact O-N 2.97Å; L357-A363 HydrophobicContact CD1-CB 3.79Å; L357-A363 HydrophobicContact CD2-CB 4.37Å; L357-A363 HydrophobicContact CG-CB 3.72Å; L357-L402 HydrophobicContact CD1-CD2 3.29Å
358	T	91.9	Very high	95	Very high	110 Å²	110	66.9 Å²	66.9	68%	0.675	37%	0.368	S	S	*	.	H	α-helix	trans	-58.4	-36.2	171.5	-56.2	0	0	0	0	111.6	R354 Q355 S360	R354-T358 PolarHBondContact O-N 2.86Å; R354-T358 PolarHBondContact O-OG1 3.49Å; R354-T358 VanDerWaalsContact O-OG1 3.09Å; Q355-T358 PolarHBondContact O-N 2.87Å; T358-S360 PolarHBondContact O-N 3.2Å
359	A	93.1	Very high	94.9	Very high	58 Å²	58	65.2 Å²	65.2	48%	0.479	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	7	173.6	0	0	0	0	0	114.5	Q355 L356 L357 R361	Q355-A359 WeakPolarHBondContact O-CB 3.41Å; Q355-A359 PolarHBondContact O-N 2.99Å; L356-A359 CarbonylContact O-C 3.37Å; L356-A359 WeakPolarHBondContact O-CA 3.36Å; L356-A359 PolarHBondContact O-N 3.02Å; L357-A359 PolarHBondContact O-N 2.7Å; A359-R361 HydrophobicContact CB-CG 4.39Å; A359-R361 PolarHBondContact O-N 2.84Å
360	S	92	Very high	94.9	Very high	116 Å²	116	65.4 Å²	65.4	81%	0.811	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.6	35.2	-175.7	-60.8	0	0	0	0	114.3	L356 L357 T358	L356-S360 PolarHBondContact O-N 2.96Å; L356-S360 VanDerWaalsContact O-N 3.15Å; L357-S360 WeakPolarHBondContact O-CA 3.35Å; L357-S360 PolarHBondContact O-N 2.97Å; T358-S360 PolarHBondContact O-N 3.2Å
361	R	94.1	Very high	94.9	Very high	167 Å²	167	73.8 Å²	73.8	63%	0.63	39%	0.391	S	S	*	.	S	Bend	trans	-111.5	154.8	178.3	-67.8	178.2	-179.4	-168.1	-1.1	111.3	L356 A359 A363	L356-R361 CarbonylContact C-O 3.56Å; L356-R361 HydrophobicContact CB-CB 4.38Å; L356-R361 HydrophobicContact CD2-CB 3.78Å; L356-R361 PolarHBondContact O-N 3.46Å; A359-R361 HydrophobicContact CB-CG 4.39Å; A359-R361 PolarHBondContact O-N 2.84Å; R361-A363 PolarHBondContact O-N 2.78Å
362	P	93.4	Very high	95	Very high	108 Å²	108	74.2 Å²	74.2	70%	0.701	39%	0.39	S	S	*	.			trans	-62.3	105.9	178.5	-24.4	35.4	0	0	0	113.5	T364	P362-T364 HydrophobicContact CB-CG2 4.4Å; P362-T364 PolarHBondContact O-N 2.84Å
363	A	93.5	Very high	95.1	Very high	27 Å²	27	71.5 Å²	71.5	22%	0.223	38%	0.378	C	S	.	.			trans	-63.1	122.9	165.4	0	0	0	0	0	110.3	D353 L356 L357 R361	D353-A363 HydrophobicContact CB-CB 3.73Å; D353-A363 VanDerWaalsContact OD1-CA 3.32Å; D353-A363 WeakPolarHBondContact OD1-CA 3.28Å; D353-A363 WeakPolarHBondContact OD1-CB 3.32Å; L356-A363 HydrophobicContact CB-CB 4.46Å; L357-A363 HydrophobicContact CD1-CB 3.79Å; L357-A363 HydrophobicContact CD2-CB 4.37Å; L357-A363 HydrophobicContact CG-CB 3.72Å; R361-A363 PolarHBondContact O-N 2.78Å
364	T	95.8	Very high	95.1	Very high	53 Å²	53	73.7 Å²	73.7	33%	0.325	39%	0.389	S	S	.	.			trans	-147	-6.3	-173.8	50.9	0	0	0	0	113.4	D353 P362 L367 N368	D353-T364 PolarHBondContact OD1-N 2.7Å; P362-T364 HydrophobicContact CB-CG2 4.4Å; P362-T364 PolarHBondContact O-N 2.84Å; T364-L367 PolarHBondContact O-N 3.11Å; T364-N368 WeakPolarHBondContact O-CB 3.34Å; T364-N368 PolarHBondContact O-N 3.35Å; T364-N368 PolarHBondContact O-ND2 2.83Å; T364-N368 VanDerWaalsContact O-ND2 3.17Å
365	K	96.9	Very high	95.2	Very high	79 Å²	79	73.4 Å²	73.4	34%	0.343	40%	0.399	S	S	.	.	H	α-helix	trans	-65.1	-46.6	-173.7	-60.8	-47.4	-166.6	82.1	0	111.7	A349 E352 D353 L356 L367 N368 M369	A349-K365 HydrophobicContact CB-CB 3.95Å; E352-K365 HydrophobicContact CB-CG 3.9Å; E352-K365 IonicContact OE2-NZ 3.42Å; E352-K365 PolarHBondContact OE2-NZ 3.41Å; D353-K365 WeakPolarHBondContact OD1-CB 3.49Å; D353-K365 PolarHBondContact OD1-N 3.13Å; L356-K365 HydrophobicContact CD1-CG 4.26Å; K365-L367 PolarHBondContact O-N 2.8Å; K365-N368 PolarHBondContact O-N 3.4Å; K365-M369 WeakPolarHBondContact O-CB 3.22Å; K365-M369 PolarHBondContact O-N 3.4Å; K365-M369 VanDerWaalsContact O-N 3.08Å
366	K	97.1	Very high	95.3	Very high	12 Å²	12	68.3 Å²	68.3	5%	0.052	38%	0.376	C	S	.	.	H	α-helix	trans	-61.1	-42.4	173.7	-68.1	-171.3	-64.9	-55.6	0	112.2	A349 A350 D353 N368 M369 L370 W398 I412	A349-K366 HydrophobicContact CB-CG 4.27Å; A350-K366 HydrophobicContact CB-CD 4.15Å; D353-K366 WeakPolarHBondContact OD2-CB 3.19Å; D353-K366 WeakPolarHBondContact OD2-CG 3.5Å; D353-K366 PolarHBondContact OD2-N 3.24Å; D353-K366 IonicContact OD2-NZ 3.92Å; D353-K366 PolarHBondContact OD2-NZ 3.03Å; K366-N368 PolarHBondContact O-N 2.93Å; K366-M369 PolarHBondContact O-N 3.41Å; K366-L370 WeakPolarHBondContact O-CB 3.34Å; K366-L370 PolarHBondContact O-N 2.7Å; K366-W398 HydrophobicContact CB-CD2 4.27Å; K366-W398 HydrophobicContact CB-CE3 4.32Å; K366-W398 HydrophobicContact CB-CH2 4.08Å; K366-W398 HydrophobicContact CB-CZ2 4.03Å; K366-W398 HydrophobicContact CB-CZ3 4.23Å; K366-W398 HydrophobicContact CD-CB 4.14Å; K366-W398 HydrophobicContact CD-CD2 3.66Å; K366-W398 HydrophobicContact CD-CE3 4.35Å; K366-W398 HydrophobicContact CD-CG 3.55Å; K366-W398 HydrophobicContact CG-CD2 3.92Å; K366-W398 HydrophobicContact CG-CE3 4.47Å; K366-W398 HydrophobicContact CG-CG 4.29Å; K366-W398 HydrophobicContact CG-CH2 4.4Å; K366-W398 HydrophobicContact CG-CZ2 3.84Å; K366-W398 WeakPolarHBondContact O-CH2 3.48Å; K366-I412 HydrophobicContact CB-CD1 3.65Å; K366-I412 HydrophobicContact CD-CD1 4.48Å
367	L	96.8	Very high	95.4	Very high	58 Å²	58	66.3 Å²	66.3	30%	0.304	37%	0.366	S	S	.	.	H	α-helix	trans	-63.9	-39	178.7	-75.3	172.9	0	0	0	113	T364 K365 N409 V411 I412	T364-L367 PolarHBondContact O-N 3.11Å; K365-L367 PolarHBondContact O-N 2.8Å; L367-N409 HydrophobicContact CD1-CB 4.43Å; L367-N409 HydrophobicContact CD2-CB 4.25Å; L367-V411 HydrophobicContact CD2-CB 4.45Å; L367-I412 HydrophobicContact CD2-CD1 4.09Å; L367-I412 HydrophobicContact CD2-CG1 3.78Å; L367-I412 HydrophobicContact CG-CD1 4.17Å; L367-I412 HydrophobicContact CG-CG1 4.4Å
368	N	97	Very high	95.5	Very high	119 Å²	119	71.3 Å²	71.3	64%	0.636	38%	0.379	S	S	*	.	H	α-helix	trans	-67.9	-40	177.1	-69.1	-28.1	0	0	0	111.6	T364 K365 K366	T364-N368 WeakPolarHBondContact O-CB 3.34Å; T364-N368 PolarHBondContact O-N 3.35Å; T364-N368 PolarHBondContact O-ND2 2.83Å; T364-N368 VanDerWaalsContact O-ND2 3.17Å; K365-N368 PolarHBondContact O-N 3.4Å; K366-N368 PolarHBondContact O-N 2.93Å
369	M	96.5	Very high	95.6	Very high	20 Å²	20	69.6 Å²	69.6	10%	0.099	36%	0.36	C	S	.	.	H	α-helix	trans	-79.3	-24.1	-179.5	-166.9	-176.3	169.8	0	0	113.6	T342 R345 M346 A349 K365 K366 K371 E372 V373 W398	T342-M369 HydrophobicContact CG2-CE 4.01Å; T342-M369 WeakPolarHBondContact O-CE 3.15Å; R345-M369 HydrophobicContact CB-CE 3.62Å; R345-M369 HydrophobicContact CB-SD 4.09Å; M346-M369 HydrophobicContact CB-CE 4.38Å; M346-M369 HydrophobicContact CG-CE 3.54Å; M346-M369 HydrophobicContact CG-SD 4.02Å; A349-M369 HydrophobicContact CB-SD 4.19Å; K365-M369 WeakPolarHBondContact O-CB 3.22Å; K365-M369 PolarHBondContact O-N 3.4Å; K365-M369 VanDerWaalsContact O-N 3.08Å; K366-M369 PolarHBondContact O-N 3.41Å; M369-K371 PolarHBondContact O-N 2.88Å; M369-E372 WeakPolarHBondContact O-CB 3.43Å; M369-E372 PolarHBondContact O-N 2.96Å; M369-V373 HydrophobicContact CE-CG2 3.8Å; M369-V373 HydrophobicContact CG-CG2 4.01Å; M369-V373 PolarHBondContact O-N 2.88Å; M369-V373 HydrophobicContact SD-CG2 4.32Å; M369-W398 HydrophobicContact CB-CH2 4.15Å; M369-W398 HydrophobicContact CB-CZ2 4.4Å; M369-W398 HydrophobicContact CG-CH2 4.47Å; M369-W398 HydrophobicContact SD-CZ2 4.13Å
370	L	97.6	Very high	95.6	Very high	9 Å²	9	70.8 Å²	70.8	5%	0.047	37%	0.369	C	S	.	.	H	α-helix	trans	-48	-40	-173.4	178.6	63.5	0	0	0	114.1	K366 E372 V373 L374 W398 V411 I412 M416	K366-L370 WeakPolarHBondContact O-CB 3.34Å; K366-L370 PolarHBondContact O-N 2.7Å; L370-E372 VanDerWaalsContact C-N 3.32Å; L370-E372 PolarHBondContact O-N 3.34Å; L370-V373 PolarHBondContact O-N 2.64Å; L370-L374 HydrophobicContact CD1-CD1 3.84Å; L370-L374 HydrophobicContact CD1-CD2 4.38Å; L370-L374 HydrophobicContact CD1-CG 3.91Å; L370-L374 HydrophobicContact CG-CD1 3.8Å; L370-L374 HydrophobicContact CG-CG 4.29Å; L370-L374 WeakPolarHBondContact O-CB 3.34Å; L370-L374 VanDerWaalsContact O-CG 3.24Å; L370-L374 WeakPolarHBondContact O-CG 3.38Å; L370-L374 PolarHBondContact O-N 3.34Å; L370-W398 HydrophobicContact CB-CZ3 4.27Å; L370-W398 HydrophobicContact CD1-CZ3 3.9Å; L370-V411 HydrophobicContact CD2-CG1 3.97Å; L370-I412 HydrophobicContact CD2-CG1 4.4Å; L370-M416 HydrophobicContact CD1-CE 3.49Å; L370-M416 VanDerWaalsContact CD1-CE 3.49Å
371	K	96.8	Very high	95.6	Very high	178 Å²	178	70.4 Å²	70.4	77%	0.774	36%	0.358	S	S	*	.	H	α-helix	trans	-65.4	-33.7	-179.2	-64.6	-177.5	-179	176.3	0	113.4	M369 A375	M369-K371 PolarHBondContact O-N 2.88Å; K371-A375 PolarHBondContact O-N 3.41Å
372	E	96.3	Very high	95.6	Very high	79 Å²	79	62.8 Å²	62.8	37%	0.369	33%	0.33	S	S	.	.	H	α-helix	trans	-72.9	-48.3	176.9	-169.4	-165.1	154.9	0	0	110.1	R345 M369 L370 L374 A375 I376	R345-E372 IonicContact CZ-OE1 2.91Å; R345-E372 VanDerWaalsContact CZ-OE1 3.22Å; R345-E372 IonicContact NH1-OE1 2.79Å; R345-E372 PolarHBondContact NH1-OE1 3.45Å; R345-E372 IonicContact NH1-OE2 2.98Å; R345-E372 PolarHBondContact NH1-OE2 3.33Å; R345-E372 IonicContact NH2-OE1 2.69Å; R345-E372 PolarHBondContact NH2-OE1 3.34Å; M369-E372 WeakPolarHBondContact O-CB 3.43Å; M369-E372 PolarHBondContact O-N 2.96Å; L370-E372 VanDerWaalsContact C-N 3.32Å; L370-E372 PolarHBondContact O-N 3.34Å; E372-L374 PolarHBondContact O-N 3.22Å; E372-A375 WeakPolarHBondContact O-CB 3.39Å; E372-A375 PolarHBondContact O-N 3.41Å; E372-A375 VanDerWaalsContact O-N 3.08Å; E372-I376 PolarHBondContact O-N 3.27Å; E372-I376 VanDerWaalsContact O-N 3.17Å
373	V	97.4	Very high	95.6	Very high	2 Å²	2	59.1 Å²	59.1	1%	0.012	30%	0.303	C	S	.	.	H	α-helix	trans	-56.2	-48	177.4	175	0	0	0	0	111	M346 M369 L370 A375 I376 L377 W398 M416	M346-V373 HydrophobicContact CE-CG1 3.86Å; M346-V373 HydrophobicContact CE-CG2 4.38Å; M346-V373 HydrophobicContact CG-CG2 3.65Å; M346-V373 HydrophobicContact SD-CB 4.33Å; M346-V373 HydrophobicContact SD-CG1 3.66Å; M346-V373 HydrophobicContact SD-CG2 3.64Å; M369-V373 HydrophobicContact CE-CG2 3.8Å; M369-V373 HydrophobicContact CG-CG2 4.01Å; M369-V373 PolarHBondContact O-N 2.88Å; M369-V373 HydrophobicContact SD-CG2 4.32Å; L370-V373 PolarHBondContact O-N 2.64Å; V373-A375 VanDerWaalsContact C-N 3.3Å; V373-A375 PolarHBondContact O-N 3.16Å; V373-I376 PolarHBondContact O-N 2.98Å; V373-I376 VanDerWaalsContact O-N 3.12Å; V373-L377 HydrophobicContact CG1-CD1 3.67Å; V373-L377 HydrophobicContact CG1-CG 3.98Å; V373-L377 WeakPolarHBondContact O-CG 3.33Å; V373-L377 PolarHBondContact O-N 3.33Å; V373-W398 HydrophobicContact CB-CH2 4.48Å; V373-W398 HydrophobicContact CG2-CH2 3.84Å; V373-W398 HydrophobicContact CG2-CZ2 4.31Å; V373-W398 HydrophobicContact CG2-CZ3 4.43Å; V373-M416 HydrophobicContact CG1-CE 4.05Å
374	L	97.2	Very high	95.5	Very high	49 Å²	49	61.4 Å²	61.4	26%	0.257	32%	0.318	S	S	.	.	H	α-helix	trans	-65	-30.8	178.4	-66.9	171.9	0	0	0	113.4	L370 E372 I376 R378 M416 S419	L370-L374 HydrophobicContact CD1-CD1 3.84Å; L370-L374 HydrophobicContact CD1-CD2 4.38Å; L370-L374 HydrophobicContact CD1-CG 3.91Å; L370-L374 HydrophobicContact CG-CD1 3.8Å; L370-L374 HydrophobicContact CG-CG 4.29Å; L370-L374 WeakPolarHBondContact O-CB 3.34Å; L370-L374 VanDerWaalsContact O-CG 3.24Å; L370-L374 WeakPolarHBondContact O-CG 3.38Å; L370-L374 PolarHBondContact O-N 3.34Å; E372-L374 PolarHBondContact O-N 3.22Å; L374-I376 VanDerWaalsContact C-N 3.29Å; L374-I376 PolarHBondContact O-N 3.38Å; L374-R378 WeakPolarHBondContact O-CB 3.49Å; L374-R378 PolarHBondContact O-N 2.85Å; L374-M416 HydrophobicContact CD2-CE 4.18Å; L374-S419 WeakPolarHBondContact CD2-OG 3.18Å
375	A	95.9	Very high	95.4	Very high	53 Å²	53	59.6 Å²	59.6	44%	0.438	31%	0.308	S	S	.	.	H	α-helix	trans	-68	-31.6	174.8	0	0	0	0	0	112.3	K371 E372 V373	K371-A375 PolarHBondContact O-N 3.41Å; E372-A375 WeakPolarHBondContact O-CB 3.39Å; E372-A375 PolarHBondContact O-N 3.41Å; E372-A375 VanDerWaalsContact O-N 3.08Å; V373-A375 VanDerWaalsContact C-N 3.3Å; V373-A375 PolarHBondContact O-N 3.16Å
376	I	95.3	Very high	95.4	Very high	16 Å²	16	55.9 Å²	55.9	8%	0.082	29%	0.292	C	S	.	.	H	α-helix	trans	-79.6	-49.3	174.7	-65.5	168.4	0	0	0	110.7	T342 E372 V373 L374 R378 R379 L382 L386	T342-I376 HydrophobicContact CG2-CD1 3.77Å; T342-I376 WeakPolarHBondContact OG1-CD1 3.41Å; E372-I376 PolarHBondContact O-N 3.27Å; E372-I376 VanDerWaalsContact O-N 3.17Å; V373-I376 PolarHBondContact O-N 2.98Å; V373-I376 VanDerWaalsContact O-N 3.12Å; L374-I376 VanDerWaalsContact C-N 3.29Å; L374-I376 PolarHBondContact O-N 3.38Å; I376-R378 PolarHBondContact O-N 3.09Å; I376-R379 WeakPolarHBondContact O-CB 3.43Å; I376-R379 PolarHBondContact O-N 3.31Å; I376-L382 HydrophobicContact CG2-CD1 4.09Å; I376-L386 HydrophobicContact CG2-CD2 3.91Å
377	L	96	Very high	95.2	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-58.1	-33.9	-177.5	-71	178.9	0	0	0	113.1	V373 R379 K383 L386 M391 I395 M416 F423	V373-L377 HydrophobicContact CG1-CD1 3.67Å; V373-L377 HydrophobicContact CG1-CG 3.98Å; V373-L377 WeakPolarHBondContact O-CG 3.33Å; V373-L377 PolarHBondContact O-N 3.33Å; L377-R379 VanDerWaalsContact C-N 3.25Å; L377-R379 PolarHBondContact O-N 3.34Å; L377-K383 WeakPolarHBondContact O-CE 3.29Å; L377-K383 PolarHBondContact O-NZ 3.45Å; L377-L386 HydrophobicContact CD2-CD1 4.43Å; L377-M391 HydrophobicContact CD2-CG 3.72Å; L377-M391 HydrophobicContact CD2-SD 4.36Å; L377-I395 HydrophobicContact CD1-CD1 4.06Å; L377-I395 HydrophobicContact CD2-CD1 4.01Å; L377-M416 HydrophobicContact CD1-CE 4.14Å; L377-M416 HydrophobicContact CD1-SD 4.27Å; L377-F423 HydrophobicContact CD2-CE2 4.49Å; L377-F423 HydrophobicContact CD2-CZ 4.1Å
378	R	94.9	Very high	95.1	Very high	184 Å²	184	61.5 Å²	61.5	69%	0.694	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-8	178.5	-166.5	-178.9	61.2	167.4	-1.9	114	L374 I376 A380	L374-R378 WeakPolarHBondContact O-CB 3.49Å; L374-R378 PolarHBondContact O-N 2.85Å; I376-R378 PolarHBondContact O-N 3.09Å; R378-A380 PolarHBondContact O-N 2.94Å; R378-A380 VanDerWaalsContact O-N 3.17Å
379	R	93.8	Very high	95	Very high	75 Å²	75	58.4 Å²	58.4	28%	0.283	30%	0.301	S	S	.	.			trans	-76.2	102.1	178	-80.2	-179.2	64.7	-172.4	-5.5	110.7	I376 L377 D381 L382 K383	I376-R379 WeakPolarHBondContact O-CB 3.43Å; I376-R379 PolarHBondContact O-N 3.31Å; L377-R379 VanDerWaalsContact C-N 3.25Å; L377-R379 PolarHBondContact O-N 3.34Å; R379-D381 VanDerWaalsContact CB-OD1 3.31Å; R379-D381 WeakPolarHBondContact CB-OD1 3Å; R379-D381 IonicContact CZ-OD2 3.69Å; R379-D381 VanDerWaalsContact CZ-OD2 3.27Å; R379-D381 IonicContact NE-OD1 4Å; R379-D381 IonicContact NE-OD2 3.59Å; R379-D381 PolarHBondContact NE-OD2 3.23Å; R379-D381 IonicContact NH2-OD2 3.27Å; R379-D381 PolarHBondContact NH2-OD2 3.44Å; R379-D381 PolarHBondContact O-N 2.72Å; R379-L382 HydrophobicContact CB-CB 4.07Å; R379-L382 HydrophobicContact CB-CD1 4.05Å; R379-L382 HydrophobicContact CB-CG 3.89Å; R379-L382 PolarHBondContact O-N 3.37Å; R379-K383 PolarHBondContact O-N 3.3Å
380	A	93.2	Very high	94.9	Very high	82 Å²	82	58.8 Å²	58.8	68%	0.678	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-54.9	-34.7	176.2	0	0	0	0	0	112.8	R378 L382 K383	R378-A380 PolarHBondContact O-N 2.94Å; R378-A380 VanDerWaalsContact O-N 3.17Å; A380-L382 VanDerWaalsContact C-N 3.26Å; A380-L382 PolarHBondContact O-N 3.4Å; A380-K383 PolarHBondContact O-N 3.14Å
381	D	92.2	Very high	94.9	Very high	108 Å²	108	58.4 Å²	58.4	58%	0.578	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-66.6	-21.3	176.1	55.7	-61.4	0	0	0	114.2	R379	R379-D381 VanDerWaalsContact CB-OD1 3.31Å; R379-D381 WeakPolarHBondContact CB-OD1 3Å; R379-D381 IonicContact CZ-OD2 3.69Å; R379-D381 VanDerWaalsContact CZ-OD2 3.27Å; R379-D381 IonicContact NE-OD1 4Å; R379-D381 IonicContact NE-OD2 3.59Å; R379-D381 PolarHBondContact NE-OD2 3.23Å; R379-D381 IonicContact NH2-OD2 3.27Å; R379-D381 PolarHBondContact NH2-OD2 3.44Å; R379-D381 PolarHBondContact O-N 2.72Å
