A0A3Q0KC66_SCHMA Loading...

KRR1 small subunit processome component

Required for 40S ribosome biogenesis. Involved in nucleolar processing of pre-18S ribosomal RNA and ribosome assembly.

AlphaFold DB , UniProt , Accession A0A3Q0KC66, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 349 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	44.1	Very low	49.8	Very low	244 Å²	244	169 Å²	169	100%	1.202	87%	0.871	S	S	*	*				0	114.1	0	-68.9	-172.4	-175.3	0	0	108.9	K3	M1-K3 PolarHBondContact O-N 3.32Å
2	G	43	Very low	50.4	Low	80 Å²	80	166.6 Å²	166.6	83%	0.825	85%	0.85	S	S	*	*			trans	-73.9	117.6	-168.9	0	0	0	0	0	113.5	K4	G2-K4 PolarHBondContact O-N 3.14Å
3	K	48.6	Very low	51.1	Low	206 Å²	206	161.9 Å²	161.9	90%	0.896	84%	0.837	S	S	*	*			trans	-70.1	106.7	172.6	-73.7	-178	177.2	178.6	0	109.2	M1 T5	M1-K3 PolarHBondContact O-N 3.32Å; K3-T5 PolarHBondContact O-N 3.24Å
4	K	46.6	Very low	52	Low	202 Å²	202	160.6 Å²	160.6	88%	0.878	84%	0.84	S	S	*	*			trans	-64	116.1	170.5	-72.6	178.4	177	176	0	109	G2 N6	G2-K4 PolarHBondContact O-N 3.14Å; K4-N6 PolarHBondContact O-N 3.19Å
5	T	50.6	Low	52.9	Low	130 Å²	130	155.5 Å²	155.5	80%	0.798	82%	0.818	S	S	*	*			trans	-75.3	114.4	169	45.1	0	0	0	0	108.8	K3 K7	K3-T5 PolarHBondContact O-N 3.24Å; T5-K7 PolarHBondContact O-N 3.4Å
6	N	51	Low	53.5	Low	159 Å²	159	153.8 Å²	153.8	85%	0.85	82%	0.819	S	S	*	*			trans	-65.5	104.8	168.9	-91.4	-21.3	0	0	0	108.2	K4 Q8	K4-N6 PolarHBondContact O-N 3.19Å; N6-Q8 PolarHBondContact O-N 3.26Å; N6-Q8 VanDerWaalsContact O-N 3.14Å
7	K	50.2	Low	54.3	Low	193 Å²	193	149.7 Å²	149.7	84%	0.839	82%	0.821	S	S	*	*			trans	-61.7	113.1	166.4	-73.9	-178.9	177.4	178.4	0	107.9	T5 K9	T5-K7 PolarHBondContact O-N 3.4Å; K7-K9 PolarHBondContact O-N 3.43Å
8	Q	51.7	Low	54.4	Low	184 Å²	184	149.3 Å²	149.3	86%	0.86	81%	0.806	S	S	*	*			trans	-56	122.9	168.8	-79.9	175.1	-26.5	0	0	108.8	N6 L10	N6-Q8 PolarHBondContact O-N 3.26Å; N6-Q8 VanDerWaalsContact O-N 3.14Å; Q8-L10 PolarHBondContact O-N 3Å
9	K	49.6	Very low	54.9	Low	206 Å²	206	147.7 Å²	147.7	90%	0.896	80%	0.801	S	S	*	*			trans	-74.2	106.9	168.6	-73.4	-177.8	178.1	179.4	0	107.3	K7 S11	K7-K9 PolarHBondContact O-N 3.43Å; K9-S11 PolarHBondContact O-N 3.31Å
10	L	56.3	Low	55.4	Low	138 Å²	138	144 Å²	144	