382	L	93.3	Very high	94.9	Very high	7 Å²	7	50 Å²	50	4%	0.037	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-99	-7.3	178.4	-63.7	-172.5	0	0	0	114.1	I339 I376 R379 A380 S384 A385 L386	I339-L382 HydrophobicContact CD1-CB 4.39Å; I339-L382 HydrophobicContact CD1-CD1 4.33Å; I339-L382 HydrophobicContact CD1-CD2 4.3Å; I376-L382 HydrophobicContact CG2-CD1 4.09Å; R379-L382 HydrophobicContact CB-CB 4.07Å; R379-L382 HydrophobicContact CB-CD1 4.05Å; R379-L382 HydrophobicContact CB-CG 3.89Å; R379-L382 PolarHBondContact O-N 3.37Å; A380-L382 VanDerWaalsContact C-N 3.26Å; A380-L382 PolarHBondContact O-N 3.4Å; L382-S384 VanDerWaalsContact C-N 3.28Å; L382-S384 PolarHBondContact O-N 3.47Å; L382-S384 VanDerWaalsContact O-N 3.14Å; L382-A385 PolarHBondContact O-N 2.95Å; L382-L386 HydrophobicContact CB-CD1 3.84Å; L382-L386 HydrophobicContact CB-CG 4.06Å; L382-L386 WeakPolarHBondContact O-CB 3.21Å; L382-L386 VanDerWaalsContact O-CG 3.26Å; L382-L386 WeakPolarHBondContact O-CG 3.44Å; L382-L386 PolarHBondContact O-N 2.81Å
383	K	93.3	Very high	94.9	Very high	31 Å²	31	48 Å²	48	14%	0.135	27%	0.267	C	S	.	.	H	α-helix	trans	-54.7	-39	-170.2	-68.5	-70	-165.9	-173.2	0	113.9	L377 R379 A380 I387 E422 F423	L377-K383 WeakPolarHBondContact O-CE 3.29Å; L377-K383 PolarHBondContact O-NZ 3.45Å; R379-K383 PolarHBondContact O-N 3.3Å; A380-K383 PolarHBondContact O-N 3.14Å; K383-I387 WeakPolarHBondContact O-CG1 3.21Å; K383-I387 PolarHBondContact O-N 3.17Å; K383-E422 VanDerWaalsContact NZ-CB 3.26Å; K383-E422 IonicContact NZ-OE2 2.93Å; K383-E422 PolarHBondContact NZ-OE2 2.95Å; K383-F423 HydrophobicContact CD-CD1 4.11Å; K383-F423 HydrophobicContact CD-CE1 3.71Å; K383-F423 HydrophobicContact CD-CE2 4.19Å; K383-F423 HydrophobicContact CD-CZ 3.77Å
384	S	92.8	Very high	94.9	Very high	76 Å²	76	48 Å²	48	53%	0.531	27%	0.267	S	S	.	.	H	α-helix	trans	-65.9	-56.5	177.2	-150.8	0	0	0	0	111	L382 L386 I387 E388	L382-S384 VanDerWaalsContact C-N 3.28Å; L382-S384 PolarHBondContact O-N 3.47Å; L382-S384 VanDerWaalsContact O-N 3.14Å; S384-L386 VanDerWaalsContact C-N 3.25Å; S384-L386 PolarHBondContact O-N 2.88Å; S384-I387 WeakPolarHBondContact O-CA 3.46Å; S384-I387 WeakPolarHBondContact O-CB 3.34Å; S384-I387 PolarHBondContact O-N 2.8Å; S384-E388 WeakPolarHBondContact CB-OE1 3.26Å; S384-E388 WeakPolarHBondContact O-CG 3.46Å; S384-E388 PolarHBondContact O-N 2.91Å; S384-E388 PolarHBondContact OG-OE1 3.18Å
385	A	93.8	Very high	94.9	Very high	15 Å²	15	45.6 Å²	45.6	12%	0.124	25%	0.254	C	S	.	.	H	α-helix	trans	-56.9	-34.9	176.7	0	0	0	0	0	113.3	D336 I339 L382 E388 N389	D336-A385 WeakPolarHBondContact OD1-CB 3.48Å; I339-A385 HydrophobicContact CD1-CB 3.57Å; L382-A385 PolarHBondContact O-N 2.95Å; A385-E388 PolarHBondContact O-N 3.25Å; A385-N389 WeakPolarHBondContact O-CB 3.47Å; A385-N389 PolarHBondContact O-N 3.39Å; A385-N389 PolarHBondContact O-ND2 3.2Å
386	L	95.5	Very high	94.9	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-64.7	-39.5	174.3	-71.8	166.1	0	0	0	111.9	I339 I376 L377 L382 S384 M391 F423	I339-L386 HydrophobicContact CD1-CD2 4.08Å; I339-L386 HydrophobicContact CD1-CG 4.14Å; I339-L386 HydrophobicContact CG1-CD2 3.9Å; I339-L386 HydrophobicContact CG2-CD2 4Å; I376-L386 HydrophobicContact CG2-CD2 3.91Å; L377-L386 HydrophobicContact CD2-CD1 4.43Å; L382-L386 HydrophobicContact CB-CD1 3.84Å; L382-L386 HydrophobicContact CB-CG 4.06Å; L382-L386 WeakPolarHBondContact O-CB 3.21Å; L382-L386 VanDerWaalsContact O-CG 3.26Å; L382-L386 WeakPolarHBondContact O-CG 3.44Å; L382-L386 PolarHBondContact O-N 2.81Å; S384-L386 VanDerWaalsContact C-N 3.25Å; S384-L386 PolarHBondContact O-N 2.88Å; L386-M391 HydrophobicContact CB-CB 4.09Å; L386-M391 HydrophobicContact CD2-CB 4.1Å; L386-M391 HydrophobicContact CD2-CE 3.5Å; L386-M391 VanDerWaalsContact CD2-CE 3.5Å; L386-M391 HydrophobicContact CD2-CG 3.98Å; L386-M391 WeakPolarHBondContact O-CB 3.26Å; L386-M391 PolarHBondContact O-N 3.35Å; L386-F423 HydrophobicContact CB-CE1 4.43Å
387	I	94.7	Very high	94.9	Very high	47 Å²	47	45.2 Å²	45.2	24%	0.241	25%	0.245	C	C	.	.	H	α-helix	trans	-68.5	-51.3	173.5	-66.8	163.3	0	0	0	110	K383 S384 N389 G390 L392 F423 L426 V430	K383-I387 WeakPolarHBondContact O-CG1 3.21Å; K383-I387 PolarHBondContact O-N 3.17Å; S384-I387 WeakPolarHBondContact O-CA 3.46Å; S384-I387 WeakPolarHBondContact O-CB 3.34Å; S384-I387 PolarHBondContact O-N 2.8Å; I387-N389 PolarHBondContact O-N 2.87Å; I387-G390 WeakPolarHBondContact O-CA 3.44Å; I387-G390 PolarHBondContact O-N 3.17Å; I387-L392 HydrophobicContact CG1-CD1 4.46Å; I387-F423 HydrophobicContact CD1-CD1 4.13Å; I387-F423 HydrophobicContact CG1-CD1 4.05Å; I387-F423 HydrophobicContact CG1-CE1 4.24Å; I387-L426 HydrophobicContact CD1-CD2 3.83Å; I387-L426 HydrophobicContact CG1-CD2 4.2Å; I387-V430 HydrophobicContact CG2-CB 4.48Å; I387-V430 HydrophobicContact CG2-CG1 3.77Å; I387-V430 HydrophobicContact CG2-CG2 3.87Å
388	E	93.7	Very high	95	Very high	141 Å²	141	45.2 Å²	45.2	66%	0.659	25%	0.245	S	C	*	.	H	α-helix	trans	-61.9	-37.5	-174.1	-69.7	165.4	-116.4	0	0	113.2	S384 A385 G390	S384-E388 WeakPolarHBondContact CB-OE1 3.26Å; S384-E388 WeakPolarHBondContact O-CG 3.46Å; S384-E388 PolarHBondContact O-N 2.91Å; S384-E388 PolarHBondContact OG-OE1 3.18Å; A385-E388 PolarHBondContact O-N 3.25Å; E388-G390 VanDerWaalsContact C-N 3.28Å; E388-G390 PolarHBondContact O-N 3.27Å
389	N	94.5	Very high	95.1	Very high	54 Å²	54	36.5 Å²	36.5	29%	0.289	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	2.7	174.3	-68.2	-78.6	0	0	0	113.6	D336 I339 V340 I343 A385 I387	D336-N389 PolarHBondContact OD1-ND2 3.09Å; I339-N389 HydrophobicContact CG2-CB 3.66Å; V340-N389 HydrophobicContact CG2-CB 4.26Å; V340-N389 WeakPolarHBondContact CG2-OD1 3.37Å; I343-N389 HydrophobicContact CD1-CB 4.07Å; I343-N389 WeakPolarHBondContact CD1-O 3.23Å; A385-N389 WeakPolarHBondContact O-CB 3.47Å; A385-N389 PolarHBondContact O-N 3.39Å; A385-N389 PolarHBondContact O-ND2 3.2Å; I387-N389 PolarHBondContact O-N 2.87Å
390	G	94.9	Very high	95	Very high	29 Å²	29	34.4 Å²	34.4	30%	0.299	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.3	26.2	173.2	0	0	0	0	0	116.2	I387 E388 L392 S393	I387-G390 WeakPolarHBondContact O-CA 3.44Å; I387-G390 PolarHBondContact O-N 3.17Å; E388-G390 VanDerWaalsContact C-N 3.28Å; E388-G390 PolarHBondContact O-N 3.27Å; G390-L392 PolarHBondContact O-N 3.09Å; G390-L392 VanDerWaalsContact O-N 3.13Å; G390-S393 VanDerWaalsContact O-CB 3.28Å; G390-S393 WeakPolarHBondContact O-CB 3.36Å; G390-S393 PolarHBondContact O-N 2.83Å
391	M	97	Very high	94.8	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.005	20%	0.195	C	C	.	.	H	α-helix	trans	-53.3	-35.3	178.2	-179	60.6	74.7	0	0	112.5	I339 T342 I343 M346 L377 L386 S393 A394 I395	I339-M391 HydrophobicContact CG2-CE 4.4Å; T342-M391 HydrophobicContact CG2-CE 4.12Å; I343-M391 HydrophobicContact CD1-CB 4.06Å; I343-M391 HydrophobicContact CD1-CE 4.16Å; I343-M391 HydrophobicContact CG1-CB 4.36Å; I343-M391 HydrophobicContact CG1-CE 3.52Å; I343-M391 HydrophobicContact CG1-SD 3.79Å; M346-M391 HydrophobicContact CE-SD 4.23Å; M346-M391 HydrophobicContact SD-CE 4.25Å; M346-M391 HydrophobicContact SD-SD 3.46Å; L377-M391 HydrophobicContact CD2-CG 3.72Å; L377-M391 HydrophobicContact CD2-SD 4.36Å; L386-M391 HydrophobicContact CB-CB 4.09Å; L386-M391 HydrophobicContact CD2-CB 4.1Å; L386-M391 HydrophobicContact CD2-CE 3.5Å; L386-M391 VanDerWaalsContact CD2-CE 3.5Å; L386-M391 HydrophobicContact CD2-CG 3.98Å; L386-M391 WeakPolarHBondContact O-CB 3.26Å; L386-M391 PolarHBondContact O-N 3.35Å; M391-S393 PolarHBondContact O-N 2.93Å; M391-A394 WeakPolarHBondContact O-CB 3.25Å; M391-A394 PolarHBondContact O-N 3.27Å; M391-A394 HydrophobicContact SD-CB 4.49Å; M391-I395 HydrophobicContact CG-CD1 4.3Å; M391-I395 PolarHBondContact O-N 2.98Å
392	L	96.6	Very high	94.5	Very high	1 Å²	1	29 Å²	29	1%	0.005	17%	0.171	C	C	.	.	H	α-helix	trans	-58.1	-34.9	177.5	-63	177.6	0	0	0	112.2	I387 G390 A394 I395 T396 L420 L426 V430	I387-L392 HydrophobicContact CG1-CD1 4.46Å; G390-L392 PolarHBondContact O-N 3.09Å; G390-L392 VanDerWaalsContact O-N 3.13Å; L392-A394 VanDerWaalsContact C-N 3.34Å; L392-A394 PolarHBondContact O-N 2.93Å; L392-I395 HydrophobicContact CD2-CD1 4.39Å; L392-I395 PolarHBondContact O-N 3.21Å; L392-T396 PolarHBondContact O-N 3.38Å; L392-T396 PolarHBondContact O-OG1 3.18Å; L392-L420 HydrophobicContact CD2-CD2 3.73Å; L392-L426 HydrophobicContact CD1-CD1 3.77Å; L392-L426 HydrophobicContact CD1-CD2 3.87Å; L392-L426 HydrophobicContact CD1-CG 4.49Å; L392-V430 HydrophobicContact CD1-CG1 3.57Å
393	S	96.5	Very high	93.8	Very high	38 Å²	38	33 Å²	33	27%	0.266	20%	0.198	S	C	.	.	H	α-helix	trans	-61.6	-39.8	174	176.9	0	0	0	0	112.1	K347 G390 M391 T396 E397	K347-S393 PolarHBondContact NZ-OG 2.92Å; G390-S393 VanDerWaalsContact O-CB 3.28Å; G390-S393 WeakPolarHBondContact O-CB 3.36Å; G390-S393 PolarHBondContact O-N 2.83Å; M391-S393 PolarHBondContact O-N 2.93Å; S393-T396 WeakPolarHBondContact O-CB 3.32Å; S393-T396 PolarHBondContact O-N 2.82Å; S393-E397 PolarHBondContact O-N 2.61Å
394	A	97.1	Very high	93.1	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-70.6	-32.6	176	0	0	0	0	0	112.3	I343 M346 K347 M391 L392 E397 W398	I343-A394 HydrophobicContact CG2-CB 4.32Å; M346-A394 HydrophobicContact CB-CB 4.03Å; M346-A394 HydrophobicContact CE-CB 3.96Å; M346-A394 HydrophobicContact SD-CB 4.25Å; K347-A394 HydrophobicContact CG-CB 4.3Å; M391-A394 WeakPolarHBondContact O-CB 3.25Å; M391-A394 PolarHBondContact O-N 3.27Å; M391-A394 HydrophobicContact SD-CB 4.49Å; L392-A394 VanDerWaalsContact C-N 3.34Å; L392-A394 PolarHBondContact O-N 2.93Å; A394-E397 PolarHBondContact O-N 3.28Å; A394-W398 VanDerWaalsContact O-CD1 3.25Å; A394-W398 PolarHBondContact O-N 3Å
395	I	97.5	Very high	92.5	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-68.1	-43.8	172.3	-61.5	176.9	0	0	0	110.8	M346 L377 M391 L392 E397 W398 L399 M416 L420 I436	M346-I395 HydrophobicContact CE-CG1 4.31Å; L377-I395 HydrophobicContact CD1-CD1 4.06Å; L377-I395 HydrophobicContact CD2-CD1 4.01Å; M391-I395 HydrophobicContact CG-CD1 4.3Å; M391-I395 PolarHBondContact O-N 2.98Å; L392-I395 HydrophobicContact CD2-CD1 4.39Å; L392-I395 PolarHBondContact O-N 3.21Å; I395-E397 PolarHBondContact O-N 3.33Å; I395-W398 PolarHBondContact O-N 3.47Å; I395-W398 VanDerWaalsContact O-N 3.14Å; I395-L399 HydrophobicContact CG2-CD1 4.09Å; I395-L399 HydrophobicContact CG2-CG 4.35Å; I395-L399 WeakPolarHBondContact O-CB 3.5Å; I395-L399 WeakPolarHBondContact O-CG 3.34Å; I395-L399 PolarHBondContact O-N 3.25Å; I395-M416 HydrophobicContact CB-SD 4.41Å; I395-M416 HydrophobicContact CD1-SD 4.37Å; I395-M416 HydrophobicContact CG1-SD 3.97Å; I395-M416 HydrophobicContact CG2-CB 4.14Å; I395-M416 HydrophobicContact CG2-CG 4.22Å; I395-M416 HydrophobicContact CG2-SD 3.83Å; I395-L420 HydrophobicContact CD1-CD2 4.08Å; I395-L420 HydrophobicContact CG2-CD1 4.1Å; I395-L420 HydrophobicContact CG2-CD2 4.24Å; I395-L420 HydrophobicContact CG2-CG 4.36Å; I395-I436 HydrophobicContact CB-CD1 4.34Å; I395-I436 HydrophobicContact CG2-CD1 3.88Å
396	T	96.6	Very high	92.3	Very high	23 Å²	23	39.3 Å²	39.3	14%	0.141	24%	0.239	C	C	.	.	H	α-helix	trans	-54.4	-44.2	172.6	-53	0	0	0	0	110.8	L392 S393 L399 S400 S434 G435 I436 A439	L392-T396 PolarHBondContact O-N 3.38Å; L392-T396 PolarHBondContact O-OG1 3.18Å; S393-T396 WeakPolarHBondContact O-CB 3.32Å; S393-T396 PolarHBondContact O-N 2.82Å; T396-L399 CarbonylContact O-C 3.54Å; T396-L399 PolarHBondContact O-N 3Å; T396-S400 PolarHBondContact O-N 3.48Å; T396-S434 WeakPolarHBondContact CB-O 3.34Å; T396-S434 PolarHBondContact OG1-O 3.12Å; T396-G435 WeakPolarHBondContact CG2-O 3.22Å; T396-I436 WeakPolarHBondContact OG1-CA 3.49Å; T396-I436 WeakPolarHBondContact OG1-CB 3.37Å; T396-I436 WeakPolarHBondContact OG1-CD1 3.44Å; T396-I436 PolarHBondContact OG1-N 3.08Å; T396-A439 HydrophobicContact CG2-CB 4.06Å
397	E	95.6	Very high	92.2	Very high	37 Å²	37	41.1 Å²	41.1	17%	0.173	25%	0.248	C	C	.	.	H	α-helix	trans	-67.6	-36.9	178.8	-154.8	-171.7	140.7	0	0	112.7	K347 A350 R354 S393 A394 I395 L399 S400	K347-E397 VanDerWaalsContact CD-OE2 3.26Å; K347-E397 WeakPolarHBondContact CD-OE2 3.5Å; K347-E397 WeakPolarHBondContact CE-OE2 3.31Å; K347-E397 VanDerWaalsContact CG-OE2 3.24Å; K347-E397 WeakPolarHBondContact CG-OE2 3.19Å; A350-E397 HydrophobicContact CB-CG 4.29Å; A350-E397 WeakPolarHBondContact CB-OE1 3.27Å; R354-E397 IonicContact CZ-OE1 3.29Å; R354-E397 VanDerWaalsContact CZ-OE1 3.29Å; R354-E397 IonicContact NH1-OE1 3.06Å; R354-E397 PolarHBondContact NH1-OE1 3.05Å; R354-E397 IonicContact NH2-OE1 2.71Å; R354-E397 PolarHBondContact NH2-OE1 3.48Å; S393-E397 PolarHBondContact O-N 2.61Å; A394-E397 PolarHBondContact O-N 3.28Å; I395-E397 PolarHBondContact O-N 3.33Å; E397-L399 VanDerWaalsContact C-N 3.32Å; E397-S400 PolarHBondContact O-N 3.27Å; E397-S400 PolarHBondContact O-OG 2.87Å
398	W	97.2	Very high	92.1	Very high	1 Å²	1	39.2 Å²	39.2	0%	0.004	24%	0.238	C	C	.	.	H	α-helix	trans	-67.9	-28.7	172.9	-84.1	36.2	0	0	0	113.8	M346 A349 K366 M369 L370 V373 A394 I395 P408 I412 M416	M346-W398 HydrophobicContact CB-CZ2 4.16Å; M346-W398 HydrophobicContact CE-CD2 3.77Å; M346-W398 HydrophobicContact CE-CE3 4.2Å; M346-W398 HydrophobicContact CE-CG 4.09Å; M346-W398 HydrophobicContact CE-CZ2 4.17Å; M346-W398 HydrophobicContact CG-CZ2 3.79Å; M346-W398 PolarHBondContact O-NE1 2.85Å; A349-W398 HydrophobicContact CB-CZ2 4.4Å; K366-W398 HydrophobicContact CB-CD2 4.27Å; K366-W398 HydrophobicContact CB-CE3 4.32Å; K366-W398 HydrophobicContact CB-CH2 4.08Å; K366-W398 HydrophobicContact CB-CZ2 4.03Å; K366-W398 HydrophobicContact CB-CZ3 4.23Å; K366-W398 HydrophobicContact CD-CB 4.14Å; K366-W398 HydrophobicContact CD-CD2 3.66Å; K366-W398 HydrophobicContact CD-CE3 4.35Å; K366-W398 HydrophobicContact CD-CG 3.55Å; K366-W398 HydrophobicContact CG-CD2 3.92Å; K366-W398 HydrophobicContact CG-CE3 4.47Å; K366-W398 HydrophobicContact CG-CG 4.29Å; K366-W398 HydrophobicContact CG-CH2 4.4Å; K366-W398 HydrophobicContact CG-CZ2 3.84Å; K366-W398 WeakPolarHBondContact O-CH2 3.48Å; M369-W398 HydrophobicContact CB-CH2 4.15Å; M369-W398 HydrophobicContact CB-CZ2 4.4Å; M369-W398 HydrophobicContact CG-CH2 4.47Å; M369-W398 HydrophobicContact SD-CZ2 4.13Å; L370-W398 HydrophobicContact CB-CZ3 4.27Å; L370-W398 HydrophobicContact CD1-CZ3 3.9Å; V373-W398 HydrophobicContact CB-CH2 4.48Å; V373-W398 HydrophobicContact CG2-CH2 3.84Å; V373-W398 HydrophobicContact CG2-CZ2 4.31Å; V373-W398 HydrophobicContact CG2-CZ3 4.43Å; A394-W398 VanDerWaalsContact O-CD1 3.25Å; A394-W398 PolarHBondContact O-N 3Å; I395-W398 PolarHBondContact O-N 3.47Å; I395-W398 VanDerWaalsContact O-N 3.14Å; W398-P408 WeakPolarHBondContact O-CG 3.24Å; W398-I412 HydrophobicContact CE3-CG2 3.95Å; W398-M416 HydrophobicContact CE3-CE 3.92Å; W398-M416 HydrophobicContact CE3-SD 4.34Å; W398-M416 HydrophobicContact CZ3-CE 4.05Å
399	L	96.8	Very high	92.2	Very high	0 Å²	0	36 Å²	36	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-91.7	-11.7	176.9	-68.1	-175.2	0	0	0	113.9	I395 T396 E397 R413 M416 L420 I436 A439 L440 L443	I395-L399 HydrophobicContact CG2-CD1 4.09Å; I395-L399 HydrophobicContact CG2-CG 4.35Å; I395-L399 WeakPolarHBondContact O-CB 3.5Å; I395-L399 WeakPolarHBondContact O-CG 3.34Å; I395-L399 PolarHBondContact O-N 3.25Å; T396-L399 CarbonylContact O-C 3.54Å; T396-L399 PolarHBondContact O-N 3Å; E397-L399 VanDerWaalsContact C-N 3.32Å; L399-R413 HydrophobicContact CD2-CG 4.24Å; L399-M416 HydrophobicContact CD1-CB 4.17Å; L399-M416 HydrophobicContact CD2-CB 3.86Å; L399-M416 HydrophobicContact CD2-CG 4.18Å; L399-M416 HydrophobicContact CG-CB 4.18Å; L399-M416 HydrophobicContact CG-CG 4.49Å; L399-L420 HydrophobicContact CD1-CD1 4.26Å; L399-I436 HydrophobicContact CD1-CD1 4.25Å; L399-A439 HydrophobicContact CB-CB 3.96Å; L399-L440 HydrophobicContact CD1-CD2 4.42Å; L399-L443 HydrophobicContact CB-CD1 4.43Å; L399-L443 HydrophobicContact CD1-CD1 4.12Å; L399-L443 HydrophobicContact CD2-CD1 4.05Å; L399-L443 HydrophobicContact CG-CD1 4.43Å
400	S	92.6	Very high	92.3	Very high	32 Å²	32	36.9 Å²	36.9	22%	0.224	23%	0.23	C	C	.	.	S	Bend	trans	-58.5	144.1	-178.9	68.1	0	0	0	0	112.4	T396 E397 L402 P408	T396-S400 PolarHBondContact O-N 3.48Å; E397-S400 PolarHBondContact O-N 3.27Å; E397-S400 PolarHBondContact O-OG 2.87Å; S400-L402 PolarHBondContact O-N 3.49Å; S400-P408 WeakPolarHBondContact O-CG 3.44Å
401	P	88.1	Confident	92.4	Very high	58 Å²	58	39 Å²	39	38%	0.377	24%	0.238	S	C	.	.	P	Polyproline II helix	trans	-62.8	136.1	174	25.7	-32.8	0	0	0	110.4	Y442	P401-Y442 HydrophobicContact CB-CD1 4.48Å; P401-Y442 HydrophobicContact CB-CE1 3.8Å; P401-Y442 HydrophobicContact CB-CE2 4.24Å; P401-Y442 HydrophobicContact CG-CE1 4.32Å; P401-Y442 HydrophobicContact CG-CE2 4.24Å
402	L	85.7	Confident	92.4	Very high	17 Å²	17	39.2 Å²	39.2	9%	0.089	24%	0.238	C	C	.	.	B	Isolated β-bridge	trans	-84.2	156.9	177.1	-60.6	92.9	0	0	0	109.5	L357 S400 G404 H405 T406 P408	L357-L402 HydrophobicContact CD1-CD2 3.29Å; S400-L402 PolarHBondContact O-N 3.49Å; L402-G404 PolarHBondContact O-N 3.23Å; L402-H405 PolarHBondContact O-N 3.43Å; L402-T406 VanDerWaalsContact CD1-O 3.31Å; L402-T406 WeakPolarHBondContact CD1-O 3.13Å; L402-T406 PolarHBondContact N-O 3.17Å; L402-T406 PolarHBondContact O-N 2.89Å; L402-T406 VanDerWaalsContact O-N 3.14Å; L402-P408 HydrophobicContact CD1-CB 4.19Å; L402-P408 HydrophobicContact CD1-CG 3.73Å
403	P	79	Confident	92.4	Very high	92 Å²	92	40 Å²	40	60%	0.597	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-46.8	133.6	-179.3	-30.6	36.5	0	0	0	112.8
404	G	79.4	Confident	92.4	Very high	63 Å²	63	40.4 Å²	40.4	65%	0.649	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.3	25.4	-167.8	0	0	0	0	0	114.5	L402 T406	L402-G404 PolarHBondContact O-N 3.23Å; G404-T406 PolarHBondContact O-N 3.06Å
405	H	80.3	Confident	92.5	Very high	124 Å²	124	41.6 Å²	41.6	57%	0.574	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.1	23	177.1	-51.9	-90	0	0	0	114.5	L402 Y442	L402-H405 PolarHBondContact O-N 3.43Å; H405-Y442 PolarHBondContact O-OH 2.9Å
406	T	89	Confident	92.5	Very high	68 Å²	68	41.6 Å²	41.6	42%	0.417	25%	0.249	S	C	.	.	B	Isolated β-bridge	trans	-78.6	138.9	-177.8	54.1	0	0	0	0	111	L402 G404	L402-T406 VanDerWaalsContact CD1-O 3.31Å; L402-T406 WeakPolarHBondContact CD1-O 3.13Å; L402-T406 PolarHBondContact N-O 3.17Å; L402-T406 PolarHBondContact O-N 2.89Å; L402-T406 VanDerWaalsContact O-N 3.14Å; G404-T406 PolarHBondContact O-N 3.06Å
407	L	93	Very high	92.5	Very high	37 Å²	37	40.5 Å²	40.5	19%	0.194	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-74.8	145.9	-179.6	-71.5	155.4	0	0	0	111.2	Y442 L443 H446 R448	L407-Y442 HydrophobicContact CD2-CE1 3.99Å; L407-L443 HydrophobicContact CD2-CD2 3.61Å; L407-H446 WeakPolarHBondContact CD1-CE1 3.19Å; L407-H446 WeakPolarHBondContact CD1-ND1 3.49Å; L407-H446 HydrophobicContact CD2-CB 4.43Å; L407-R448 HydrophobicContact CD1-CB 3.97Å; L407-R448 WeakPolarHBondContact CD1-O 3.47Å
408	P	93.9	Very high	92.5	Very high	7 Å²	7	42.1 Å²	42.1	5%	0.045	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-55.2	157.2	165.2	-23.3	32.3	0	0	0	112.3	W398 S400 L402 L410 R413	W398-P408 WeakPolarHBondContact O-CG 3.24Å; S400-P408 WeakPolarHBondContact O-CG 3.44Å; L402-P408 HydrophobicContact CD1-CB 4.19Å; L402-P408 HydrophobicContact CD1-CG 3.73Å; P408-L410 PolarHBondContact O-N 3.33Å; P408-R413 HydrophobicContact CB-CG 4.08Å; P408-R413 WeakPolarHBondContact O-CD 3.39Å; P408-R413 PolarHBondContact O-NE 3.2Å; P408-R413 VanDerWaalsContact O-NE 3.09Å
409	N	95	Very high	92.4	Very high	75 Å²	75	42.5 Å²	42.5	40%	0.401	26%	0.258	S	S	.	.	P	Polyproline II helix	trans	-53	136.7	179.5	-176.3	-74.7	0	0	0	111.3	L367 V411 I412 R413	L367-N409 HydrophobicContact CD1-CB 4.43Å; L367-N409 HydrophobicContact CD2-CB 4.25Å; N409-V411 VanDerWaalsContact C-N 3.27Å; N409-V411 PolarHBondContact O-N 3.48Å; N409-V411 WeakPolarHBondContact OD1-CB 3.47Å; N409-V411 PolarHBondContact OD1-N 3.21Å; N409-I412 HydrophobicContact CB-CD1 4.08Å; N409-I412 HydrophobicContact CB-CG1 4.26Å; N409-I412 WeakPolarHBondContact O-CA 3.45Å; N409-I412 WeakPolarHBondContact O-CB 3.36Å; N409-I412 PolarHBondContact O-N 2.7Å; N409-R413 PolarHBondContact O-N 3.12Å
410	L	96	Very high	92.3	Very high	71 Å²	71	42.5 Å²	42.5	37%	0.372	26%	0.258	S	S	.	.	H	α-helix	trans	-46.6	-48.5	-178.5	-178.3	65.2	0	0	0	112.6	P408 I412 R413 D414 T450	P408-L410 PolarHBondContact O-N 3.33Å; L410-I412 PolarHBondContact O-N 3.5Å; L410-R413 VanDerWaalsContact CD1-NH2 3.31Å; L410-R413 PolarHBondContact O-N 3.17Å; L410-D414 WeakPolarHBondContact CD1-OD1 3.48Å; L410-D414 PolarHBondContact O-N 3.37Å; L410-D414 VanDerWaalsContact O-OD1 3.06Å; L410-T450 HydrophobicContact CD1-CG2 3.55Å
411	V	96.9	Very high	92.3	Very high	75 Å²	75	44.3 Å²	44.3	46%	0.455	27%	0.27	S	S	.	.	H	α-helix	trans	-61.1	-32.1	-178.2	-174.2	0	0	0	0	112.2	L367 L370 N409 S415	L367-V411 HydrophobicContact CD2-CB 4.45Å; L370-V411 HydrophobicContact CD2-CG1 3.97Å; N409-V411 VanDerWaalsContact C-N 3.27Å; N409-V411 PolarHBondContact O-N 3.48Å; N409-V411 WeakPolarHBondContact OD1-CB 3.47Å; N409-V411 PolarHBondContact OD1-N 3.21Å; V411-S415 WeakPolarHBondContact O-CB 3.38Å; V411-S415 PolarHBondContact O-N 2.96Å; V411-S415 PolarHBondContact O-OG 2.86Å
412	I	97.4	Very high	92.5	Very high	4 Å²	4	45.6 Å²	45.6	2%	0.021	27%	0.271	C	S	.	.	H	α-helix	trans	-69.6	-48.6	173.9	-59.5	172.6	0	0	0	109.7	K366 L367 L370 W398 N409 L410 S415 M416	K366-I412 HydrophobicContact CB-CD1 3.65Å; K366-I412 HydrophobicContact CD-CD1 4.48Å; L367-I412 HydrophobicContact CD2-CD1 4.09Å; L367-I412 HydrophobicContact CD2-CG1 3.78Å; L367-I412 HydrophobicContact CG-CD1 4.17Å; L367-I412 HydrophobicContact CG-CG1 4.4Å; L370-I412 HydrophobicContact CD2-CG1 4.4Å; W398-I412 HydrophobicContact CE3-CG2 3.95Å; N409-I412 HydrophobicContact CB-CD1 4.08Å; N409-I412 HydrophobicContact CB-CG1 4.26Å; N409-I412 WeakPolarHBondContact O-CA 3.45Å; N409-I412 WeakPolarHBondContact O-CB 3.36Å; N409-I412 PolarHBondContact O-N 2.7Å; L410-I412 PolarHBondContact O-N 3.5Å; I412-S415 PolarHBondContact O-N 3.39Å; I412-M416 HydrophobicContact CG2-CG 4.05Å; I412-M416 WeakPolarHBondContact O-CB 3.26Å; I412-M416 VanDerWaalsContact O-CG 3.23Å; I412-M416 WeakPolarHBondContact O-CG 3.5Å; I412-M416 PolarHBondContact O-N 2.79Å
413	R	97	Very high	92.7	Very high	17 Å²	17	45 Å²	45	6%	0.064	27%	0.268	C	S	.	.	H	α-helix	trans	-60.5	-51.6	-178.6	-61.8	-178.7	-63.4	164.7	0.9	111.3	L399 P408 N409 L410 S415 M416 L417 E449	L399-R413 HydrophobicContact CD2-CG 4.24Å; P408-R413 HydrophobicContact CB-CG 4.08Å; P408-R413 WeakPolarHBondContact O-CD 3.39Å; P408-R413 PolarHBondContact O-NE 3.2Å; P408-R413 VanDerWaalsContact O-NE 3.09Å; N409-R413 PolarHBondContact O-N 3.12Å; L410-R413 VanDerWaalsContact CD1-NH2 3.31Å; L410-R413 PolarHBondContact O-N 3.17Å; R413-S415 VanDerWaalsContact C-N 3.31Å; R413-S415 PolarHBondContact O-N 3.35Å; R413-M416 PolarHBondContact O-N 3.34Å; R413-L417 VanDerWaalsContact O-CB 3.32Å; R413-L417 WeakPolarHBondContact O-CB 3.26Å; R413-L417 VanDerWaalsContact O-CG 3.25Å; R413-L417 WeakPolarHBondContact O-CG 3.19Å; R413-L417 PolarHBondContact O-N 3.29Å; R413-E449 WeakPolarHBondContact CD-OE2 3.22Å; R413-E449 IonicContact CZ-OE1 3.15Å; R413-E449 VanDerWaalsContact CZ-OE1 3.24Å; R413-E449 IonicContact CZ-OE2 3.92Å; R413-E449 IonicContact NE-OE1 3.5Å; R413-E449 IonicContact NE-OE2 2.72Å; R413-E449 IonicContact NH1-OE1 3.76Å; R413-E449 PolarHBondContact NH1-OE1 3.17Å; R413-E449 IonicContact NH1-OE2 2.83Å; R413-E449 PolarHBondContact NH1-OE2 3.42Å; R413-E449 IonicContact NH2-OE1 2.67Å
414	D	97.3	Very high	92.6	Very high	47 Å²	47	47.7 Å²	47.7	25%	0.251	27%	0.272	S	S	.	.	H	α-helix	trans	-54	-48.4	177.3	-57.8	-3.8	0	0	0	111	L410 T418 N453	L410-D414 WeakPolarHBondContact CD1-OD1 3.48Å; L410-D414 PolarHBondContact O-N 3.37Å; L410-D414 VanDerWaalsContact O-OD1 3.06Å; D414-T418 VanDerWaalsContact O-CB 3.27Å; D414-T418 WeakPolarHBondContact O-CB 3.3Å; D414-T418 PolarHBondContact O-N 3.08Å; D414-T418 PolarHBondContact O-OG1 3.24Å; D414-N453 PolarHBondContact OD1-ND2 3.29Å; D414-N453 PolarHBondContact OD1-OD1 2.91Å
415	S	97.4	Very high	92.3	Very high	25 Å²	25	49.8 Å²	49.8	18%	0.175	28%	0.277	C	S	.	.	H	α-helix	trans	-70.3	-39.6	-175.7	-58.9	0	0	0	0	112.7	V411 I412 R413 S419	V411-S415 WeakPolarHBondContact O-CB 3.38Å; V411-S415 PolarHBondContact O-N 2.96Å; V411-S415 PolarHBondContact O-OG 2.86Å; I412-S415 PolarHBondContact O-N 3.39Å; R413-S415 VanDerWaalsContact C-N 3.31Å; R413-S415 PolarHBondContact O-N 3.35Å; S415-S419 WeakPolarHBondContact O-CB 3.31Å; S415-S419 PolarHBondContact O-N 2.94Å; S415-S419 PolarHBondContact O-OG 3.11Å
416	M	97.4	Very high	92.7	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-70.1	-47.8	176.7	-68.9	-62.5	121.6	0	0	110.9	L370 V373 L374 L377 I395 W398 L399 I412 R413 T418 S419 L420	L370-M416 HydrophobicContact CD1-CE 3.49Å; L370-M416 VanDerWaalsContact CD1-CE 3.49Å; V373-M416 HydrophobicContact CG1-CE 4.05Å; L374-M416 HydrophobicContact CD2-CE 4.18Å; L377-M416 HydrophobicContact CD1-CE 4.14Å; L377-M416 HydrophobicContact CD1-SD 4.27Å; I395-M416 HydrophobicContact CB-SD 4.41Å; I395-M416 HydrophobicContact CD1-SD 4.37Å; I395-M416 HydrophobicContact CG1-SD 3.97Å; I395-M416 HydrophobicContact CG2-CB 4.14Å; I395-M416 HydrophobicContact CG2-CG 4.22Å; I395-M416 HydrophobicContact CG2-SD 3.83Å; W398-M416 HydrophobicContact CE3-CE 3.92Å; W398-M416 HydrophobicContact CE3-SD 4.34Å; W398-M416 HydrophobicContact CZ3-CE 4.05Å; L399-M416 HydrophobicContact CD1-CB 4.17Å; L399-M416 HydrophobicContact CD2-CB 3.86Å; L399-M416 HydrophobicContact CD2-CG 4.18Å; L399-M416 HydrophobicContact CG-CB 4.18Å; L399-M416 HydrophobicContact CG-CG 4.49Å; I412-M416 HydrophobicContact CG2-CG 4.05Å; I412-M416 WeakPolarHBondContact O-CB 3.26Å; I412-M416 VanDerWaalsContact O-CG 3.23Å; I412-M416 WeakPolarHBondContact O-CG 3.5Å; I412-M416 PolarHBondContact O-N 2.79Å; R413-M416 PolarHBondContact O-N 3.34Å; M416-T418 VanDerWaalsContact C-N 3.3Å; M416-T418 PolarHBondContact O-N 2.79Å; M416-S419 PolarHBondContact O-N 3.45Å; M416-S419 VanDerWaalsContact O-N 3.11Å; M416-L420 WeakPolarHBondContact O-CB 3.44Å; M416-L420 VanDerWaalsContact O-CG 3.26Å; M416-L420 WeakPolarHBondContact O-CG 3.35Å; M416-L420 PolarHBondContact O-N 2.82Å
417	L	96.8	Very high	92.7	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.005	25%	0.253	C	S	.	.	H	α-helix	trans	-58	-42	175.8	-71.3	170.5	0	0	0	111.9	R413 L420 S421 L440 L443 N453 R456 A457 L460	R413-L417 VanDerWaalsContact O-CB 3.32Å; R413-L417 WeakPolarHBondContact O-CB 3.26Å; R413-L417 VanDerWaalsContact O-CG 3.25Å; R413-L417 WeakPolarHBondContact O-CG 3.19Å; R413-L417 PolarHBondContact O-N 3.29Å; L417-L420 PolarHBondContact O-N 3.49Å; L417-S421 PolarHBondContact O-N 2.7Å; L417-L440 HydrophobicContact CD2-CD2 3.38Å; L417-L443 HydrophobicContact CD1-CD1 4.5Å; L417-L443 HydrophobicContact CD2-CD1 4.37Å; L417-N453 HydrophobicContact CD1-CB 3.6Å; L417-R456 HydrophobicContact CB-CB 4.33Å; L417-A457 HydrophobicContact CD2-CB 4.03Å; L417-L460 HydrophobicContact CD2-CD1 4.11Å
418	T	95.9	Very high	92.5	Very high	70 Å²	70	44.5 Å²	44.5	43%	0.429	26%	0.258	S	S	.	.	H	α-helix	trans	-63.6	-47	174	-56.4	0	0	0	0	111.1	D414 M416 L420 S421	D414-T418 VanDerWaalsContact O-CB 3.27Å; D414-T418 WeakPolarHBondContact O-CB 3.3Å; D414-T418 PolarHBondContact O-N 3.08Å; D414-T418 PolarHBondContact O-OG1 3.24Å; M416-T418 VanDerWaalsContact C-N 3.3Å; M416-T418 PolarHBondContact O-N 2.79Å; T418-L420 VanDerWaalsContact C-N 3.32Å; T418-L420 PolarHBondContact O-N 2.98Å; T418-S421 PolarHBondContact O-N 3.06Å; T418-S421 VanDerWaalsContact O-N 3.17Å; T418-S421 PolarHBondContact O-OG 3.27Å
419	S	95.7	Very high	92.4	Very high	10 Å²	10	50.4 Å²	50.4	7%	0.07	29%	0.285	C	S	.	.	H	α-helix	trans	-62.6	-36.7	179.1	-58.4	0	0	0	0	112.9	L374 S415 M416 S421 E422 F423	L374-S419 WeakPolarHBondContact CD2-OG 3.18Å; S415-S419 WeakPolarHBondContact O-CB 3.31Å; S415-S419 PolarHBondContact O-N 2.94Å; S415-S419 PolarHBondContact O-OG 3.11Å; M416-S419 PolarHBondContact O-N 3.45Å; M416-S419 VanDerWaalsContact O-N 3.11Å; S419-S421 VanDerWaalsContact C-N 3.28Å; S419-S421 PolarHBondContact O-N 3.38Å; S419-E422 WeakPolarHBondContact O-CB 3.39Å; S419-E422 PolarHBondContact O-N 2.66Å; S419-F423 WeakPolarHBondContact O-CD2 3.38Å; S419-F423 WeakPolarHBondContact O-CE2 3.39Å
420	L	95.4	Very high	92.3	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-66	-28.5	177.5	-71	171.7	0	0	0	112.5	L392 I395 L399 M416 L417 T418 E422 F423 I436 L440 L460 W464	L392-L420 HydrophobicContact CD2-CD2 3.73Å; I395-L420 HydrophobicContact CD1-CD2 4.08Å; I395-L420 HydrophobicContact CG2-CD1 4.1Å; I395-L420 HydrophobicContact CG2-CD2 4.24Å; I395-L420 HydrophobicContact CG2-CG 4.36Å; L399-L420 HydrophobicContact CD1-CD1 4.26Å; M416-L420 WeakPolarHBondContact O-CB 3.44Å; M416-L420 VanDerWaalsContact O-CG 3.26Å; M416-L420 WeakPolarHBondContact O-CG 3.35Å; M416-L420 PolarHBondContact O-N 2.82Å; L417-L420 PolarHBondContact O-N 3.49Å; T418-L420 VanDerWaalsContact C-N 3.32Å; T418-L420 PolarHBondContact O-N 2.98Å; L420-E422 PolarHBondContact O-N 2.9Å; L420-F423 PolarHBondContact O-N 2.78Å; L420-I436 HydrophobicContact CD1-CD1 3.96Å; L420-I436 HydrophobicContact CD1-CG1 4.11Å; L420-I436 HydrophobicContact CD2-CG1 4.36Å; L420-L440 HydrophobicContact CD1-CD2 4.05Å; L420-L460 HydrophobicContact CB-CD1 3.86Å; L420-L460 HydrophobicContact CB-CD2 4.32Å; L420-W464 HydrophobicContact CB-CH2 4.16Å; L420-W464 HydrophobicContact CB-CZ2 4.3Å; L420-W464 HydrophobicContact CD1-CH2 4.33Å; L420-W464 HydrophobicContact CD2-CH2 4.1Å; L420-W464 HydrophobicContact CG-CH2 4.41Å
421	S	92.8	Very high	92.1	Very high	69 Å²	69	45 Å²	45	48%	0.483	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-10.4	174.6	74.2	0	0	0	0	114.6	L417 T418 S419	L417-S421 PolarHBondContact O-N 2.7Å; T418-S421 PolarHBondContact O-N 3.06Å; T418-S421 VanDerWaalsContact O-N 3.17Å; T418-S421 PolarHBondContact O-OG 3.27Å; S419-S421 VanDerWaalsContact C-N 3.28Å; S419-S421 PolarHBondContact O-N 3.38Å
422	E	91.2	Very high	91.9	Very high	86 Å²	86	45.9 Å²	45.9	40%	0.402	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-5.6	169.7	-57.3	-179	172.8	0	0	113.4	K383 S419 L420 Q424	K383-E422 VanDerWaalsContact NZ-CB 3.26Å; K383-E422 IonicContact NZ-OE2 2.93Å; K383-E422 PolarHBondContact NZ-OE2 2.95Å; S419-E422 WeakPolarHBondContact O-CB 3.39Å; S419-E422 PolarHBondContact O-N 2.66Å; L420-E422 PolarHBondContact O-N 2.9Å; E422-Q424 PolarHBondContact O-N 2.71Å
423	F	89.4	Confident	91.7	Very high	5 Å²	5	53 Å²	53	2%	0.022	29%	0.29	C	S	.	.			trans	-98.8	79.4	179.7	-69	-100.2	0	0	0	110.6	L377 K383 L386 I387 S419 L420 L426 W464	L377-F423 HydrophobicContact CD2-CE2 4.49Å; L377-F423 HydrophobicContact CD2-CZ 4.1Å; K383-F423 HydrophobicContact CD-CD1 4.11Å; K383-F423 HydrophobicContact CD-CE1 3.71Å; K383-F423 HydrophobicContact CD-CE2 4.19Å; K383-F423 HydrophobicContact CD-CZ 3.77Å; L386-F423 HydrophobicContact CB-CE1 4.43Å; I387-F423 HydrophobicContact CD1-CD1 4.13Å; I387-F423 HydrophobicContact CG1-CD1 4.05Å; I387-F423 HydrophobicContact CG1-CE1 4.24Å; S419-F423 WeakPolarHBondContact O-CD2 3.38Å; S419-F423 WeakPolarHBondContact O-CE2 3.39Å; L420-F423 PolarHBondContact O-N 2.78Å; F423-L426 HydrophobicContact CB-CD2 4.25Å; F423-W464 PolarHBondContact O-NE1 3.14Å
424	Q	76.7	Confident	91.6	Very high	147 Å²	147	52.9 Å²	52.9	69%	0.687	29%	0.292	S	S	*	.			trans	-70.7	141.2	176.5	-65.8	-179.3	-24.6	0	0	111.3	E422	E422-Q424 PolarHBondContact O-N 2.71Å
425	S	74.1	Confident	91.4	Very high	107 Å²	107	51.2 Å²	51.2	75%	0.748	29%	0.286	S	S	*	.			trans	52.4	62.7	173.7	56.3	0	0	0	0	115.8
426	L	88.7	Confident	91.3	Very high	18 Å²	18	50 Å²	50	9%	0.094	28%	0.277	C	S	.	.			trans	-66.6	147.3	163	-60.4	-175.9	0	0	0	110.9	I387 L392 F423 V430 W464	I387-L426 HydrophobicContact CD1-CD2 3.83Å; I387-L426 HydrophobicContact CG1-CD2 4.2Å; L392-L426 HydrophobicContact CD1-CD1 3.77Å; L392-L426 HydrophobicContact CD1-CD2 3.87Å; L392-L426 HydrophobicContact CD1-CG 4.49Å; F423-L426 HydrophobicContact CB-CD2 4.25Å; L426-V430 HydrophobicContact CD2-CG1 4.39Å; L426-W464 HydrophobicContact CD1-CD2 3.91Å; L426-W464 HydrophobicContact CD1-CE3 4.15Å; L426-W464 HydrophobicContact CD1-CH2 3.91Å; L426-W464 HydrophobicContact CD1-CZ2 3.65Å; L426-W464 HydrophobicContact CD1-CZ3 4.14Å; L426-W464 HydrophobicContact CG-CZ2 4.43Å
427	S	88.8	Confident	91.1	Very high	58 Å²	58	50 Å²	50	41%	0.406	28%	0.278	S	S	.	.			trans	-79.7	156.3	171.4	71.9	0	0	0	0	111.3	E429 V430 L431	S427-E429 PolarHBondContact O-N 2.8Å; S427-V430 PolarHBondContact O-N 2.88Å; S427-V430 WeakPolarHBondContact OG-CB 3.48Å; S427-V430 WeakPolarHBondContact OG-CG2 3.44Å; S427-V430 PolarHBondContact OG-N 3.21Å; S427-L431 WeakPolarHBondContact O-CB 3.43Å; S427-L431 PolarHBondContact O-N 3.35Å
428	S	88.8	Confident	91	Very high	42 Å²	42	54.5 Å²	54.5	29%	0.294	30%	0.297	S	S	.	.	H	α-helix	trans	-59.5	-35.4	176.4	-170.3	0	0	0	0	112.5	L431 Q432	S428-L431 PolarHBondContact O-N 2.83Å; S428-Q432 VanDerWaalsContact O-CG 3.28Å; S428-Q432 WeakPolarHBondContact O-CG 3.16Å; S428-Q432 PolarHBondContact O-N 2.9Å
429	E	91.8	Very high	90.9	Very high	132 Å²	132	51.4 Å²	51.4	62%	0.617	28%	0.279	S	S	*	.	H	α-helix	trans	-63.1	-54	177.1	-172.6	169.6	-139.9	0	0	110.5	S427 L431 Q432 E433	S427-E429 PolarHBondContact O-N 2.8Å; E429-L431 VanDerWaalsContact C-N 3.29Å; E429-L431 PolarHBondContact O-N 3.11Å; E429-Q432 PolarHBondContact O-N 2.82Å; E429-Q432 VanDerWaalsContact O-N 3.13Å; E429-E433 WeakPolarHBondContact O-CG 3.34Å; E429-E433 PolarHBondContact O-N 2.96Å
430	V	93.2	Very high	90.9	Very high	29 Å²	29	51 Å²	51	18%	0.176	28%	0.275	C	S	.	.	H	α-helix	trans	-59.8	-37.3	176	166.6	0	0	0	0	112.2	I387 L392 L426 S427 S434	I387-V430 HydrophobicContact CG2-CB 4.48Å; I387-V430 HydrophobicContact CG2-CG1 3.77Å; I387-V430 HydrophobicContact CG2-CG2 3.87Å; L392-V430 HydrophobicContact CD1-CG1 3.57Å; L426-V430 HydrophobicContact CD2-CG1 4.39Å; S427-V430 PolarHBondContact O-N 2.88Å; S427-V430 WeakPolarHBondContact OG-CB 3.48Å; S427-V430 WeakPolarHBondContact OG-CG2 3.44Å; S427-V430 PolarHBondContact OG-N 3.21Å; V430-S434 VanDerWaalsContact O-CB 3.26Å; V430-S434 WeakPolarHBondContact O-CB 3.37Å; V430-S434 PolarHBondContact O-N 2.96Å; V430-S434 VanDerWaalsContact O-N 3.09Å; V430-S434 PolarHBondContact O-OG 2.55Å
431	L	92.4	Very high	90.8	Very high	4 Å²	4	52.4 Å²	52.4	2%	0.021	28%	0.282	C	S	.	.	H	α-helix	trans	-66	-38.3	177.6	-178.5	61	0	0	0	112.3	I245 F246 S427 S428 E429 I436 W464 I468	I245-L431 HydrophobicContact CG2-CD2 4.02Å; I245-L431 HydrophobicContact CG2-CG 4.13Å; F246-L431 HydrophobicContact CE1-CD1 4.34Å; F246-L431 HydrophobicContact CE1-CD2 4.09Å; F246-L431 HydrophobicContact CE1-CG 4.27Å; F246-L431 HydrophobicContact CZ-CD2 4.49Å; S427-L431 WeakPolarHBondContact O-CB 3.43Å; S427-L431 PolarHBondContact O-N 3.35Å; S428-L431 PolarHBondContact O-N 2.83Å; E429-L431 VanDerWaalsContact C-N 3.29Å; E429-L431 PolarHBondContact O-N 3.11Å; L431-I436 HydrophobicContact CD1-CG2 3.69Å; L431-W464 HydrophobicContact CD1-CE3 3.73Å; L431-W464 HydrophobicContact CD1-CZ3 4.25Å; L431-W464 HydrophobicContact CD2-CB 4.26Å; L431-I468 HydrophobicContact CD2-CD1 3.73Å
432	Q	91.5	Very high	90.9	Very high	93 Å²	93	51.1 Å²	51.1	44%	0.435	27%	0.267	S	S	.	.	H	α-helix	trans	-72.4	-54	175.6	-72.9	170.7	-0.8	0	0	111.4	I245 S428 E429 S434 G435	I245-Q432 HydrophobicContact CG1-CG 4.5Å; I245-Q432 HydrophobicContact CG2-CG 4.09Å; S428-Q432 VanDerWaalsContact O-CG 3.28Å; S428-Q432 WeakPolarHBondContact O-CG 3.16Å; S428-Q432 PolarHBondContact O-N 2.9Å; E429-Q432 PolarHBondContact O-N 2.82Å; E429-Q432 VanDerWaalsContact O-N 3.13Å; Q432-S434 PolarHBondContact O-N 3.45Å; Q432-G435 PolarHBondContact O-N 2.81Å; Q432-G435 VanDerWaalsContact O-N 3.11Å
433	E	93.4	Very high	91.1	Very high	154 Å²	154	47 Å²	47	72%	0.72	25%	0.248	S	C	*	.	H	α-helix	trans	-60	-40.9	-176.4	-72	-172.9	145	0	0	113.1	E429 G435	E429-E433 WeakPolarHBondContact O-CG 3.34Å; E429-E433 PolarHBondContact O-N 2.96Å; E433-G435 VanDerWaalsContact C-N 3.31Å
434	S	94.6	Very high	91.4	Very high	13 Å²	13	51.8 Å²	51.8	9%	0.091	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77	-17.7	179.3	64.2	0	0	0	0	113.6	T396 V430 Q432 I436	T396-S434 WeakPolarHBondContact CB-O 3.34Å; T396-S434 PolarHBondContact OG1-O 3.12Å; V430-S434 VanDerWaalsContact O-CB 3.26Å; V430-S434 WeakPolarHBondContact O-CB 3.37Å; V430-S434 PolarHBondContact O-N 2.96Å; V430-S434 VanDerWaalsContact O-N 3.09Å; V430-S434 PolarHBondContact O-OG 2.55Å; Q432-S434 PolarHBondContact O-N 3.45Å; S434-I436 PolarHBondContact O-N 3.14Å; S434-I436 VanDerWaalsContact O-N 3.14Å; S434-I436 WeakPolarHBondContact OG-CG2 3.41Å
435	G	94.1	Very high	92.3	Very high	12 Å²	12	52.2 Å²	52.2	12%	0.124	27%	0.266	C	S	.	.			trans	62.8	9.7	-173.9	0	0	0	0	0	114.9	T396 Q432 E433 G437 K438	T396-G435 WeakPolarHBondContact CG2-O 3.22Å; Q432-G435 PolarHBondContact O-N 2.81Å; Q432-G435 VanDerWaalsContact O-N 3.11Å; E433-G435 VanDerWaalsContact C-N 3.31Å; G435-G437 VanDerWaalsContact C-N 3.26Å; G435-G437 PolarHBondContact O-N 3.42Å; G435-K438 VanDerWaalsContact O-CB 3.25Å; G435-K438 WeakPolarHBondContact O-CB 3.28Å; G435-K438 VanDerWaalsContact O-CG 3.32Å; G435-K438 WeakPolarHBondContact O-CG 3.46Å; G435-K438 PolarHBondContact O-N 3.38Å
436	I	95.3	Very high	93.2	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-62.4	-34.3	-169	-172.1	60.3	0	0	0	112.8	I395 T396 L399 L420 L431 S434 K438 A439 L440 W464	I395-I436 HydrophobicContact CB-CD1 4.34Å; I395-I436 HydrophobicContact CG2-CD1 3.88Å; T396-I436 WeakPolarHBondContact OG1-CA 3.49Å; T396-I436 WeakPolarHBondContact OG1-CB 3.37Å; T396-I436 WeakPolarHBondContact OG1-CD1 3.44Å; T396-I436 PolarHBondContact OG1-N 3.08Å; L399-I436 HydrophobicContact CD1-CD1 4.25Å; L420-I436 HydrophobicContact CD1-CD1 3.96Å; L420-I436 HydrophobicContact CD1-CG1 4.11Å; L420-I436 HydrophobicContact CD2-CG1 4.36Å; L431-I436 HydrophobicContact CD1-CG2 3.69Å; S434-I436 PolarHBondContact O-N 3.14Å; S434-I436 VanDerWaalsContact O-N 3.14Å; S434-I436 WeakPolarHBondContact OG-CG2 3.41Å; I436-K438 VanDerWaalsContact C-N 3.28Å; I436-K438 PolarHBondContact O-N 2.97Å; I436-A439 PolarHBondContact O-N 2.68Å; I436-L440 WeakPolarHBondContact O-CG 3.23Å; I436-L440 PolarHBondContact O-N 3.14Å; I436-W464 HydrophobicContact CG1-CH2 4.28Å; I436-W464 HydrophobicContact CG1-CZ3 4.12Å; I436-W464 HydrophobicContact CG2-CE3 4.49Å; I436-W464 HydrophobicContact CG2-CH2 4.35Å; I436-W464 HydrophobicContact CG2-CZ3 3.75Å
437	G	93.7	Very high	93.4	Very high	1 Å²	1	53.1 Å²	53.1	1%	0.01	27%	0.268	C	S	.	.	H	α-helix	trans	-63.3	-30.3	175	0	0	0	0	0	113.9	F246 G435 L440 M441	F246-G437 VanDerWaalsContact CD1-C 3.46Å; G435-G437 VanDerWaalsContact C-N 3.26Å; G435-G437 PolarHBondContact O-N 3.42Å; G437-L440 PolarHBondContact O-N 3.46Å; G437-M441 VanDerWaalsContact O-CB 3.31Å; G437-M441 WeakPolarHBondContact O-CB 3.49Å; G437-M441 PolarHBondContact O-N 2.99Å
438	K	93.4	Very high	93.6	Very high	95 Å²	95	59.7 Å²	59.7	41%	0.413	28%	0.284	S	S	.	.	H	α-helix	trans	-62.3	-48.1	174.8	-45.4	-157.6	168.6	-130.4	0	110.3	I245 F246 G247 G435 I436 M441 Y442	I245-K438 WeakPolarHBondContact O-CE 3.32Å; F246-K438 VanDerWaalsContact C-CE 3.43Å; F246-K438 HydrophobicContact CB-CG 4.39Å; F246-K438 WeakPolarHBondContact O-CD 3.5Å; F246-K438 WeakPolarHBondContact O-CE 3.22Å; F246-K438 WeakPolarHBondContact O-CG 3.47Å; F246-K438 PolarHBondContact O-NZ 3.04Å; G247-K438 VanDerWaalsContact N-NZ 3.1Å; G435-K438 VanDerWaalsContact O-CB 3.25Å; G435-K438 WeakPolarHBondContact O-CB 3.28Å; G435-K438 VanDerWaalsContact O-CG 3.32Å; G435-K438 WeakPolarHBondContact O-CG 3.46Å; G435-K438 PolarHBondContact O-N 3.38Å; I436-K438 VanDerWaalsContact C-N 3.28Å; I436-K438 PolarHBondContact O-N 2.97Å; K438-M441 PolarHBondContact O-N 2.73Å; K438-Y442 PolarHBondContact O-N 2.71Å
439	A	94.6	Very high	94	Very high	5 Å²	5	58.4 Å²	58.4	4%	0.041	27%	0.273	C	S	.	.	H	α-helix	trans	-65.7	-41.8	177.1	0	0	0	0	0	112.2	T396 L399 I436 Y442 L443	T396-A439 HydrophobicContact CG2-CB 4.06Å; L399-A439 HydrophobicContact CB-CB 3.96Å; I436-A439 PolarHBondContact O-N 2.68Å; A439-Y442 PolarHBondContact O-N 3.17Å; A439-L443 WeakPolarHBondContact O-CG 3.5Å; A439-L443 PolarHBondContact O-N 2.73Å
440	L	95.3	Very high	94.2	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-62.3	-44	175.2	-68	-169.6	0	0	0	112.5	L399 L417 L420 I436 G437 Y442 L443 Y444 L460 I461 W464	L399-L440 HydrophobicContact CD1-CD2 4.42Å; L417-L440 HydrophobicContact CD2-CD2 3.38Å; L420-L440 HydrophobicContact CD1-CD2 4.05Å; I436-L440 WeakPolarHBondContact O-CG 3.23Å; I436-L440 PolarHBondContact O-N 3.14Å; G437-L440 PolarHBondContact O-N 3.46Å; L440-Y442 VanDerWaalsContact C-N 3.32Å; L440-Y442 PolarHBondContact O-N 3.36Å; L440-L443 PolarHBondContact O-N 3.47Å; L440-Y444 WeakPolarHBondContact O-CB 3.37Å; L440-Y444 PolarHBondContact O-N 2.93Å; L440-L460 HydrophobicContact CD1-CB 3.66Å; L440-L460 HydrophobicContact CD1-CD1 3.98Å; L440-L460 HydrophobicContact CD1-CG 4.46Å; L440-L460 HydrophobicContact CD2-CD1 4.25Å; L440-I461 HydrophobicContact CB-CD1 4.1Å; L440-I461 HydrophobicContact CB-CG1 3.94Å; L440-I461 HydrophobicContact CD1-CG1 4.42Å; L440-W464 HydrophobicContact CD1-CE3 3.95Å; L440-W464 HydrophobicContact CD1-CH2 3.86Å; L440-W464 HydrophobicContact CD1-CZ3 3.31Å; L440-W464 HydrophobicContact CG-CZ3 4.37Å
441	M	93.8	Very high	94.4	Very high	30 Å²	30	60.1 Å²	60.1	15%	0.148	28%	0.277	C	S	.	.	H	α-helix	trans	-62.5	-40	177.6	-173.8	60.2	70.4	0	0	111.5	F246 G437 K438 Y444 K445 I461	F246-M441 HydrophobicContact CD2-CE 4.13Å; F246-M441 HydrophobicContact CE2-CE 4.18Å; G437-M441 VanDerWaalsContact O-CB 3.31Å; G437-M441 WeakPolarHBondContact O-CB 3.49Å; G437-M441 PolarHBondContact O-N 2.99Å; K438-M441 PolarHBondContact O-N 2.73Å; M441-Y444 PolarHBondContact O-N 2.96Å; M441-Y444 HydrophobicContact SD-CD1 4.32Å; M441-K445 HydrophobicContact CG-CD 4.39Å; M441-K445 PolarHBondContact O-N 2.95Å; M441-K445 HydrophobicContact SD-CD 4.19Å; M441-K445 HydrophobicContact SD-CG 4.21Å; M441-I461 HydrophobicContact CE-CD1 4.25Å; M441-I461 HydrophobicContact CE-CG2 4.07Å; M441-I461 HydrophobicContact SD-CD1 4.49Å
442	Y	94.5	Very high	94.6	Very high	42 Å²	42	65.7 Å²	65.7	17%	0.165	30%	0.303	C	S	.	.	H	α-helix	trans	-58.5	-53.8	172.5	-176.4	-92.6	0	0	0	111.4	P401 H405 L407 K438 A439 L440 Y444 K445 H446	P401-Y442 HydrophobicContact CB-CD1 4.48Å; P401-Y442 HydrophobicContact CB-CE1 3.8Å; P401-Y442 HydrophobicContact CB-CE2 4.24Å; P401-Y442 HydrophobicContact CG-CE1 4.32Å; P401-Y442 HydrophobicContact CG-CE2 4.24Å; H405-Y442 PolarHBondContact O-OH 2.9Å; L407-Y442 HydrophobicContact CD2-CE1 3.99Å; K438-Y442 PolarHBondContact O-N 2.71Å; A439-Y442 PolarHBondContact O-N 3.17Å; L440-Y442 VanDerWaalsContact C-N 3.32Å; L440-Y442 PolarHBondContact O-N 3.36Å; Y442-Y444 VanDerWaalsContact C-N 3.32Å; Y442-Y444 PolarHBondContact O-N 3.25Å; Y442-K445 PolarHBondContact O-N 3.24Å; Y442-H446 HydrophobicContact CE1-CB 4.37Å; Y442-H446 AromaticContact CE1-CD2 3.83Å; Y442-H446 AromaticContact CZ-CD2 3.6Å; Y442-H446 WeakPolarHBondContact O-CB 3.43Å; Y442-H446 PolarHBondContact O-N 3.42Å; Y442-H446 PolarHBondContact OH-CD2 2.82Å
443	L	95.5	Very high	94.9	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-60.5	-40.4	179.8	-62.5	177	0	0	0	112.3	L399 L407 L417 A439 L440 E449	L399-L443 HydrophobicContact CB-CD1 4.43Å; L399-L443 HydrophobicContact CD1-CD1 4.12Å; L399-L443 HydrophobicContact CD2-CD1 4.05Å; L399-L443 HydrophobicContact CG-CD1 4.43Å; L407-L443 HydrophobicContact CD2-CD2 3.61Å; L417-L443 HydrophobicContact CD1-CD1 4.5Å; L417-L443 HydrophobicContact CD2-CD1 4.37Å; A439-L443 WeakPolarHBondContact O-CG 3.5Å; A439-L443 PolarHBondContact O-N 2.73Å; L440-L443 PolarHBondContact O-N 3.47Å; L443-E449 VanDerWaalsContact O-CB 3.28Å; L443-E449 WeakPolarHBondContact O-CB 3.46Å; L443-E449 WeakPolarHBondContact O-CG 3.17Å
444	Y	96	Very high	95.1	Very high	105 Å²	105	56.3 Å²	56.3	41%	0.412	26%	0.258	S	S	.	.	H	α-helix	trans	-61.8	-49.7	177.4	179.1	-111.4	0	0	0	112.3	L440 M441 Y442 K454 I461	L440-Y444 WeakPolarHBondContact O-CB 3.37Å; L440-Y444 PolarHBondContact O-N 2.93Å; M441-Y444 PolarHBondContact O-N 2.96Å; M441-Y444 HydrophobicContact SD-CD1 4.32Å; Y442-Y444 VanDerWaalsContact C-N 3.32Å; Y442-Y444 PolarHBondContact O-N 3.25Å; Y444-K454 HydrophobicContact CD2-CB 4.23Å; Y444-K454 WeakPolarHBondContact CD2-O 3.31Å; Y444-K454 WeakPolarHBondContact O-CD 3.25Å; Y444-K454 VanDerWaalsContact O-CE 3.25Å; Y444-K454 WeakPolarHBondContact O-CE 3.36Å; Y444-K454 PolarHBondContact O-NZ 2.92Å; Y444-I461 HydrophobicContact CD1-CD1 4.48Å; Y444-I461 HydrophobicContact CG-CD1 4.22Å
445	K	94.2	Very high	95.2	Very high	156 Å²	156	58.6 Å²	58.6	68%	0.678	27%	0.269	S	S	*	.	H	α-helix	trans	-71.6	-37.4	179.1	-70.6	-172.8	174.2	-175.8	0	112.5	M441 Y442 K454	M441-K445 HydrophobicContact CG-CD 4.39Å; M441-K445 PolarHBondContact O-N 2.95Å; M441-K445 HydrophobicContact SD-CD 4.19Å; M441-K445 HydrophobicContact SD-CG 4.21Å; Y442-K445 PolarHBondContact O-N 3.24Å; K445-K454 PolarHBondContact O-NZ 2.85Å; K445-K454 VanDerWaalsContact O-NZ 3.12Å
446	H	93.5	Very high	95.3	Very high	27 Å²	27	61.7 Å²	61.7	13%	0.125	28%	0.277	C	S	.	.			trans	-55.4	130.5	-168.3	-170.3	-88.9	0	0	0	114.1	L407 Y442 R448 E449 K454	L407-H446 WeakPolarHBondContact CD1-CE1 3.19Å; L407-H446 WeakPolarHBondContact CD1-ND1 3.49Å; L407-H446 HydrophobicContact CD2-CB 4.43Å; Y442-H446 HydrophobicContact CE1-CB 4.37Å; Y442-H446 AromaticContact CE1-CD2 3.83Å; Y442-H446 AromaticContact CZ-CD2 3.6Å; Y442-H446 WeakPolarHBondContact O-CB 3.43Å; Y442-H446 PolarHBondContact O-N 3.42Å; Y442-H446 PolarHBondContact OH-CD2 2.82Å; H446-R448 VanDerWaalsContact C-N 3.31Å; H446-R448 PolarHBondContact ND1-N 2.8Å; H446-R448 VanDerWaalsContact ND1-N 3.15Å; H446-R448 PolarHBondContact O-N 3.3Å; H446-E449 PolarHBondContact O-N 3.1Å; H446-K454 WeakPolarHBondContact O-CE 3.43Å; H446-K454 PolarHBondContact O-NZ 3.43Å
447	P	93.5	Very high	95.3	Very high	117 Å²	117	61.7 Å²	61.7	76%	0.76	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-25.8	-171.1	24.2	-34.2	0	0	0	114.4
448	R	93.5	Very high	95.3	Very high	197 Å²	197	62.1 Å²	62.1	74%	0.743	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.5	18.3	-178.5	-47.1	171.1	63.7	-175.6	1.9	114.3	L407 H446	L407-R448 HydrophobicContact CD1-CB 3.97Å; L407-R448 WeakPolarHBondContact CD1-O 3.47Å; H446-R448 VanDerWaalsContact C-N 3.31Å; H446-R448 PolarHBondContact ND1-N 2.8Å; H446-R448 VanDerWaalsContact ND1-N 3.15Å; H446-R448 PolarHBondContact O-N 3.3Å
449	E	95.8	Very high	95.3	Very high	14 Å²	14	65.5 Å²	65.5	7%	0.065	29%	0.292	C	S	.	.	S	Bend	trans	-84.3	149.5	169.4	-174.9	57.6	-90.5	0	0	111	R413 L443 H446 N453 K454	R413-E449 WeakPolarHBondContact CD-OE2 3.22Å; R413-E449 IonicContact CZ-OE1 3.15Å; R413-E449 VanDerWaalsContact CZ-OE1 3.24Å; R413-E449 IonicContact CZ-OE2 3.92Å; R413-E449 IonicContact NE-OE1 3.5Å; R413-E449 IonicContact NE-OE2 2.72Å; R413-E449 IonicContact NH1-OE1 3.76Å; R413-E449 PolarHBondContact NH1-OE1 3.17Å; R413-E449 IonicContact NH1-OE2 2.83Å; R413-E449 PolarHBondContact NH1-OE2 3.42Å; R413-E449 IonicContact NH2-OE1 2.67Å; L443-E449 VanDerWaalsContact O-CB 3.28Å; L443-E449 WeakPolarHBondContact O-CB 3.46Å; L443-E449 WeakPolarHBondContact O-CG 3.17Å; H446-E449 PolarHBondContact O-N 3.1Å; E449-N453 VanDerWaalsContact CD-CB 3.48Å; E449-N453 HydrophobicContact CG-CB 3.68Å; E449-N453 WeakPolarHBondContact OE1-CB 3.46Å; E449-N453 PolarHBondContact OE1-ND2 3.43Å; E449-K454 HydrophobicContact CB-CG 4.1Å; E449-K454 HydrophobicContact CG-CG 3.97Å
450	T	97.1	Very high	95.3	Very high	50 Å²	50	65.6 Å²	65.6	31%	0.307	29%	0.291	S	S	.	.			trans	-70.7	148.9	177.6	71.2	0	0	0	0	110.8	L410 E452 N453 K454	L410-T450 HydrophobicContact CD1-CG2 3.55Å; T450-E452 VanDerWaalsContact C-N 3.31Å; T450-E452 PolarHBondContact O-N 3.21Å; T450-N453 PolarHBondContact O-N 3.06Å; T450-N453 VanDerWaalsContact O-N 3.09Å; T450-N453 WeakPolarHBondContact OG1-CB 3.36Å; T450-N453 VanDerWaalsContact OG1-CG 3.25Å; T450-N453 PolarHBondContact OG1-N 2.93Å; T450-N453 PolarHBondContact OG1-ND2 2.9Å; T450-K454 PolarHBondContact O-N 2.61Å
451	R	96.8	Very high	95.2	Very high	148 Å²	148	66.2 Å²	66.2	56%	0.558	29%	0.294	S	S	*	.	H	α-helix	trans	-55.8	-45.7	178.7	-178.8	174.7	171.5	-169.4	-4.8	111.9	N222 N453 K454 D455	N222-R451 VanDerWaalsContact OD1-CZ 3.25Å; N222-R451 PolarHBondContact OD1-NH1 3.1Å; N222-R451 PolarHBondContact OD1-NH2 2.85Å; R451-N453 VanDerWaalsContact C-N 3.26Å; R451-N453 PolarHBondContact O-N 3.43Å; R451-K454 WeakPolarHBondContact O-CB 3.28Å; R451-K454 PolarHBondContact O-N 2.83Å; R451-K454 VanDerWaalsContact O-N 3.16Å; R451-D455 IonicContact NE-OD2 3.24Å; R451-D455 PolarHBondContact O-N 2.9Å
452	E	96.9	Very high	95	Very high	120 Å²	120	68.9 Å²	68.9	56%	0.561	31%	0.31	S	S	*	.	H	α-helix	trans	-58.9	-37.1	178.3	-57.8	-177.1	-166.2	0	0	113	T450 D455 R456	T450-E452 VanDerWaalsContact C-N 3.31Å; T450-E452 PolarHBondContact O-N 3.21Å; E452-D455 PolarHBondContact O-N 3.39Å; E452-R456 VanDerWaalsContact CB-NH1 3.26Å; E452-R456 WeakPolarHBondContact O-CB 3.17Å; E452-R456 VanDerWaalsContact O-CG 3.23Å; E452-R456 WeakPolarHBondContact O-CG 3.17Å; E452-R456 PolarHBondContact O-N 3.21Å; E452-R456 IonicContact OE2-CZ 2.68Å; E452-R456 IonicContact OE2-NH1 2.78Å; E452-R456 PolarHBondContact OE2-NH1 2.88Å; E452-R456 IonicContact OE2-NH2 3.22Å; E452-R456 PolarHBondContact OE2-NH2 3.05Å
453	N	97.1	Very high	94.7	Very high	0 Å²	0	71.1 Å²	71.1	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-74.8	-35	178.4	-74.9	-13.1	0	0	0	112.3	D414 L417 E449 T450 R451 D455 R456 A457	D414-N453 PolarHBondContact OD1-ND2 3.29Å; D414-N453 PolarHBondContact OD1-OD1 2.91Å; L417-N453 HydrophobicContact CD1-CB 3.6Å; E449-N453 VanDerWaalsContact CD-CB 3.48Å; E449-N453 HydrophobicContact CG-CB 3.68Å; E449-N453 WeakPolarHBondContact OE1-CB 3.46Å; E449-N453 PolarHBondContact OE1-ND2 3.43Å; T450-N453 PolarHBondContact O-N 3.06Å; T450-N453 VanDerWaalsContact O-N 3.09Å; T450-N453 WeakPolarHBondContact OG1-CB 3.36Å; T450-N453 VanDerWaalsContact OG1-CG 3.25Å; T450-N453 PolarHBondContact OG1-N 2.93Å; T450-N453 PolarHBondContact OG1-ND2 2.9Å; R451-N453 VanDerWaalsContact C-N 3.26Å; R451-N453 PolarHBondContact O-N 3.43Å; N453-D455 VanDerWaalsContact C-N 3.34Å; N453-R456 PolarHBondContact O-N 3.32Å; N453-R456 PolarHBondContact OD1-NH1 2.74Å; N453-A457 VanDerWaalsContact O-CB 3.26Å; N453-A457 WeakPolarHBondContact O-CB 3.47Å; N453-A457 PolarHBondContact O-N 2.87Å
454	K	97.2	Very high	94.5	Very high	50 Å²	50	71.7 Å²	71.7	22%	0.217	32%	0.323	C	S	.	.	H	α-helix	trans	-61.2	-44.3	167.8	-66.6	-169.3	173.7	-132.2	0	110.8	Y444 K445 H446 E449 T450 R451 R456 A457 G458	Y444-K454 HydrophobicContact CD2-CB 4.23Å; Y444-K454 WeakPolarHBondContact CD2-O 3.31Å; Y444-K454 WeakPolarHBondContact O-CD 3.25Å; Y444-K454 VanDerWaalsContact O-CE 3.25Å; Y444-K454 WeakPolarHBondContact O-CE 3.36Å; Y444-K454 PolarHBondContact O-NZ 2.92Å; K445-K454 PolarHBondContact O-NZ 2.85Å; K445-K454 VanDerWaalsContact O-NZ 3.12Å; H446-K454 WeakPolarHBondContact O-CE 3.43Å; H446-K454 PolarHBondContact O-NZ 3.43Å; E449-K454 HydrophobicContact CB-CG 4.1Å; E449-K454 HydrophobicContact CG-CG 3.97Å; T450-K454 PolarHBondContact O-N 2.61Å; R451-K454 WeakPolarHBondContact O-CB 3.28Å; R451-K454 PolarHBondContact O-N 2.83Å; R451-K454 VanDerWaalsContact O-N 3.16Å; K454-R456 VanDerWaalsContact C-N 3.33Å; K454-R456 PolarHBondContact O-N 3.22Å; K454-A457 PolarHBondContact O-N 3.27Å; K454-G458 PolarHBondContact O-N 3.2Å
455	D	96.7	Very high	94	Very high	62 Å²	62	67.5 Å²	67.5	33%	0.332	31%	0.308	S	S	.	.	H	α-helix	trans	-64.8	-35.2	177.8	-62.9	-17.4	0	0	0	112.2	R451 E452 N453 R459	R451-D455 IonicContact NE-OD2 3.24Å; R451-D455 PolarHBondContact O-N 2.9Å; E452-D455 PolarHBondContact O-N 3.39Å; N453-D455 VanDerWaalsContact C-N 3.34Å; D455-R459 WeakPolarHBondContact O-CD 3.42Å; D455-R459 VanDerWaalsContact O-CG 3.22Å; D455-R459 WeakPolarHBondContact O-CG 3.4Å; D455-R459 PolarHBondContact O-N 2.74Å; D455-R459 PolarHBondContact O-NE 3.25Å
456	R	96	Very high	93.6	Very high	77 Å²	77	63.2 Å²	63.2	29%	0.291	29%	0.288	S	S	.	.	H	α-helix	trans	-69.5	-51.2	173	-72.6	166.6	-172.3	119.9	12.7	111.6	L417 E452 N453 K454 R459 L460	L417-R456 HydrophobicContact CB-CB 4.33Å; E452-R456 VanDerWaalsContact CB-NH1 3.26Å; E452-R456 WeakPolarHBondContact O-CB 3.17Å; E452-R456 VanDerWaalsContact O-CG 3.23Å; E452-R456 WeakPolarHBondContact O-CG 3.17Å; E452-R456 PolarHBondContact O-N 3.21Å; E452-R456 IonicContact OE2-CZ 2.68Å; E452-R456 IonicContact OE2-NH1 2.78Å; E452-R456 PolarHBondContact OE2-NH1 2.88Å; E452-R456 IonicContact OE2-NH2 3.22Å; E452-R456 PolarHBondContact OE2-NH2 3.05Å; N453-R456 PolarHBondContact O-N 3.32Å; N453-R456 PolarHBondContact OD1-NH1 2.74Å; K454-R456 VanDerWaalsContact C-N 3.33Å; K454-R456 PolarHBondContact O-N 3.22Å; R456-R459 PolarHBondContact O-N 2.74Å; R456-L460 WeakPolarHBondContact O-CG 3.47Å; R456-L460 PolarHBondContact O-N 2.87Å
457	A	95.8	Very high	93	Very high	0 Å²	0	66.2 Å²	66.2	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-62.1	-44.3	179.9	0	0	0	0	0	111.6	L417 N453 K454 R459 L460 I461	L417-A457 HydrophobicContact CD2-CB 4.03Å; N453-A457 VanDerWaalsContact O-CB 3.26Å; N453-A457 WeakPolarHBondContact O-CB 3.47Å; N453-A457 PolarHBondContact O-N 2.87Å; K454-A457 PolarHBondContact O-N 3.27Å; A457-R459 VanDerWaalsContact C-N 3.32Å; A457-R459 PolarHBondContact O-N 3.26Å; A457-L460 PolarHBondContact O-N 2.62Å; A457-I461 WeakPolarHBondContact O-CB 3.47Å; A457-I461 WeakPolarHBondContact O-CD1 3.41Å; A457-I461 WeakPolarHBondContact O-CG1 2.99Å; A457-I461 PolarHBondContact O-N 3.32Å
458	G	94.3	Very high	92.4	Very high	9 Å²	9	62.7 Å²	62.7	9%	0.093	28%	0.284	C	S	.	.	H	α-helix	trans	-60.9	-37.4	176.2	0	0	0	0	0	113	K454 N462	K454-G458 PolarHBondContact O-N 3.2Å; G458-N462 WeakPolarHBondContact O-CB 3.33Å; G458-N462 PolarHBondContact O-N 2.84Å; G458-N462 PolarHBondContact O-ND2 3.35Å
459	R	93.7	Very high	91.8	Very high	167 Å²	167	55.2 Å²	55.2	63%	0.63	26%	0.257	S	S	*	.	H	α-helix	trans	-64.9	-48	172.4	-76.3	173.5	-124.7	-165.7	-4.9	112.1	D455 R456 A457 I461 N462 E463	D455-R459 WeakPolarHBondContact O-CD 3.42Å; D455-R459 VanDerWaalsContact O-CG 3.22Å; D455-R459 WeakPolarHBondContact O-CG 3.4Å; D455-R459 PolarHBondContact O-N 2.74Å; D455-R459 PolarHBondContact O-NE 3.25Å; R456-R459 PolarHBondContact O-N 2.74Å; A457-R459 VanDerWaalsContact C-N 3.32Å; A457-R459 PolarHBondContact O-N 3.26Å; R459-I461 PolarHBondContact O-N 3.46Å; R459-N462 PolarHBondContact O-N 3.2Å; R459-E463 WeakPolarHBondContact O-CB 2.99Å; R459-E463 PolarHBondContact O-N 3.27Å
460	L	94.3	Very high	90.6	Very high	6 Å²	6	61.1 Å²	61.1	3%	0.031	29%	0.289	C	S	.	.	H	α-helix	trans	-59.6	-46	177.7	-69.7	169.9	0	0	0	112.2	L417 L420 L440 R456 A457 N462 E463 W464	L417-L460 HydrophobicContact CD2-CD1 4.11Å; L420-L460 HydrophobicContact CB-CD1 3.86Å; L420-L460 HydrophobicContact CB-CD2 4.32Å; L440-L460 HydrophobicContact CD1-CB 3.66Å; L440-L460 HydrophobicContact CD1-CD1 3.98Å; L440-L460 HydrophobicContact CD1-CG 4.46Å; L440-L460 HydrophobicContact CD2-CD1 4.25Å; R456-L460 WeakPolarHBondContact O-CG 3.47Å; R456-L460 PolarHBondContact O-N 2.87Å; A457-L460 PolarHBondContact O-N 2.62Å; L460-N462 PolarHBondContact O-N 2.86Å; L460-E463 PolarHBondContact O-N 3.43Å; L460-W464 HydrophobicContact CD2-CZ2 3.96Å; L460-W464 PolarHBondContact O-N 2.8Å
461	I	92.2	Very high	89.3	Confident	13 Å²	13	62.1 Å²	62.1	7%	0.067	29%	0.292	C	S	.	.	H	α-helix	trans	-57.9	-48.8	175.9	-68.3	162.7	0	0	0	109.9	L440 M441 Y444 A457 R459 E463 L465	L440-I461 HydrophobicContact CB-CD1 4.1Å; L440-I461 HydrophobicContact CB-CG1 3.94Å; L440-I461 HydrophobicContact CD1-CG1 4.42Å; M441-I461 HydrophobicContact CE-CD1 4.25Å; M441-I461 HydrophobicContact CE-CG2 4.07Å; M441-I461 HydrophobicContact SD-CD1 4.49Å; Y444-I461 HydrophobicContact CD1-CD1 4.48Å; Y444-I461 HydrophobicContact CG-CD1 4.22Å; A457-I461 WeakPolarHBondContact O-CB 3.47Å; A457-I461 WeakPolarHBondContact O-CD1 3.41Å; A457-I461 WeakPolarHBondContact O-CG1 2.99Å; A457-I461 PolarHBondContact O-N 3.32Å; R459-I461 PolarHBondContact O-N 3.46Å; I461-E463 PolarHBondContact O-N 3.1Å; I461-L465 HydrophobicContact CG2-CD1 3.6Å; I461-L465 HydrophobicContact CG2-CG 4.31Å; I461-L465 WeakPolarHBondContact O-CB 3.41Å; I461-L465 WeakPolarHBondContact O-CG 3.46Å; I461-L465 PolarHBondContact O-N 3.08Å
462	N	89.7	Confident	87.6	Confident	87 Å²	87	58.1 Å²	58.1	47%	0.465	28%	0.284	S	S	.	.	H	α-helix	trans	-62.6	-40.6	177.3	-87.6	-81.1	0	0	0	113.2	G458 R459 L460 R466	G458-N462 WeakPolarHBondContact O-CB 3.33Å; G458-N462 PolarHBondContact O-N 2.84Å; G458-N462 PolarHBondContact O-ND2 3.35Å; R459-N462 PolarHBondContact O-N 3.2Å; L460-N462 PolarHBondContact O-N 2.86Å; N462-R466 WeakPolarHBondContact O-CD 3.12Å; N462-R466 WeakPolarHBondContact O-CG 3.26Å; N462-R466 PolarHBondContact O-N 3.34Å
463	E	89.7	Confident	85.9	Confident	89 Å²	89	55.5 Å²	55.5	42%	0.416	28%	0.279	S	S	.	.	H	α-helix	trans	-66.8	-46.2	-179.6	-172	177.2	147.9	0	0	111.7	R459 L460 I461 P467	R459-E463 WeakPolarHBondContact O-CB 2.99Å; R459-E463 PolarHBondContact O-N 3.27Å; L460-E463 PolarHBondContact O-N 3.43Å; I461-E463 PolarHBondContact O-N 3.1Å; E463-P467 VanDerWaalsContact O-CD 3.31Å; E463-P467 WeakPolarHBondContact O-CD 3.48Å
464	W	90	Very high	84.2	Confident	11 Å²	11	59.9 Å²	59.9	4%	0.042	30%	0.302	C	S	.	.	H	α-helix	trans	-77.7	-26.5	-177.4	-60.1	-16.2	0	0	0	113.6	L420 F423 L426 L431 I436 L440 L460	L420-W464 HydrophobicContact CB-CH2 4.16Å; L420-W464 HydrophobicContact CB-CZ2 4.3Å; L420-W464 HydrophobicContact CD1-CH2 4.33Å; L420-W464 HydrophobicContact CD2-CH2 4.1Å; L420-W464 HydrophobicContact CG-CH2 4.41Å; F423-W464 PolarHBondContact O-NE1 3.14Å; L426-W464 HydrophobicContact CD1-CD2 3.91Å; L426-W464 HydrophobicContact CD1-CE3 4.15Å; L426-W464 HydrophobicContact CD1-CH2 3.91Å; L426-W464 HydrophobicContact CD1-CZ2 3.65Å; L426-W464 HydrophobicContact CD1-CZ3 4.14Å; L426-W464 HydrophobicContact CG-CZ2 4.43Å; L431-W464 HydrophobicContact CD1-CE3 3.73Å; L431-W464 HydrophobicContact CD1-CZ3 4.25Å; L431-W464 HydrophobicContact CD2-CB 4.26Å; I436-W464 HydrophobicContact CG1-CH2 4.28Å; I436-W464 HydrophobicContact CG1-CZ3 4.12Å; I436-W464 HydrophobicContact CG2-CE3 4.49Å; I436-W464 HydrophobicContact CG2-CH2 4.35Å; I436-W464 HydrophobicContact CG2-CZ3 3.75Å; L440-W464 HydrophobicContact CD1-CE3 3.95Å; L440-W464 HydrophobicContact CD1-CH2 3.86Å; L440-W464 HydrophobicContact CD1-CZ3 3.31Å; L440-W464 HydrophobicContact CG-CZ3 4.37Å; L460-W464 HydrophobicContact CD2-CZ2 3.96Å; L460-W464 PolarHBondContact O-N 2.8Å
465	L	86.9	Confident	82.5	Confident	18 Å²	18	64.7 Å²	64.7	9%	0.094	32%	0.32	C	S	.	.	H	α-helix	trans	-79.1	-32.4	176.7	-77.2	-179.3	0	0	0	114.1	I245 F246 I461 I468 F469	I245-L465 HydrophobicContact CD1-CD2 4.22Å; F246-L465 HydrophobicContact CE1-CD2 4.47Å; F246-L465 HydrophobicContact CE2-CD1 3.83Å; F246-L465 HydrophobicContact CE2-CD2 3.66Å; F246-L465 HydrophobicContact CE2-CG 4.06Å; F246-L465 HydrophobicContact CZ-CD1 4.06Å; F246-L465 HydrophobicContact CZ-CD2 3.38Å; F246-L465 HydrophobicContact CZ-CG 3.8Å; I461-L465 HydrophobicContact CG2-CD1 3.6Å; I461-L465 HydrophobicContact CG2-CG 4.31Å; I461-L465 WeakPolarHBondContact O-CB 3.41Å; I461-L465 WeakPolarHBondContact O-CG 3.46Å; I461-L465 PolarHBondContact O-N 3.08Å; L465-I468 HydrophobicContact CD2-CD1 4.4Å; L465-I468 WeakPolarHBondContact O-CB 3.3Å; L465-I468 PolarHBondContact O-N 3.18Å; L465-F469 HydrophobicContact CB-CD2 4.01Å; L465-F469 HydrophobicContact CB-CE2 4.15Å; L465-F469 HydrophobicContact CD1-CE2 4.16Å; L465-F469 HydrophobicContact CD2-CD2 4.32Å; L465-F469 HydrophobicContact CD2-CE2 3.74Å; L465-F469 HydrophobicContact CG-CE2 4.24Å; L465-F469 WeakPolarHBondContact O-CD2 3.39Å; L465-F469 PolarHBondContact O-N 2.82Å; L465-F469 VanDerWaalsContact O-N 3.09Å
466	R	84	Confident	81	Confident	66 Å²	66	72.4 Å²	72.4	25%	0.249	35%	0.345	C	S	.	.	H	α-helix	trans	-52	-46.1	-175.6	-86.6	168.7	-172.7	-73.6	-6.3	114.1	N462 I468 N470 L471	N462-R466 WeakPolarHBondContact O-CD 3.12Å; N462-R466 WeakPolarHBondContact O-CG 3.26Å; N462-R466 PolarHBondContact O-N 3.34Å; R466-I468 VanDerWaalsContact C-N 3.27Å; R466-I468 PolarHBondContact O-N 3.39Å; R466-N470 CarbonylContact O-C 3.57Å; R466-N470 WeakPolarHBondContact O-CA 3.45Å; R466-N470 PolarHBondContact O-N 3.39Å; R466-N470 VanDerWaalsContact O-N 3.09Å; R466-L471 HydrophobicContact CB-CB 4.42Å; R466-L471 HydrophobicContact CG-CB 3.99Å; R466-L471 WeakPolarHBondContact CG-O 3.35Å; R466-L471 PolarHBondContact O-N 3.08Å
467	P	82.9	Confident	79.7	Confident	89 Å²	89	73.7 Å²	73.7	58%	0.578	36%	0.361	S	S	*	.	H	α-helix	trans	-63.4	-29.7	176	-23.4	34.8	0	0	0	114	E463	E463-P467 VanDerWaalsContact O-CD 3.31Å; E463-P467 WeakPolarHBondContact O-CD 3.48Å
468	I	80.8	Confident	78.2	Confident	43 Å²	43	74.3 Å²	74.3	22%	0.221	36%	0.364	C	S	.	.	H	α-helix	trans	-78.5	-40.8	-175.2	-52.2	175.4	0	0	0	110.4	I245 L431 L465 R466 N470	I245-I468 HydrophobicContact CD1-CD1 4.02Å; I245-I468 HydrophobicContact CD1-CG2 3.81Å; L431-I468 HydrophobicContact CD2-CD1 3.73Å; L465-I468 HydrophobicContact CD2-CD1 4.4Å; L465-I468 WeakPolarHBondContact O-CB 3.3Å; L465-I468 PolarHBondContact O-N 3.18Å; R466-I468 VanDerWaalsContact C-N 3.27Å; R466-I468 PolarHBondContact O-N 3.39Å; I468-N470 VanDerWaalsContact C-N 3.31Å
469	F	78.9	Confident	77.3	Confident	40 Å²	40	77.3 Å²	77.3	18%	0.175	38%	0.381	C	S	.	.	H	α-helix	trans	-82.9	-2.4	174	-70.3	-70	0	0	0	114.4	V238 I241 I242 L465 L471	V238-F469 HydrophobicContact CB-CE1 4.33Å; V238-F469 HydrophobicContact CG1-CE1 3.97Å; V238-F469 HydrophobicContact CG1-CZ 4.01Å; V238-F469 HydrophobicContact CG2-CE1 4.47Å; I241-F469 HydrophobicContact CB-CE1 3.61Å; I241-F469 HydrophobicContact CB-CZ 3.77Å; I241-F469 HydrophobicContact CD1-CD1 4.41Å; I241-F469 HydrophobicContact CD1-CE1 3.89Å; I241-F469 HydrophobicContact CG1-CE1 4.35Å; I241-F469 HydrophobicContact CG2-CD1 4.46Å; I241-F469 HydrophobicContact CG2-CE1 3.54Å; I241-F469 HydrophobicContact CG2-CE2 4.41Å; I241-F469 HydrophobicContact CG2-CZ 3.49Å; I241-F469 VanDerWaalsContact CG2-CZ 3.49Å; I242-F469 HydrophobicContact CG1-CE2 4.24Å; I242-F469 HydrophobicContact CG1-CZ 3.93Å; L465-F469 HydrophobicContact CB-CD2 4.01Å; L465-F469 HydrophobicContact CB-CE2 4.15Å; L465-F469 HydrophobicContact CD1-CE2 4.16Å; L465-F469 HydrophobicContact CD2-CD2 4.32Å; L465-F469 HydrophobicContact CD2-CE2 3.74Å; L465-F469 HydrophobicContact CG-CE2 4.24Å; L465-F469 WeakPolarHBondContact O-CD2 3.39Å; L465-F469 PolarHBondContact O-N 2.82Å; L465-F469 VanDerWaalsContact O-N 3.09Å; F469-L471 HydrophobicContact CB-CB 4.42Å; F469-L471 HydrophobicContact CB-CD1 3.62Å; F469-L471 HydrophobicContact CB-CG 3.66Å; F469-L471 HydrophobicContact CD2-CD1 4.38Å; F469-L471 HydrophobicContact CG-CD1 4.21Å; F469-L471 PolarHBondContact O-N 3.39Å
470	N	72.5	Confident	76.2	Confident	139 Å²	139	78.1 Å²	78.1	74%	0.743	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.1	24.4	-168.9	-55.4	-82.8	0	0	0	114	R466 I468 T472	R466-N470 CarbonylContact O-C 3.57Å; R466-N470 WeakPolarHBondContact O-CA 3.45Å; R466-N470 PolarHBondContact O-N 3.39Å; R466-N470 VanDerWaalsContact O-N 3.09Å; I468-N470 VanDerWaalsContact C-N 3.31Å; N470-T472 PolarHBondContact O-N 3.12Å; N470-T472 VanDerWaalsContact O-N 3.08Å
471	L	69.2	Low	75.3	Confident	71 Å²	71	85.4 Å²	85.4	37%	0.372	42%	0.423	S	S	.	.			trans	-73.6	96.2	-179.8	-74.1	166.6	0	0	0	111.2	R466 F469 S473	R466-L471 HydrophobicContact CB-CB 4.42Å; R466-L471 HydrophobicContact CG-CB 3.99Å; R466-L471 WeakPolarHBondContact CG-O 3.35Å; R466-L471 PolarHBondContact O-N 3.08Å; F469-L471 HydrophobicContact CB-CB 4.42Å; F469-L471 HydrophobicContact CB-CD1 3.62Å; F469-L471 HydrophobicContact CB-CG 3.66Å; F469-L471 HydrophobicContact CD2-CD1 4.38Å; F469-L471 HydrophobicContact CG-CD1 4.21Å; F469-L471 PolarHBondContact O-N 3.39Å; L471-S473 PolarHBondContact O-N 3.15Å; L471-S473 VanDerWaalsContact O-N 3.14Å
472	T	60.4	Low	74.5	Confident	64 Å²	64	89.2 Å²	89.2	39%	0.393	44%	0.441	S	S	.	.			trans	-66	111	-177.7	56.3	0	0	0	0	112.3	N470 L478	N470-T472 PolarHBondContact O-N 3.12Å; N470-T472 VanDerWaalsContact O-N 3.08Å; T472-L478 HydrophobicContact CG2-CD1 4.29Å
473	S	60.6	Low	73.7	Confident	65 Å²	65	88.5 Å²	88.5	46%	0.455	43%	0.432	S	S	.	.			trans	-74.4	-32.5	161.4	52.7	0	0	0	0	112.1	L471 Y475	L471-S473 PolarHBondContact O-N 3.15Å; L471-S473 VanDerWaalsContact O-N 3.14Å; S473-Y475 PolarHBondContact O-N 3.47Å
474	D	61.4	Low	73	Confident	91 Å²	91	89.1 Å²	89.1	49%	0.487	43%	0.433	S	S	.	.			trans	-88.4	91.2	-171	-87.7	38.5	0	0	0	111.6	R476 T477	D474-R476 PolarHBondContact O-N 3.48Å; D474-T477 HydrophobicContact CB-CG2 4.47Å; D474-T477 PolarHBondContact O-N 3.27Å; D474-T477 VanDerWaalsContact O-N 3.14Å; D474-T477 PolarHBondContact O-OG1 2.94Å
475	Y	62	Low	72.3	Confident	152 Å²	152	93.1 Å²	93.1	60%	0.596	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	-4.5	168.8	-63.1	-75.8	0	0	0	114.9	S473 R483	S473-Y475 PolarHBondContact O-N 3.47Å; Y475-R483 PolarHBondContact O-NE 3Å; Y475-R483 PolarHBondContact O-NH2 3.44Å
476	R	65.5	Low	71.7	Confident	223 Å²	223	94.3 Å²	94.3	84%	0.842	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-43	176.6	-68.4	-176.6	175.8	-172.5	0.6	113	D474 R483	D474-R476 PolarHBondContact O-N 3.48Å; R476-R483 PolarHBondContact O-NH2 3.02Å; R476-R483 VanDerWaalsContact O-NH2 3.09Å
477	T	68.8	Low	71.2	Confident	104 Å²	104	93.5 Å²	93.5	64%	0.638	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-36.3	-179	52.6	0	0	0	0	111.6	D474 T479	D474-T477 HydrophobicContact CB-CG2 4.47Å; D474-T477 PolarHBondContact O-N 3.27Å; D474-T477 VanDerWaalsContact O-N 3.14Å; D474-T477 PolarHBondContact O-OG1 2.94Å; T477-T479 PolarHBondContact O-N 3.4Å
478	L	64.3	Low	70.6	Confident	13 Å²	13	94.1 Å²	94.1	7%	0.068	45%	0.45	C	S	.	.	S	Bend	trans	-50.4	134.2	178.4	-155.1	65.4	0	0	0	111.4	T472 E482 R483 L486	T472-L478 HydrophobicContact CG2-CD1 4.29Å; L478-E482 HydrophobicContact CD1-CB 3.5Å; L478-E482 VanDerWaalsContact CD1-CB 3.5Å; L478-E482 HydrophobicContact CD1-CG 4.22Å; L478-E482 HydrophobicContact CD2-CB 4.36Å; L478-E482 HydrophobicContact CG-CB 3.62Å; L478-R483 HydrophobicContact CB-CG 4.18Å; L478-R483 HydrophobicContact CD2-CB 4.49Å; L478-R483 HydrophobicContact CD2-CG 3.78Å; L478-R483 HydrophobicContact CG-CG 4.1Å; L478-R483 PolarHBondContact O-NH1 3.38Å; L478-R483 PolarHBondContact O-NH2 3.08Å; L478-L486 HydrophobicContact CD2-CD1 3.49Å; L478-L486 VanDerWaalsContact CD2-CD1 3.49Å; L478-L486 HydrophobicContact CD2-CG 4.23Å
479	T	75	Confident	70.2	Confident	72 Å²	72	97.1 Å²	97.1	44%	0.442	46%	0.463	S	S	.	.			trans	-71.4	173.9	-179.4	64.3	0	0	0	0	111.8	T477 E481 E482 R483	T477-T479 PolarHBondContact O-N 3.4Å; T479-E481 PolarHBondContact O-N 2.89Å; T479-E481 PolarHBondContact OG1-N 3.18Å; T479-E482 WeakPolarHBondContact CA-OE2 3.34Å; T479-E482 WeakPolarHBondContact CB-OE2 3.38Å; T479-E482 WeakPolarHBondContact CG2-OE2 3.48Å; T479-E482 PolarHBondContact N-OE2 3.14Å; T479-E482 VanDerWaalsContact OG1-CD 3.27Å; T479-E482 WeakPolarHBondContact OG1-CG 3.29Å; T479-E482 PolarHBondContact OG1-N 2.92Å; T479-E482 VanDerWaalsContact OG1-N 3.15Å; T479-E482 PolarHBondContact OG1-OE2 3.09Å; T479-R483 WeakPolarHBondContact O-CB 3.17Å; T479-R483 VanDerWaalsContact O-CG 3.29Å; T479-R483 WeakPolarHBondContact O-CG 3.34Å; T479-R483 PolarHBondContact O-N 2.76Å; T479-R483 VanDerWaalsContact O-N 3.08Å; T479-R483 PolarHBondContact O-NH1 3.08Å
480	K	72.1	Confident	69.7	Low	185 Å²	185	100.6 Å²	100.6	80%	0.804	48%	0.48	S	S	*	.	H	α-helix	trans	-66.6	-27.6	173.7	-177.8	-176.2	169.1	-162.8	0	112.2	K484	K480-K484 PolarHBondContact O-N 2.83Å
481	E	74.6	Confident	69.5	Low	159 Å²	159	96.7 Å²	96.7	74%	0.743	46%	0.459	S	S	*	.	H	α-helix	trans	-82.6	-48.1	-178.3	-171.5	145.1	-138.1	0	0	110.9	T479 R483 K484 Q485	T479-E481 PolarHBondContact O-N 2.89Å; T479-E481 PolarHBondContact OG1-N 3.18Å; E481-R483 PolarHBondContact O-N 2.72Å; E481-K484 CarbonylContact O-C 3.51Å; E481-K484 WeakPolarHBondContact O-CA 3.13Å; E481-K484 VanDerWaalsContact O-CB 3.3Å; E481-K484 WeakPolarHBondContact O-CB 3.2Å; E481-K484 PolarHBondContact O-N 2.72Å; E481-Q485 PolarHBondContact O-N 3.03Å
482	E	76.1	Confident	69.2	Low	93 Å²	93	96.5 Å²	96.5	44%	0.435	46%	0.462	S	S	.	.	H	α-helix	trans	-61.1	-40	173	-65.8	155.3	141.8	0	0	112.1	L478 T479 K484 Q485 L486	L478-E482 HydrophobicContact CD1-CB 3.5Å; L478-E482 VanDerWaalsContact CD1-CB 3.5Å; L478-E482 HydrophobicContact CD1-CG 4.22Å; L478-E482 HydrophobicContact CD2-CB 4.36Å; L478-E482 HydrophobicContact CG-CB 3.62Å; T479-E482 WeakPolarHBondContact CA-OE2 3.34Å; T479-E482 WeakPolarHBondContact CB-OE2 3.38Å; T479-E482 WeakPolarHBondContact CG2-OE2 3.48Å; T479-E482 PolarHBondContact N-OE2 3.14Å; T479-E482 VanDerWaalsContact OG1-CD 3.27Å; T479-E482 WeakPolarHBondContact OG1-CG 3.29Å; T479-E482 PolarHBondContact OG1-N 2.92Å; T479-E482 VanDerWaalsContact OG1-N 3.15Å; T479-E482 PolarHBondContact OG1-OE2 3.09Å; E482-K484 PolarHBondContact O-N 2.73Å; E482-Q485 WeakPolarHBondContact O-CB 3.28Å; E482-Q485 PolarHBondContact O-N 3.02Å; E482-L486 PolarHBondContact O-N 3.36Å
483	R	72.9	Confident	69.2	Low	72 Å²	72	100 Å²	100	27%	0.272	47%	0.472	S	S	.	.	H	α-helix	trans	-58.9	-33.3	170.7	-79.4	-172.1	-158.6	90.5	-1.2	112.9	Y475 R476 L478 T479 E481 D487	Y475-R483 PolarHBondContact O-NE 3Å; Y475-R483 PolarHBondContact O-NH2 3.44Å; R476-R483 PolarHBondContact O-NH2 3.02Å; R476-R483 VanDerWaalsContact O-NH2 3.09Å; L478-R483 HydrophobicContact CB-CG 4.18Å; L478-R483 HydrophobicContact CD2-CB 4.49Å; L478-R483 HydrophobicContact CD2-CG 3.78Å; L478-R483 HydrophobicContact CG-CG 4.1Å; L478-R483 PolarHBondContact O-NH1 3.38Å; L478-R483 PolarHBondContact O-NH2 3.08Å; T479-R483 WeakPolarHBondContact O-CB 3.17Å; T479-R483 VanDerWaalsContact O-CG 3.29Å; T479-R483 WeakPolarHBondContact O-CG 3.34Å; T479-R483 PolarHBondContact O-N 2.76Å; T479-R483 VanDerWaalsContact O-N 3.08Å; T479-R483 PolarHBondContact O-NH1 3.08Å; E481-R483 PolarHBondContact O-N 2.72Å; R483-D487 WeakPolarHBondContact O-CB 3.28Å; R483-D487 PolarHBondContact O-N 3.22Å; R483-D487 VanDerWaalsContact O-N 3.08Å
484	K	73.5	Confident	69	Low	102 Å²	102	102.5 Å²	102.5	44%	0.443	47%	0.471	S	S	.	.	H	α-helix	trans	-77.2	-28.5	176.9	-168.1	-153.7	173.8	-144.3	0	110.8	K480 E481 E482 D487 Y488	K480-K484 PolarHBondContact O-N 2.83Å; E481-K484 CarbonylContact O-C 3.51Å; E481-K484 WeakPolarHBondContact O-CA 3.13Å; E481-K484 VanDerWaalsContact O-CB 3.3Å; E481-K484 WeakPolarHBondContact O-CB 3.2Å; E481-K484 PolarHBondContact O-N 2.72Å; E482-K484 PolarHBondContact O-N 2.73Å; K484-D487 WeakPolarHBondContact O-CB 3.21Å; K484-Y488 HydrophobicContact CD-CE2 3.95Å; K484-Y488 VanDerWaalsContact CE-OH 3.26Å; K484-Y488 WeakPolarHBondContact CE-OH 3.38Å; K484-Y488 HydrophobicContact CG-CD2 4.38Å; K484-Y488 HydrophobicContact CG-CE2 3.92Å; K484-Y488 PolarHBondContact NZ-OH 3.32Å; K484-Y488 WeakPolarHBondContact O-CD2 3.06Å; K484-Y488 PolarHBondContact O-N 2.67Å
485	Q	76.5	Confident	68.5	Low	95 Å²	95	109.5 Å²	109.5	44%	0.444	49%	0.491	S	S	.	.	H	α-helix	trans	-72.2	-47.8	174.9	-170.4	60.7	21.1	0	0	111.1	E481 E482 D487 Y488 E489	E481-Q485 PolarHBondContact O-N 3.03Å; E482-Q485 WeakPolarHBondContact O-CB 3.28Å; E482-Q485 PolarHBondContact O-N 3.02Å; Q485-D487 VanDerWaalsContact C-N 3.31Å; Q485-D487 PolarHBondContact O-N 2.71Å; Q485-Y488 CarbonylContact O-C 3.54Å; Q485-Y488 WeakPolarHBondContact O-CA 3.35Å; Q485-Y488 WeakPolarHBondContact O-CB 3.37Å; Q485-Y488 PolarHBondContact O-N 2.72Å; Q485-E489 WeakPolarHBondContact CG-OE1 3.32Å; Q485-E489 PolarHBondContact NE2-OE1 3.09Å; Q485-E489 PolarHBondContact O-N 3.21Å
486	L	73.9	Confident	67.6	Low	42 Å²	42	109.2 Å²	109.2	22%	0.22	50%	0.499	C	S	.	.	H	α-helix	trans	-60.9	-38.3	171.3	-64.7	-170.9	0	0	0	112.1	L478 E482 Y488 E489 H490	L478-L486 HydrophobicContact CD2-CD1 3.49Å; L478-L486 VanDerWaalsContact CD2-CD1 3.49Å; L478-L486 HydrophobicContact CD2-CG 4.23Å; E482-L486 PolarHBondContact O-N 3.36Å; L486-Y488 PolarHBondContact O-N 3.36Å; L486-E489 PolarHBondContact O-N 2.9Å; L486-H490 WeakPolarHBondContact O-CB 2.92Å; L486-H490 PolarHBondContact O-CD2 2.78Å; L486-H490 PolarHBondContact O-N 2.96Å
487	D	72.4	Confident	67	Low	50 Å²	50	102.2 Å²	102.2	27%	0.267	48%	0.478	S	S	.	.	H	α-helix	trans	-56.4	-33.5	170.5	-81.4	1.3	0	0	0	112.7	R483 K484 Q485 L491 R543	R483-D487 WeakPolarHBondContact O-CB 3.28Å; R483-D487 PolarHBondContact O-N 3.22Å; R483-D487 VanDerWaalsContact O-N 3.08Å; K484-D487 WeakPolarHBondContact O-CB 3.21Å; Q485-D487 VanDerWaalsContact C-N 3.31Å; Q485-D487 PolarHBondContact O-N 2.71Å; D487-L491 WeakPolarHBondContact O-CD1 3.33Å; D487-R543 IonicContact OD1-CZ 2.68Å; D487-R543 IonicContact OD1-NH2 2.87Å; D487-R543 PolarHBondContact OD1-NH2 3.41Å; D487-R543 IonicContact OD2-CZ 3.76Å; D487-R543 IonicContact OD2-NE 3.33Å; D487-R543 PolarHBondContact OD2-NE 3.32Å; D487-R543 IonicContact OD2-NH2 2.94Å; D487-R543 PolarHBondContact OD2-NH2 3.21Å
488	Y	70.5	Confident	66.3	Low	102 Å²	102	104.9 Å²	104.9	40%	0.4	49%	0.488	S	S	.	.	H	α-helix	trans	-82.1	-33.2	177.5	-77.7	-58.7	0	0	0	113	K484 Q485 L486 L491 I541	K484-Y488 HydrophobicContact CD-CE2 3.95Å; K484-Y488 VanDerWaalsContact CE-OH 3.26Å; K484-Y488 WeakPolarHBondContact CE-OH 3.38Å; K484-Y488 HydrophobicContact CG-CD2 4.38Å; K484-Y488 HydrophobicContact CG-CE2 3.92Å; K484-Y488 PolarHBondContact NZ-OH 3.32Å; K484-Y488 WeakPolarHBondContact O-CD2 3.06Å; K484-Y488 PolarHBondContact O-N 2.67Å; Q485-Y488 CarbonylContact O-C 3.54Å; Q485-Y488 WeakPolarHBondContact O-CA 3.35Å; Q485-Y488 WeakPolarHBondContact O-CB 3.37Å; Q485-Y488 PolarHBondContact O-N 2.72Å; L486-Y488 PolarHBondContact O-N 3.36Å; Y488-L491 WeakPolarHBondContact O-CB 3.44Å; Y488-L491 PolarHBondContact O-N 2.99Å; Y488-I541 HydrophobicContact CD1-CG2 3.74Å; Y488-I541 HydrophobicContact CE1-CG2 3.51Å
489	E	73.2	Confident	65.4	Low	105 Å²	105	112 Å²	112	49%	0.491	53%	0.526	S	S	.	.	H	α-helix	trans	-78.8	-35.2	-177.7	-74.4	162.1	175.3	0	0	111.4	Q485 L486 L491	Q485-E489 WeakPolarHBondContact CG-OE1 3.32Å; Q485-E489 PolarHBondContact NE2-OE1 3.09Å; Q485-E489 PolarHBondContact O-N 3.21Å; L486-E489 PolarHBondContact O-N 2.9Å; E489-L491 PolarHBondContact O-N 2.84Å
490	H	69.3	Low	64	Low	114 Å²	114	113.9 Å²	113.9	53%	0.528	53%	0.53	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	14.3	168.2	-60.6	-52.5	0	0	0	114.1	L486	L486-H490 WeakPolarHBondContact O-CB 2.92Å; L486-H490 PolarHBondContact O-CD2 2.78Å; L486-H490 PolarHBondContact O-N 2.96Å
491	L	66.6	Low	62.6	Low	56 Å²	56	108.9 Å²	108.9	29%	0.293	52%	0.523	S	S	.	.	S	Bend	trans	-65.9	127.3	159.8	-95.7	52	0	0	0	107.7	D487 Y488 E489 K493 I541	D487-L491 WeakPolarHBondContact O-CD1 3.33Å; Y488-L491 WeakPolarHBondContact O-CB 3.44Å; Y488-L491 PolarHBondContact O-N 2.99Å; E489-L491 PolarHBondContact O-N 2.84Å; L491-K493 PolarHBondContact O-N 3.28Å; L491-I541 HydrophobicContact CD1-CD1 4Å; L491-I541 HydrophobicContact CD1-CG1 3.93Å; L491-I541 HydrophobicContact CD1-CG2 4.45Å; L491-I541 HydrophobicContact CD2-CD1 3.8Å; L491-I541 HydrophobicContact CG-CD1 4.16Å
492	P	64.3	Low	61.4	Low	67 Å²	67	109.5 Å²	109.5	44%	0.435	52%	0.52	S	S	.	.			trans	-58.8	113.8	170	24.8	-33	0	0	0	108.1	R494	P492-R494 PolarHBondContact O-N 2.69Å
493	K	60.6	Low	59.9	Low	139 Å²	139	111.2 Å²	111.2	60%	0.604	53%	0.532	S	S	*	.			trans	-60.2	100.6	-172.2	-70.5	-169.7	178	-168.6	0	109.8	E232 L491 R495	E232-K493 IonicContact OE1-NZ 3.44Å; E232-K493 PolarHBondContact OE1-NZ 3.05Å; E232-K493 IonicContact OE2-NZ 3.21Å; E232-K493 PolarHBondContact OE2-NZ 3.42Å; L491-K493 PolarHBondContact O-N 3.28Å; K493-R495 PolarHBondContact O-N 2.92Å
494	R	55.3	Low	58.9	Low	117 Å²	117	116.2 Å²	116.2	44%	0.442	56%	0.558	S	S	.	*			trans	-64.3	90	-170.8	-67.5	-70.9	179.8	153.6	-0.9	110.6	P492 N496 N537 D539	P492-R494 PolarHBondContact O-N 2.69Å; R494-N496 PolarHBondContact O-N 3.24Å; R494-N537 PolarHBondContact NH2-O 2.99Å; R494-D539 IonicContact CZ-OD2 3.69Å; R494-D539 IonicContact NE-OD2 3.51Å; R494-D539 IonicContact NH2-OD1 2.67Å; R494-D539 IonicContact NH2-OD2 2.81Å; R494-D539 PolarHBondContact NH2-OD2 2.83Å
495	R	51.5	Low	57.8	Low	237 Å²	237	119 Å²	119	89%	0.894	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56	96.8	169	-71.3	176.5	170.9	162.6	-2.7	109.4	K493	K493-R495 PolarHBondContact O-N 2.92Å
496	N	43.7	Very low	56.6	Low	146 Å²	146	117.3 Å²	117.3	78%	0.781	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	56.9	64	164.4	-55.2	-28.2	0	0	0	117	R494	R494-N496 PolarHBondContact O-N 3.24Å
497	I	53	Low	55.8	Low	77 Å²	77	121.2 Å²	121.2	40%	0.395	58%	0.58	S	S	.	*			trans	-99.7	4	169.8	-78.4	-179.9	0	0	0	113.7	N499 E500	I497-N499 PolarHBondContact O-N 2.67Å; I497-E500 HydrophobicContact CG2-CB 4.34Å; I497-E500 PolarHBondContact O-N 3.2Å
498	D	52.4	Low	55.1	Low	160 Å²	160	124.6 Å²	124.6	86%	0.856	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60	-5.4	-179.8	-66.1	-34.1	0	0	0	116.1
499	N	45.9	Very low	54.5	Low	161 Å²	161	127.2 Å²	127.2	86%	0.861	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.9	-10.9	173.5	-81.2	-62.8	0	0	0	114.7	I497 A501	I497-N499 PolarHBondContact O-N 2.67Å; N499-A501 VanDerWaalsContact C-N 3.29Å; N499-A501 PolarHBondContact O-N 2.9Å
500	E	46.1	Very low	53.5	Low	113 Å²	113	124.4 Å²	124.4	53%	0.528	59%	0.594	S	S	.	*			trans	-78.2	86	168.1	-72.4	-141.4	111.6	0	0	109.8	I497 Y502	I497-E500 HydrophobicContact CG2-CB 4.34Å; I497-E500 PolarHBondContact O-N 3.2Å; E500-Y502 HydrophobicContact CB-CD2 3.83Å; E500-Y502 HydrophobicContact CB-CE2 3.51Å; E500-Y502 HydrophobicContact CG-CE2 4.25Å; E500-Y502 WeakPolarHBondContact O-CD2 3.36Å; E500-Y502 PolarHBondContact O-N 2.79Å; E500-Y502 WeakPolarHBondContact OE2-CE2 3.34Å; E500-Y502 PolarHBondContact OE2-OH 3.29Å
501	A	42.5	Very low	52.9	Low	80 Å²	80	125.6 Å²	125.6	66%	0.661	60%	0.604	S	S	*	*			trans	-64.9	79.9	168.2	0	0	0	0	0	110.3	N499 N503	N499-A501 VanDerWaalsContact C-N 3.29Å; N499-A501 PolarHBondContact O-N 2.9Å; A501-N503 PolarHBondContact O-N 2.75Å; A501-N503 PolarHBondContact O-ND2 2.9Å
502	Y	48.9	Very low	52.5	Low	171 Å²	171	129 Å²	129	67%	0.671	62%	0.622	S	S	*	*			trans	-63.1	77.2	166.6	-80.2	-80.6	0	0	0	109.2	E500 H504	E500-Y502 HydrophobicContact CB-CD2 3.83Å; E500-Y502 HydrophobicContact CB-CE2 3.51Å; E500-Y502 HydrophobicContact CG-CE2 4.25Å; E500-Y502 WeakPolarHBondContact O-CD2 3.36Å; E500-Y502 PolarHBondContact O-N 2.79Å; E500-Y502 WeakPolarHBondContact OE2-CE2 3.34Å; E500-Y502 PolarHBondContact OE2-OH 3.29Å; Y502-H504 PolarHBondContact O-N 2.91Å
503	N	45.9	Very low	52.1	Low	129 Å²	129	128.6 Å²	128.6	69%	0.69	63%	0.63	S	S	*	*			trans	-45.7	115.2	171.9	-82.3	-101	0	0	0	107.3	A501 R505	A501-N503 PolarHBondContact O-N 2.75Å; A501-N503 PolarHBondContact O-ND2 2.9Å; N503-R505 VanDerWaalsContact C-N 3.31Å; N503-R505 PolarHBondContact O-N 3.19Å
504	H	51	Low	51.8	Low	178 Å²	178	131 Å²	131	82%	0.824	64%	0.643	S	S	*	*			trans	-65.2	93.3	-172	-148.2	-70	0	0	0	108.4	Y502 D506	Y502-H504 PolarHBondContact O-N 2.91Å; H504-D506 PolarHBondContact O-N 2.87Å
505	R	51.1	Low	51.5	Low	159 Å²	159	127.7 Å²	127.7	60%	0.6	64%	0.641	S	S	*	*			trans	-70.8	84.7	-178.4	-72.1	-176	-172.2	-134	10.8	108.6	N503 I507 E510	N503-R505 VanDerWaalsContact C-N 3.31Å; N503-R505 PolarHBondContact O-N 3.19Å; R505-I507 VanDerWaalsContact C-N 3.33Å; R505-I507 PolarHBondContact O-N 3.27Å; R505-E510 WeakPolarHBondContact CD-OE1 3.32Å; R505-E510 IonicContact NH1-OE1 2.71Å; R505-E510 PolarHBondContact NH1-OE1 3.49Å
506	D	49.8	Very low	51.8	Low	60 Å²	60	127 Å²	127	32%	0.321	65%	0.645	S	S	.	*			trans	-56.4	99.9	165.6	-108.3	-25.7	0	0	0	107.3	H504 N508 R509 E510	H504-D506 PolarHBondContact O-N 2.87Å; D506-N508 PolarHBondContact O-N 2.89Å; D506-N508 VanDerWaalsContact O-N 3.09Å; D506-R509 HydrophobicContact CB-CB 3.76Å; D506-R509 WeakPolarHBondContact O-CA 3.24Å; D506-R509 WeakPolarHBondContact O-CB 3.21Å; D506-R509 PolarHBondContact O-N 3.39Å; D506-R509 IonicContact OD2-CZ 2.97Å; D506-R509 IonicContact OD2-NH1 2.78Å; D506-R509 PolarHBondContact OD2-NH1 3.5Å; D506-R509 IonicContact OD2-NH2 3.87Å; D506-R509 PolarHBondContact OD2-NH2 3.43Å; D506-E510 PolarHBondContact O-N 2.92Å
507	I	57.4	Low	52.5	Low	124 Å²	124	122.1 Å²	122.1	64%	0.636	63%	0.629	S	S	*	*	H	α-helix	trans	-55.4	-31.6	179.2	-49.3	173.1	0	0	0	110	R505 R509 E510 L511	R505-I507 VanDerWaalsContact C-N 3.33Å; R505-I507 PolarHBondContact O-N 3.27Å; I507-R509 VanDerWaalsContact C-N 3.34Å; I507-R509 PolarHBondContact O-N 2.93Å; I507-E510 PolarHBondContact O-N 3.31Å; I507-L511 PolarHBondContact O-N 2.89Å
508	N	57.8	Low	52.8	Low	122 Å²	122	123 Å²	123	65%	0.652	63%	0.634	S	S	*	*	H	α-helix	trans	-65.9	-29.8	173.4	-59.8	-62	0	0	0	113.7	D506	D506-N508 PolarHBondContact O-N 2.89Å; D506-N508 VanDerWaalsContact O-N 3.09Å
509	R	57.8	Low	53.5	Low	156 Å²	156	118.5 Å²	118.5	59%	0.589	61%	0.61	S	S	*	*	H	α-helix	trans	-87.2	-29.1	177.6	-164.6	111	67.9	-109.9	-12.5	112.1	D506 I507 L511 D512	D506-R509 HydrophobicContact CB-CB 3.76Å; D506-R509 WeakPolarHBondContact O-CA 3.24Å; D506-R509 WeakPolarHBondContact O-CB 3.21Å; D506-R509 PolarHBondContact O-N 3.39Å; D506-R509 IonicContact OD2-CZ 2.97Å; D506-R509 IonicContact OD2-NH1 2.78Å; D506-R509 PolarHBondContact OD2-NH1 3.5Å; D506-R509 IonicContact OD2-NH2 3.87Å; D506-R509 PolarHBondContact OD2-NH2 3.43Å; I507-R509 VanDerWaalsContact C-N 3.34Å; I507-R509 PolarHBondContact O-N 2.93Å; R509-L511 PolarHBondContact O-N 2.77Å; R509-D512 PolarHBondContact O-N 2.89Å
510	E	53.2	Low	54.7	Low	47 Å²	47	118.1 Å²	118.1	22%	0.22	60%	0.596	C	S	.	*	H	α-helix	trans	-68.1	-22.5	173	-73.6	-176.5	132.2	0	0	112.4	R505 D506 I507 L518	R505-E510 WeakPolarHBondContact CD-OE1 3.32Å; R505-E510 IonicContact NH1-OE1 2.71Å; R505-E510 PolarHBondContact NH1-OE1 3.49Å; D506-E510 PolarHBondContact O-N 2.92Å; I507-E510 PolarHBondContact O-N 3.31Å; E510-L518 HydrophobicContact CB-CD1 4.21Å
511	L	57	Low	56.1	Low	139 Å²	139	117.6 Å²	117.6	73%	0.728	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.1	-25.3	172.5	-85.1	161.7	0	0	0	114.7	I507 R509 G513	I507-L511 PolarHBondContact O-N 2.89Å; R509-L511 PolarHBondContact O-N 2.77Å; L511-G513 VanDerWaalsContact C-N 3.27Å; L511-G513 PolarHBondContact O-N 2.99Å
512	D	58.5	Low	57.6	Low	127 Å²	127	117.4 Å²	117.4	68%	0.679	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.9	3	-177.1	-74.2	-30	0	0	0	113.6	R509 E514	R509-D512 PolarHBondContact O-N 2.89Å; D512-E514 VanDerWaalsContact C-N 3.3Å; D512-E514 PolarHBondContact O-N 2.78Å; D512-E514 VanDerWaalsContact O-N 3.13Å
513	G	54.9	Low	59.1	Low	59 Å²	59	111.6 Å²	111.6	61%	0.608	59%	0.589	S	S	*	*	S	Bend	trans	77.1	-6.8	163.3	0	0	0	0	0	117.9	L511	L511-G513 VanDerWaalsContact C-N 3.27Å; L511-G513 PolarHBondContact O-N 2.99Å
514	E	54.9	Low	60.5	Low	188 Å²	188	111.3 Å²	111.3	88%	0.879	59%	0.594	S	S	*	*			trans	-90.3	-6.5	-178	-62.6	-167	148.9	0	0	114.6	D512	D512-E514 VanDerWaalsContact C-N 3.3Å; D512-E514 PolarHBondContact O-N 2.78Å; D512-E514 VanDerWaalsContact O-N 3.13Å
515	A	49	Very low	61.7	Low	48 Å²	48	105.4 Å²	105.4	40%	0.397	58%	0.581	S	S	.	*			trans	-86.6	124.7	-174.2	0	0	0	0	0	113.7	G517	A515-G517 PolarHBondContact O-N 3.26Å
516	K	56.3	Low	63.1	Low	222 Å²	222	102.6 Å²	102.6	97%	0.965	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.5	14.4	-177.3	-58.5	177.8	-179.8	175.5	0	115.8
517	G	59.4	Low	64.3	Low	44 Å²	44	103.3 Å²	103.3	45%	0.454	58%	0.577	S	S	.	*	T	Hydrogen-bonded Turn	trans	-96.5	-22	-176	0	0	0	0	0	114.8	A515	A515-G517 PolarHBondContact O-N 3.26Å
518	L	58.9	Low	65.3	Low	96 Å²	96	104.3 Å²	104.3	50%	0.503	58%	0.584	S	S	.	*			trans	-96.4	101.4	175.4	-69.7	169.7	0	0	0	109.2	E510	E510-L518 HydrophobicContact CB-CD1 4.21Å
519	L	66.7	Low	66.4	Low	66 Å²	66	108.5 Å²	108.5	35%	0.346	59%	0.59	S	S	.	*			trans	-53.8	144.4	159.7	-61.5	169.7	0	0	0	108.3	D523 W526	L519-D523 HydrophobicContact CB-CB 4.34Å; L519-D523 HydrophobicContact CD2-CB 4.06Å; L519-W526 HydrophobicContact CB-CB 4.37Å; L519-W526 HydrophobicContact CB-CE3 4.06Å; L519-W526 WeakPolarHBondContact O-CZ3 3.43Å
520	R	71.8	Confident	67.4	Low	153 Å²	153	106 Å²	106	58%	0.577	60%	0.603	S	S	*	*			trans	-111.7	164.2	176.8	-66.8	158.3	-65.7	-150.5	1.1	111	G522 D523 W526	R520-G522 PolarHBondContact O-N 2.84Å; R520-D523 WeakPolarHBondContact CB-OD2 3.36Å; R520-D523 IonicContact CZ-OD2 3.56Å; R520-D523 PolarHBondContact N-OD2 3.04Å; R520-D523 IonicContact NE-OD2 2.7Å; R520-D523 PolarHBondContact NE-OD2 2.81Å; R520-D523 IonicContact NH2-OD1 3.32Å; R520-D523 IonicContact NH2-OD2 2.66Å; R520-D523 PolarHBondContact NH2-OD2 2.68Å; R520-D523 PolarHBondContact O-N 3.48Å; R520-W526 VanDerWaalsContact O-CB 3.32Å; R520-W526 WeakPolarHBondContact O-CB 3.44Å
521	P	74.9	Confident	68.4	Low	102 Å²	102	112.3 Å²	112.3	66%	0.662	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.5	104.6	169.6	-26	33.7	0	0	0	112.1	W526	P521-W526 HydrophobicContact CG-CD2 4.49Å; P521-W526 HydrophobicContact CG-CH2 4.24Å; P521-W526 HydrophobicContact CG-CZ2 3.66Å
522	G	75	Confident	69.4	Low	75 Å²	75	111.5 Å²	111.5	77%	0.773	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	114.2	-14.9	-177	0	0	0	0	0	115.7	R520	R520-G522 PolarHBondContact O-N 2.84Å
523	D	80	Confident	70.4	Confident	49 Å²	49	110.9 Å²	110.9	26%	0.262	63%	0.628	S	S	.	*	S	Bend	trans	-73.6	140.1	171.8	-72.4	-43.5	0	0	0	110.1	L519 R520 G525 W526	L519-D523 HydrophobicContact CB-CB 4.34Å; L519-D523 HydrophobicContact CD2-CB 4.06Å; R520-D523 WeakPolarHBondContact CB-OD2 3.36Å; R520-D523 IonicContact CZ-OD2 3.56Å; R520-D523 PolarHBondContact N-OD2 3.04Å; R520-D523 IonicContact NE-OD2 2.7Å; R520-D523 PolarHBondContact NE-OD2 2.81Å; R520-D523 IonicContact NH2-OD1 3.32Å; R520-D523 IonicContact NH2-OD2 2.66Å; R520-D523 PolarHBondContact NH2-OD2 2.68Å; R520-D523 PolarHBondContact O-N 3.48Å; D523-G525 PolarHBondContact O-N 3.32Å; D523-W526 WeakPolarHBondContact O-CB 3.41Å; D523-W526 PolarHBondContact O-N 3.5Å
524	P	75.1	Confident	71.5	Confident	123 Å²	123	115.7 Å²	115.7	80%	0.799	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.4	131.7	177.6	-27.4	35.7	0	0	0	112.8	W526	P524-W526 VanDerWaalsContact C-N 3.32Å
525	G	76.1	Confident	72.5	Confident	54 Å²	54	111.8 Å²	111.8	56%	0.557	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	83	-0.1	-174.8	0	0	0	0	0	115	D523 R531	D523-G525 PolarHBondContact O-N 3.32Å; G525-R531 PolarHBondContact O-NH2 3.09Å
526	W	80	Confident	73.7	Confident	101 Å²	101	113 Å²	113	38%	0.383	63%	0.631	S	S	.	*			trans	-65.1	132.1	165	173.2	-92.8	0	0	0	110.4	L519 R520 P521 D523 P524 N528	L519-W526 HydrophobicContact CB-CB 4.37Å; L519-W526 HydrophobicContact CB-CE3 4.06Å; L519-W526 WeakPolarHBondContact O-CZ3 3.43Å; R520-W526 VanDerWaalsContact O-CB 3.32Å; R520-W526 WeakPolarHBondContact O-CB 3.44Å; P521-W526 HydrophobicContact CG-CD2 4.49Å; P521-W526 HydrophobicContact CG-CH2 4.24Å; P521-W526 HydrophobicContact CG-CZ2 3.66Å; D523-W526 WeakPolarHBondContact O-CB 3.41Å; D523-W526 PolarHBondContact O-N 3.5Å; P524-W526 VanDerWaalsContact C-N 3.32Å; W526-N528 PolarHBondContact NE1-OD1 3.42Å
527	V	76.1	Confident	74.2	Confident	75 Å²	75	108 Å²	108	46%	0.455	62%	0.616	S	S	.	*			trans	-116.6	123.3	177.4	-176.2	0	0	0	0	107.9	R529	V527-R529 HydrophobicContact CG1-CB 4.07Å; V527-R529 HydrophobicContact CG1-CG 4.5Å; V527-R529 PolarHBondContact O-N 3.48Å
528	N	78.8	Confident	74.8	Confident	144 Å²	144	112.9 Å²	112.9	77%	0.77	62%	0.624	S	S	*	*	S	Bend	trans	-68.6	12.1	178.7	-80.3	-26.6	0	0	0	114.5	W526	W526-N528 PolarHBondContact NE1-OD1 3.42Å
529	R	80.9	Confident	75.2	Confident	210 Å²	210	112.3 Å²	112.3	79%	0.792	62%	0.621	S	S	*	*	S	Bend	trans	-120.3	142.9	178.8	-59.9	178.5	-178.1	-95.4	3.5	107.8	V527 R531	V527-R529 HydrophobicContact CG1-CB 4.07Å; V527-R529 HydrophobicContact CG1-CG 4.5Å; V527-R529 PolarHBondContact O-N 3.48Å; R529-R531 PolarHBondContact O-N 2.76Å
530	A	78.4	Confident	75.3	Confident	104 Å²	104	118.9 Å²	118.9	86%	0.86	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-56.8	134.6	171.4	0	0	0	0	0	109.7
531	R	74.4	Confident	74.9	Confident	180 Å²	180	114.5 Å²	114.5	68%	0.679	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-74.9	136.5	170.1	-68	-179	179.2	161.6	0.7	108.2	G525 R529	G525-R531 PolarHBondContact O-NH2 3.09Å; R529-R531 PolarHBondContact O-N 2.76Å
532	V	77.6	Confident	74.8	Confident	121 Å²	121	116 Å²	116	73%	0.733	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-59.6	127.9	172.7	-177.7	0	0	0	0	108.1	Q534	V532-Q534 PolarHBondContact O-N 3.37Å
533	P	79.7	Confident	74.6	Confident	114 Å²	114	119.2 Å²	119.2	74%	0.74	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-56.4	130	174	-23.9	34.2	0	0	0	110.1
534	Q	78	Confident	74.6	Confident	160 Å²	160	122.9 Å²	122.9	75%	0.748	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-69.4	142	168.7	-65.3	-62.8	-84.6	0	0	109	V532 S536	V532-Q534 PolarHBondContact O-N 3.37Å; Q534-S536 PolarHBondContact O-N 3.13Å
535	P	74.9	Confident	74.7	Confident	106 Å²	106	125.8 Å²	125.8	69%	0.688	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-49.7	133.4	169	-27.4	35.9	0	0	0	110.7	N537	P535-N537 PolarHBondContact O-N 3.38Å
536	S	74.4	Confident	74.8	Confident	73 Å²	73	132 Å²	132	51%	0.51	66%	0.66	S	S	.	*			trans	-85.2	96.9	-177.2	174.8	0	0	0	0	109.3	Q534 K538	Q534-S536 PolarHBondContact O-N 3.13Å; S536-K538 PolarHBondContact O-N 2.94Å; S536-K538 WeakPolarHBondContact OG-CD 3.29Å; S536-K538 WeakPolarHBondContact OG-CG 3.41Å
537	N	68.3	Low	74.7	Confident	119 Å²	119	138.4 Å²	138.4	64%	0.636	68%	0.684	S	S	*	*			trans	-67.1	50.7	174.7	-63.8	-7.6	0	0	0	112.8	R494 P535	R494-N537 PolarHBondContact NH2-O 2.99Å; P535-N537 PolarHBondContact O-N 3.38Å
538	K	71.6	Confident	74.4	Confident	145 Å²	145	139.4 Å²	139.4	63%	0.63	69%	0.69	S	S	*	*			trans	-122	109.7	-175.8	-65	179.5	-167.4	163	0	109.8	S536 Y540	S536-K538 PolarHBondContact O-N 2.94Å; S536-K538 WeakPolarHBondContact OG-CD 3.29Å; S536-K538 WeakPolarHBondContact OG-CG 3.41Å; K538-Y540 WeakPolarHBondContact O-CD2 3.16Å
539	D	65.7	Low	73.4	Confident	84 Å²	84	143.4 Å²	143.4	45%	0.449	69%	0.694	S	S	.	*			trans	-86.5	130	-176.1	-45.5	-51.2	0	0	0	108.9	R494 I541	R494-D539 IonicContact CZ-OD2 3.69Å; R494-D539 IonicContact NE-OD2 3.51Å; R494-D539 IonicContact NH2-OD1 2.67Å; R494-D539 IonicContact NH2-OD2 2.81Å; R494-D539 PolarHBondContact NH2-OD2 2.83Å; D539-I541 VanDerWaalsContact C-N 3.31Å; D539-I541 PolarHBondContact O-N 3.25Å
540	Y	68.8	Low	72.4	Confident	205 Å²	205	140.4 Å²	140.4	80%	0.804	69%	0.689	S	S	*	*			trans	-88.5	59.9	-167	-77.7	-84.7	0	0	0	113.5	K538 V542	K538-Y540 WeakPolarHBondContact O-CD2 3.16Å; Y540-V542 PolarHBondContact O-N 2.97Å
541	I	65.1	Low	70.8	Confident	61 Å²	61	141.8 Å²	141.8	31%	0.313	68%	0.682	S	S	.	*			trans	-59.1	-31.5	-176.5	-40.6	163.9	0	0	0	112.7	Y488 L491 D539 R543	Y488-I541 HydrophobicContact CD1-CG2 3.74Å; Y488-I541 HydrophobicContact CE1-CG2 3.51Å; L491-I541 HydrophobicContact CD1-CD1 4Å; L491-I541 HydrophobicContact CD1-CG1 3.93Å; L491-I541 HydrophobicContact CD1-CG2 4.45Å; L491-I541 HydrophobicContact CD2-CD1 3.8Å; L491-I541 HydrophobicContact CG-CD1 4.16Å; D539-I541 VanDerWaalsContact C-N 3.31Å; D539-I541 PolarHBondContact O-N 3.25Å; I541-R543 PolarHBondContact O-N 3.12Å
542	V	71.7	Confident	69.7	Low	134 Å²	134	138.6 Å²	138.6	81%	0.812	69%	0.694	S	S	*	*	S	Bend	trans	-82.3	83	-177.9	-173.5	0	0	0	0	110.6	Y540	Y540-V542 PolarHBondContact O-N 2.97Å
543	R	71.2	Confident	68.4	Low	142 Å²	142	138.2 Å²	138.2	54%	0.536	69%	0.692	S	S	.	*	P	Polyproline II helix	trans	-49.5	126.5	171.7	-63.4	-172.2	-178	-140.5	2.2	110.5	D487 I541 K545	D487-R543 IonicContact OD1-CZ 2.68Å; D487-R543 IonicContact OD1-NH2 2.87Å; D487-R543 PolarHBondContact OD1-NH2 3.41Å; D487-R543 IonicContact OD2-CZ 3.76Å; D487-R543 IonicContact OD2-NE 3.33Å; D487-R543 PolarHBondContact OD2-NE 3.32Å; D487-R543 IonicContact OD2-NH2 2.94Å; D487-R543 PolarHBondContact OD2-NH2 3.21Å; I541-R543 PolarHBondContact O-N 3.12Å; R543-K545 PolarHBondContact O-N 3.42Å
544	P	79.8	Confident	66.6	Low	126 Å²	126	136.4 Å²	136.4	82%	0.818	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-66.6	124.2	-173.7	25	-33.7	0	0	0	111.7	W546	P544-W546 PolarHBondContact O-N 3.04Å
545	K	77.7	Confident	65	Low	183 Å²	183	135.9 Å²	135.9	80%	0.796	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-61.5	121.5	175.8	-65.7	-165.1	178.3	-166.9	0	110	R543 R547	R543-K545 PolarHBondContact O-N 3.42Å; K545-R547 WeakPolarHBondContact O-CG 3.45Å; K545-R547 PolarHBondContact O-N 3.05Å
546	W	78.3	Confident	63.7	Low	186 Å²	186	138.2 Å²	138.2	71%	0.705	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-59	130.8	176	-166.5	21.2	0	0	0	109.7	P544 V548 E550	P544-W546 PolarHBondContact O-N 3.04Å; W546-V548 HydrophobicContact CZ2-CB 4.3Å; W546-E550 HydrophobicContact CH2-CG 4.47Å
547	R	77.3	Confident	62.4	Low	235 Å²	235	141.3 Å²	141.3	89%	0.887	71%	0.714	S	S	*	*			trans	-116.4	12.7	-177.3	-64.6	-155	-66.4	-129.4	-2	114.2	K545	K545-R547 WeakPolarHBondContact O-CG 3.45Å; K545-R547 PolarHBondContact O-N 3.05Å
548	V	69.2	Low	61.5	Low	95 Å²	95	143.1 Å²	143.1	58%	0.576	72%	0.724	S	S	*	*			trans	-77.5	122.5	160.9	-178.9	0	0	0	0	106.2	W546 E550	W546-V548 HydrophobicContact CZ2-CB 4.3Å; V548-E550 PolarHBondContact O-N 3.39Å
549	R	59	Low	60.4	Low	229 Å²	229	145.2 Å²	145.2	86%	0.864	74%	0.736	S	S	*	*			trans	-75.6	113.9	162.9	-70	-178.7	175.5	-169.7	-5.9	106.8
550	E	58.7	Low	59.4	Low	146 Å²	146	150.6 Å²	150.6	68%	0.682	76%	0.758	S	S	*	*	S	Bend	trans	-59.2	158.1	150.4	-64.2	-176	134	0	0	108.2	W546 V548	W546-E550 HydrophobicContact CH2-CG 4.47Å; V548-E550 PolarHBondContact O-N 3.39Å
551	N	45.7	Very low	58.1	Low	134 Å²	134	144.3 Å²	144.3	72%	0.717	76%	0.756	S	S	*	*			trans	71.3	71.1	-163.8	-53.9	-13.5	0	0	0	114.3
552	A	52.1	Low	56.9	Low	113 Å²	113	149 Å²	149	93%	0.934	78%	0.781	S	S	*	*			trans	-80.1	-3	148.9	0	0	0	0	0	112.4
553	T	49.7	Very low	55.5	Low	112 Å²	112	150.2 Å²	150.2	69%	0.687	78%	0.784	S	S	*	*	S	Bend	trans	-84.7	107.2	161.9	42.4	0	0	0	0	108.1
554	G	41.9	Very low	54.2	Low	76 Å²	76	149.4 Å²	149.4	78%	0.784	79%	0.79	S	S	*	*			trans	-76.6	129.7	-173.5	0	0	0	0	0	113.3
555	D	44.8	Very low	52.4	Low	149 Å²	149	152.4 Å²	152.4	80%	0.797	79%	0.793	S	S	*	*			trans	-128.6	129.8	136.6	-150.5	-18.9	0	0	0	106.7
556	D	46.3	Very low	50.6	Low	155 Å²	155	148.7 Å²	148.7	83%	0.829	79%	0.786	S	S	*	*			trans	-104.5	73.1	-174.7	-85.9	-59.1	0	0	0	109.2
557	N	46.4	Very low	48.7	Very low	139 Å²	139	148.2 Å²	148.2	74%	0.743	79%	0.791	S	S	*	*			trans	-158.9	-174.4	167.2	-83.6	-55.7	0	0	0	110.2
558	D	49.5	Very low	47.1	Very low	156 Å²	156	146.3 Å²	146.3	83%	0.834	79%	0.792	S	S	*	*			trans	61.5	76.5	179.4	-55.8	-6.7	0	0	0	112.5
559	E	49.9	Very low	45.6	Very low	190 Å²	190	147.5 Å²	147.5	89%	0.888	81%	0.805	S	S	*	*				73.9	141.9	62.5	-156	166.1	-113.7	0	0	113.6
560	E	44.9	Very low	44.7	Very low	197 Å²	197	146.1 Å²	146.1	92%	0.921	81%	0.808	S	S	*	*			trans	-56.2	126.1	-154.2	-56.1	178.9	150.3	0	0	116.2
561	G	41.5	Very low	43.8	Very low	73 Å²	73	144.7 Å²	144.7	75%	0.753	82%	0.815	S	S	*	*			trans	-146.8	103	173.4	0	0	0	0	0	112.9
562	N	38.5	Very low	43.7	Very low	159 Å²	159	146.9 Å²	146.9	85%	0.85	82%	0.824	S	S	*	*			trans	12.8	122.7	166	-60.6	-26.8	0	0	0	119.7
563	D	43.3	Very low	43.1	Very low	160 Å²	160	146.4 Å²	146.4	86%	0.856	81%	0.814	S	S	*	*				-159.2	132.8	123.2	-116.3	-5.4	0	0	0	112.2
564	D	42.6	Very low	42.6	Very low	125 Å²	125	152.1 Å²	152.1	67%	0.668	82%	0.823	S	S	*	*			trans	-42.3	124.1	-169.7	-179.6	30.3	0	0	0	117.6	T566	D564-T566 WeakPolarHBondContact OD1-CB 3.32Å; D564-T566 PolarHBondContact OD1-N 2.96Å; D564-T566 PolarHBondContact OD1-OG1 3.07Å
565	Q	42.3	Very low	42.7	Very low	189 Å²	189	157.8 Å²	157.8	88%	0.883	83%	0.826	S	S	*	*			trans	-141.2	65.3	152.1	-71.5	-164.2	19	0	0	110.3
566	T	40.9	Very low	42.6	Very low	105 Å²	105	160 Å²	160	64%	0.644	83%	0.832	S	S	*	*			trans	-76.9	130	-180	-50.8	0	0	0	0	111.7	D564	D564-T566 WeakPolarHBondContact OD1-CB 3.32Å; D564-T566 PolarHBondContact OD1-N 2.96Å; D564-T566 PolarHBondContact OD1-OG1 3.07Å
567	E	39.2	Very low	42.4	Very low	175 Å²	175	164.3 Å²	164.3	82%	0.818	84%	0.836	S	S	*	*	S	Bend	trans	53.4	74.3	160.8	-68	-177.3	-160	0	0	120.5
568	Q	42.3	Very low	42.2	Very low	195 Å²	195	167.2 Å²	167.2	91%	0.911	84%	0.842	S	S	*	*			trans	-154.5	59.1	145.4	-125.4	171.1	101.8	0	0	114.9
569	S	37.7	Very low	41.9	Very low	120 Å²	120	165.1 Å²	165.1	84%	0.839	84%	0.839	S	S	*	*			trans	-154.8	48.5	-177.8	-81.4	0	0	0	0	116.4
570	Q	41.3	Very low	41.4	Very low	201 Å²	201	167.4 Å²	167.4	94%	0.939	84%	0.84	S	S	*	*			trans	-137.3	43.1	-179.8	-69.4	-156.2	48	0	0	117.8
571	S	39.7	Very low	41.3	Very low	116 Å²	116	164.4 Å²	164.4	81%	0.811	84%	0.835	S	S	*	*			trans	-158.2	60.8	171.2	58.2	0	0	0	0	119.4
572	I	42.5	Very low	41.2	Very low	180 Å²	180	167.1 Å²	167.1	92%	0.923	84%	0.843	S	S	*	*			trans	-145.9	97.8	146.5	23.6	172.4	0	0	0	111.8
573	S	40.5	Very low	41.1	Very low	103 Å²	103	163 Å²	163	72%	0.72	84%	0.837	S	S	*	*			trans	-90.2	117.2	-171.9	-167.4	0	0	0	0	113.7
574	R	38.5	Very low	40.9	Very low	231 Å²	231	166.2 Å²	166.2	87%	0.872	84%	0.844	S	S	*	*			trans	40	89.8	139.6	-58.8	173.5	177.7	164.7	0.3	117.2
575	K	44.9	Very low	40.9	Very low	195 Å²	195	163.6 Å²	163.6	85%	0.848	85%	0.847	S	S	*	*			trans	-154.1	105.5	151.9	-104.3	154.6	-172.1	173.6	0	111.3
576	H	41.9	Very low	41.1	Very low	197 Å²	197	159.6 Å²	159.6	91%	0.912	85%	0.846	S	S	*	*				-171.3	132	122.3	-104	-77.4	0	0	0	109.1
577	R	42.5	Very low	41.9	Very low	244 Å²	244	158.7 Å²	158.7	92%	0.921	84%	0.841	S	S	*	*			trans	-94.5	146.5	-176.3	-66.3	171.9	89.7	161.3	3.6	110.3	S579	R577-S579 PolarHBondContact O-N 3.49Å
578	K	42.4	Very low	43.5	Very low	201 Å²	201	153.2 Å²	153.2	87%	0.874	82%	0.821	S	S	*	*			trans	-58.2	127.1	173.9	-66.7	167.8	177.7	169	0	111.1
579	S	42.8	Very low	44.9	Very low	111 Å²	111	154.7 Å²	154.7	78%	0.776	82%	0.819	S	S	*	*			trans	-105.6	135.8	147.1	50.7	0	0	0	0	108	R577	R577-S579 PolarHBondContact O-N 3.49Å
580	R	39.8	Very low	46.8	Very low	239 Å²	239	154.5 Å²	154.5	90%	0.902	81%	0.807	S	S	*	*			trans	-112.1	109	177.2	-69.7	178	70.8	160.4	2.5	108.6
581	T	42.8	Very low	48.4	Very low	133 Å²	133	149.3 Å²	149.3	82%	0.816	78%	0.783	S	S	*	*			trans	-129.3	122.3	168	48.7	0	0	0	0	108.7
582	S	37.8	Very low	50.2	Low	130 Å²	130	146.6 Å²	146.6	91%	0.909	76%	0.764	S	S	*	*			trans	-74.4	124.6	179.9	48.3	0	0	0	0	111.3
583	G	38.1	Very low	51.9	Low	72 Å²	72	143.9 Å²	143.9	74%	0.742	75%	0.747	S	S	*	*			trans	-147	131.6	170.5	0	0	0	0	0	110.4
584	F	37.9	Very low	53.9	Low	229 Å²	229	144 Å²	144	100%	1.004	74%	0.739	S	S	*	*			trans	-74.9	136.6	170	-83.4	-120.2	0	0	0	109
585	G	43.5	Very low	55.9	Low	70 Å²	70	140 Å²	140	72%	0.722	72%	0.723	S	S	*	*			trans	-173.4	125.4	175.4	0	0	0	0	0	110.8	T587	G585-T587 PolarHBondContact O-N 2.87Å
586	A	45.5	Very low	57.6	Low	105 Å²	105	135.3 Å²	135.3	87%	0.868	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-52.4	122.5	-171.5	0	0	0	0	0	113.9
587	T	57.9	Low	59.3	Low	86 Å²	86	130.9 Å²	130.9	53%	0.528	69%	0.69	S	S	.	*	P	Polyproline II helix	trans	-61.5	135.6	160	53.2	0	0	0	0	109	G585 E591	G585-T587 PolarHBondContact O-N 2.87Å; T587-E591 WeakPolarHBondContact CA-OE2 3.27Å; T587-E591 WeakPolarHBondContact CB-OE2 3.34Å
588	S	73.4	Confident	61.1	Low	59 Å²	59	121.8 Å²	121.8	41%	0.413	66%	0.664	S	S	.	*	P	Polyproline II helix	trans	-59.7	151.5	-176.7	179.5	0	0	0	0	112	I590 E591 S592	S588-I590 PolarHBondContact O-N 2.88Å; S588-I590 VanDerWaalsContact O-N 3.11Å; S588-I590 PolarHBondContact OG-N 3.11Å; S588-E591 PolarHBondContact N-OE2 3.3Å; S588-E591 PolarHBondContact O-N 2.99Å; S588-S592 PolarHBondContact O-N 3.42Å; S588-S592 VanDerWaalsContact O-N 3.1Å
589	R	72.4	Confident	62.8	Low	226 Å²	226	116 Å²	116	85%	0.853	64%	0.642	S	S	*	*	H	α-helix	trans	-53.8	-30.6	171.1	-173	174.8	178.4	132.1	-2.2	111.5	H593	R589-H593 WeakPolarHBondContact O-CB 3.38Å; R589-H593 PolarHBondContact O-N 3.48Å; R589-H593 VanDerWaalsContact O-N 3.09Å
590	I	76.3	Confident	64.4	Low	116 Å²	116	114.4 Å²	114.4	60%	0.595	63%	0.632	S	S	*	*	H	α-helix	trans	-69.6	-45.5	174.5	-76.3	169.4	0	0	0	112.1	S588 S592 H593 I594	S588-I590 PolarHBondContact O-N 2.88Å; S588-I590 VanDerWaalsContact O-N 3.11Å; S588-I590 PolarHBondContact OG-N 3.11Å; I590-S592 VanDerWaalsContact C-N 3.3Å; I590-S592 PolarHBondContact O-N 2.71Å; I590-H593 WeakPolarHBondContact O-CB 3.49Å; I590-H593 PolarHBondContact O-N 2.96Å; I590-I594 HydrophobicContact CG2-CD1 3.64Å; I590-I594 HydrophobicContact CG2-CG1 4.34Å; I590-I594 WeakPolarHBondContact O-CG1 3.46Å; I590-I594 PolarHBondContact O-N 3.28Å
591	E	74.7	Confident	65.9	Low	93 Å²	93	105.6 Å²	105.6	44%	0.435	61%	0.61	S	S	.	*	H	α-helix	trans	-62.6	-38.2	177.1	-65.9	177.8	98.5	0	0	112	T587 S588 H593 R595	T587-E591 WeakPolarHBondContact CA-OE2 3.27Å; T587-E591 WeakPolarHBondContact CB-OE2 3.34Å; S588-E591 PolarHBondContact N-OE2 3.3Å; S588-E591 PolarHBondContact O-N 2.99Å; E591-H593 VanDerWaalsContact C-N 3.35Å; E591-R595 VanDerWaalsContact O-CB 3.3Å; E591-R595 WeakPolarHBondContact O-CB 3.17Å; E591-R595 PolarHBondContact O-N 3.15Å
592	S	78.4	Confident	67.1	Low	58 Å²	58	108.5 Å²	108.5	41%	0.406	61%	0.606	S	S	.	*	H	α-helix	trans	-59.5	-45.4	171.1	-178.6	0	0	0	0	111.4	S588 I590 R595 N596	S588-S592 PolarHBondContact O-N 3.42Å; S588-S592 VanDerWaalsContact O-N 3.1Å; I590-S592 VanDerWaalsContact C-N 3.3Å; I590-S592 PolarHBondContact O-N 2.71Å; S592-R595 PolarHBondContact O-N 3.28Å; S592-N596 WeakPolarHBondContact O-CB 3.3Å; S592-N596 PolarHBondContact O-N 2.9Å
593	H	78.6	Confident	68.4	Low	123 Å²	123	110 Å²	110	57%	0.569	60%	0.596	S	S	*	*	H	α-helix	trans	-66.5	-43.8	179.4	-146.3	-79.2	0	0	0	112.5	R589 I590 E591 N596 L597	R589-H593 WeakPolarHBondContact O-CB 3.38Å; R589-H593 PolarHBondContact O-N 3.48Å; R589-H593 VanDerWaalsContact O-N 3.09Å; I590-H593 WeakPolarHBondContact O-CB 3.49Å; I590-H593 PolarHBondContact O-N 2.96Å; E591-H593 VanDerWaalsContact C-N 3.35Å; H593-N596 PolarHBondContact O-N 3.45Å; H593-L597 VanDerWaalsContact ND1-CD1 3.25Å; H593-L597 WeakPolarHBondContact ND1-CD1 3.32Å; H593-L597 VanDerWaalsContact O-CD1 3.32Å; H593-L597 WeakPolarHBondContact O-CD1 3.5Å; H593-L597 PolarHBondContact O-N 3.2Å
594	I	81.9	Confident	69.5	Low	107 Å²	107	110.1 Å²	110.1	55%	0.549	59%	0.585	S	S	.	*	H	α-helix	trans	-61.8	-46.4	176.2	-67.6	165.5	0	0	0	110.5	I590 N596 L597 S598	I590-I594 HydrophobicContact CG2-CD1 3.64Å; I590-I594 HydrophobicContact CG2-CG1 4.34Å; I590-I594 WeakPolarHBondContact O-CG1 3.46Å; I590-I594 PolarHBondContact O-N 3.28Å; I594-N596 VanDerWaalsContact C-N 3.31Å; I594-N596 PolarHBondContact O-N 3.27Å; I594-L597 PolarHBondContact O-N 3.22Å; I594-S598 PolarHBondContact O-N 3.03Å
595	R	79.8	Confident	70.4	Confident	145 Å²	145	106.8 Å²	106.8	55%	0.547	57%	0.572	S	S	.	*	H	α-helix	trans	-61.2	-40.8	176.5	-172.5	171.9	-74.5	143.7	-0.2	111	E591 S592 S598 N599	E591-R595 VanDerWaalsContact O-CB 3.3Å; E591-R595 WeakPolarHBondContact O-CB 3.17Å; E591-R595 PolarHBondContact O-N 3.15Å; S592-R595 PolarHBondContact O-N 3.28Å; R595-S598 PolarHBondContact O-N 3.1Å; R595-S598 PolarHBondContact O-OG 2.93Å; R595-N599 PolarHBondContact O-N 3.49Å; R595-N599 PolarHBondContact O-ND2 3.33Å
596	N	81.3	Confident	71.2	Confident	98 Å²	98	107.5 Å²	107.5	52%	0.524	57%	0.572	S	S	.	*	H	α-helix	trans	-66.9	-40.7	175.2	-77.1	-15.3	0	0	0	113.3	S592 H593 I594 S598 N599 S600	S592-N596 WeakPolarHBondContact O-CB 3.3Å; S592-N596 PolarHBondContact O-N 2.9Å; H593-N596 PolarHBondContact O-N 3.45Å; I594-N596 VanDerWaalsContact C-N 3.31Å; I594-N596 PolarHBondContact O-N 3.27Å; N596-S598 PolarHBondContact O-N 3.27Å; N596-N599 PolarHBondContact O-N 2.95Å; N596-S600 WeakPolarHBondContact O-CB 3.46Å; N596-S600 PolarHBondContact O-N 3.31Å
597	L	78.5	Confident	71.8	Confident	103 Å²	103	111 Å²	111	54%	0.539	57%	0.567	S	S	.	*	H	α-helix	trans	-58.3	-48.3	171.8	-99.9	76.5	0	0	0	111.2	H593 I594 N599 S600 A601	H593-L597 VanDerWaalsContact ND1-CD1 3.25Å; H593-L597 WeakPolarHBondContact ND1-CD1 3.32Å; H593-L597 VanDerWaalsContact O-CD1 3.32Å; H593-L597 WeakPolarHBondContact O-CD1 3.5Å; H593-L597 PolarHBondContact O-N 3.2Å; I594-L597 PolarHBondContact O-N 3.22Å; L597-N599 VanDerWaalsContact C-N 3.28Å; L597-N599 PolarHBondContact O-N 3.48Å; L597-S600 WeakPolarHBondContact O-CB 3.25Å; L597-S600 PolarHBondContact O-N 3.05Å; L597-S600 VanDerWaalsContact O-N 3.07Å; L597-A601 PolarHBondContact O-N 2.78Å
598	S	79.4	Confident	71.5	Confident	54 Å²	54	110.8 Å²	110.8	38%	0.378	57%	0.574	S	S	.	*	H	α-helix	trans	-61.5	-35.3	-179.9	75.1	0	0	0	0	113	I594 R595 N596 R602	I594-S598 PolarHBondContact O-N 3.03Å; R595-S598 PolarHBondContact O-N 3.1Å; R595-S598 PolarHBondContact O-OG 2.93Å; N596-S598 PolarHBondContact O-N 3.27Å; S598-R602 VanDerWaalsContact O-CG 3.27Å; S598-R602 WeakPolarHBondContact O-CG 3.39Å; S598-R602 PolarHBondContact O-N 3.41Å
599	N	77.6	Confident	70.5	Confident	78 Å²	78	112.5 Å²	112.5	42%	0.417	59%	0.592	S	S	.	*	H	α-helix	trans	-75.8	-30.8	175.1	-75	-25.8	0	0	0	112.4	R595 N596 L597 K603	R595-N599 PolarHBondContact O-N 3.49Å; R595-N599 PolarHBondContact O-ND2 3.33Å; N596-N599 PolarHBondContact O-N 2.95Å; L597-N599 VanDerWaalsContact C-N 3.28Å; L597-N599 PolarHBondContact O-N 3.48Å; N599-K603 PolarHBondContact O-N 3.27Å
600	S	76.5	Confident	69.7	Low	79 Å²	79	113.4 Å²	113.4	55%	0.552	60%	0.595	S	S	*	*	H	α-helix	trans	-70.1	-47.7	175.2	-163	0	0	0	0	111.2	N596 L597 R602 K603 S604	N596-S600 WeakPolarHBondContact O-CB 3.46Å; N596-S600 PolarHBondContact O-N 3.31Å; L597-S600 WeakPolarHBondContact O-CB 3.25Å; L597-S600 PolarHBondContact O-N 3.05Å; L597-S600 VanDerWaalsContact O-N 3.07Å; S600-R602 VanDerWaalsContact C-N 3.28Å; S600-R602 PolarHBondContact O-N 2.96Å; S600-K603 CarbonylContact O-C 3.53Å; S600-K603 WeakPolarHBondContact O-CA 3.41Å; S600-K603 PolarHBondContact O-N 2.86Å; S600-S604 PolarHBondContact O-N 3.32Å
601	A	71.9	Confident	68.9	Low	53 Å²	53	112.1 Å²	112.1	44%	0.438	60%	0.602	S	S	.	*	H	α-helix	trans	-59.4	-36.6	176.2	0	0	0	0	0	112.7	L597 K603 S604 H605	L597-A601 PolarHBondContact O-N 2.78Å; A601-K603 VanDerWaalsContact C-N 3.29Å; A601-K603 PolarHBondContact O-N 2.87Å; A601-S604 WeakPolarHBondContact CA-OG 3.41Å; A601-S604 PolarHBondContact O-OG 3.5Å; A601-H605 PolarHBondContact O-N 3.41Å
602	R	67.7	Low	67.9	Low	194 Å²	194	112.8 Å²	112.8	73%	0.732	61%	0.612	S	S	*	*	H	α-helix	trans	-67.6	-26.6	172.5	-73.2	173.1	179.5	-152.8	-2.5	113.3	S598 S600	S598-R602 VanDerWaalsContact O-CG 3.27Å; S598-R602 WeakPolarHBondContact O-CG 3.39Å; S598-R602 PolarHBondContact O-N 3.41Å; S600-R602 VanDerWaalsContact C-N 3.28Å; S600-R602 PolarHBondContact O-N 2.96Å
603	K	65.4	Low	66.8	Low	163 Å²	163	115 Å²	115	71%	0.709	63%	0.625	S	S	*	*	H	α-helix	trans	-87.7	-27.7	176.4	-81.1	-173.9	172.3	-175.6	0	113.8	N599 S600 A601	N599-K603 PolarHBondContact O-N 3.27Å; S600-K603 CarbonylContact O-C 3.53Å; S600-K603 WeakPolarHBondContact O-CA 3.41Å; S600-K603 PolarHBondContact O-N 2.86Å; A601-K603 VanDerWaalsContact C-N 3.29Å; A601-K603 PolarHBondContact O-N 2.87Å
604	S	60.2	Low	65.5	Low	74 Å²	74	117.3 Å²	117.3	52%	0.517	64%	0.638	S	S	.	*	H	α-helix	trans	-71.4	-41.3	172.2	57	0	0	0	0	111.5	S600 A601 A606 K607	S600-S604 PolarHBondContact O-N 3.32Å; A601-S604 WeakPolarHBondContact CA-OG 3.41Å; A601-S604 PolarHBondContact O-OG 3.5Å; S604-A606 PolarHBondContact O-N 3.26Å; S604-K607 PolarHBondContact O-N 2.94Å
605	H	58.1	Low	64.5	Low	158 Å²	158	114.9 Å²	114.9	73%	0.731	63%	0.631	S	S	*	*	G	3₁₀ helix	trans	-60.5	-27.3	175.4	-108.6	-70	0	0	0	113.9	A601 K607	A601-H605 PolarHBondContact O-N 3.41Å; H605-K607 PolarHBondContact O-N 2.88Å
606	A	59.9	Low	63.5	Low	85 Å²	85	116.7 Å²	116.7	70%	0.702	65%	0.649	S	S	*	*	G	3₁₀ helix	trans	-75.9	3.6	173.8	0	0	0	0	0	114.1	S604	S604-A606 PolarHBondContact O-N 3.26Å
607	K	57.9	Low	62.7	Low	180 Å²	180	118.8 Å²	118.8	78%	0.783	66%	0.656	S	S	*	*	G	3₁₀ helix	trans	-129.9	20.7	178	-70.7	-166.2	171.7	-166.3	0	113.3	S604 H605 A609	S604-K607 PolarHBondContact O-N 2.94Å; H605-K607 PolarHBondContact O-N 2.88Å; K607-A609 PolarHBondContact O-N 2.89Å; K607-A609 VanDerWaalsContact O-N 3.1Å
608	A	51.7	Low	61.6	Low	80 Å²	80	116.4 Å²	116.4	66%	0.661	66%	0.657	S	S	*	*			trans	-57.8	117.3	168	0	0	0	0	0	108.9	R610	A608-R610 PolarHBondContact O-N 3.07Å
609	A	53.1	Low	60.8	Low	96 Å²	96	123.1 Å²	123.1	79%	0.793	67%	0.674	S	S	*	*			trans	-64.2	136.6	-177.9	0	0	0	0	0	110	K607 A611	K607-A609 PolarHBondContact O-N 2.89Å; K607-A609 VanDerWaalsContact O-N 3.1Å; A609-A611 PolarHBondContact O-N 2.75Å; A609-A611 VanDerWaalsContact O-N 3.15Å
610	R	54.5	Low	59.8	Low	245 Å²	245	124.5 Å²	124.5	93%	0.925	68%	0.681	S	S	*	*			trans	-63.7	114.7	175.5	-176.7	179.4	-174.5	172.9	1.9	108.2	A608 V612	A608-R610 PolarHBondContact O-N 3.07Å; R610-V612 PolarHBondContact O-N 3.01Å
611	A	59.1	Low	58.6	Low	89 Å²	89	128.5 Å²	128.5	74%	0.736	69%	0.693	S	S	*	*			trans	-56.4	137.9	179.7	0	0	0	0	0	111	A609	A609-A611 PolarHBondContact O-N 2.75Å; A609-A611 VanDerWaalsContact O-N 3.15Å
612	V	55.6	Low	58.1	Low	107 Å²	107	131.2 Å²	131.2	65%	0.648	71%	0.709	S	S	*	*			trans	-76.6	133.2	175.1	179.4	0	0	0	0	108.3	R610 M614	R610-V612 PolarHBondContact O-N 3.01Å; V612-M614 PolarHBondContact O-N 3.11Å; V612-M614 VanDerWaalsContact O-N 3.11Å
613	P	54.2	Low	57.5	Low	105 Å²	105	133.9 Å²	133.9	68%	0.682	74%	0.736	S	S	*	*			trans	-69.9	107.2	175	28.5	-33.4	0	0	0	109.9	S615	P613-S615 PolarHBondContact O-N 3.1Å
614	M	52.3	Low	57.1	Low	170 Å²	170	132.4 Å²	132.4	84%	0.837	74%	0.738	S	S	*	*			trans	-73.3	115.5	173.7	-56.3	-151.9	-51.6	0	0	109.5	V612	V612-M614 PolarHBondContact O-N 3.11Å; V612-M614 VanDerWaalsContact O-N 3.11Å
615	S	60.7	Low	56.9	Low	56 Å²	56	135.5 Å²	135.5	39%	0.392	75%	0.749	S	S	.	*			trans	-81.8	136.2	175.1	-51.4	0	0	0	0	110.2	P613 E617 G618 N620	P613-S615 PolarHBondContact O-N 3.1Å; S615-E617 PolarHBondContact O-N 2.84Å; S615-G618 PolarHBondContact O-N 3.06Å; S615-N620 PolarHBondContact OG-ND2 3.09Å
616	I	58.8	Low	56.8	Low	183 Å²	183	134.2 Å²	134.2	94%	0.938	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.6	-22.2	-177.8	-66.6	168.3	0	0	0	112.5	G618	I616-G618 PolarHBondContact O-N 3.38Å
617	E	64.8	Low	56.7	Low	142 Å²	142	137.1 Å²	137.1	66%	0.664	75%	0.753	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.6	8.7	174.5	-57	-170.8	159.1	0	0	115.3	S615 R619	S615-E617 PolarHBondContact O-N 2.84Å; E617-R619 PolarHBondContact O-N 3.33Å; E617-R619 IonicContact OE2-CZ 2.61Å; E617-R619 IonicContact OE2-NH1 3.33Å; E617-R619 PolarHBondContact OE2-NH1 3.38Å
618	G	54.3	Low	56.6	Low	54 Å²	54	134.4 Å²	134.4	56%	0.557	75%	0.751	S	S	*	*			trans	68.2	-8.8	173.6	0	0	0	0	0	117.5	S615 I616 N620	S615-G618 PolarHBondContact O-N 3.06Å; I616-G618 PolarHBondContact O-N 3.38Å; G618-N620 PolarHBondContact O-N 3.32Å
619	R	63.3	Low	56.9	Low	195 Å²	195	138.1 Å²	138.1	74%	0.736	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.3	-7	-169.4	-86.5	177.9	164.2	126.3	-0	118.6	E617	E617-R619 PolarHBondContact O-N 3.33Å; E617-R619 IonicContact OE2-CZ 2.61Å; E617-R619 IonicContact OE2-NH1 3.33Å; E617-R619 PolarHBondContact OE2-NH1 3.38Å
620	N	55.6	Low	57.2	Low	107 Å²	107	141.1 Å²	141.1	57%	0.572	75%	0.754	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.1	21	-164.8	-73.7	-35.7	0	0	0	115.1	S615 G618	S615-N620 PolarHBondContact OG-ND2 3.09Å; G618-N620 PolarHBondContact O-N 3.32Å
621	M	51.5	Low	57.4	Low	162 Å²	162	133.1 Å²	133.1	80%	0.798	74%	0.741	S	S	*	*			trans	-83.5	129.7	168.3	-70.4	-64.1	-71.5	0	0	110.6
622	S	62.1	Low	57.3	Low	110 Å²	110	136.8 Å²	136.8	77%	0.769	74%	0.742	S	S	*	*			trans	-83	135.5	165.1	56	0	0	0	0	110.1
623	L	54.1	Low	57.4	Low	250 Å²	250	139.5 Å²	139.5	100%	1.309	75%	0.75	S	S	*	*			trans	-58.9	0	165	-62.6	168.8	0	0	0	111.5

Retrieved 623 of 623 residues in 829.5 ms (Link to these results)

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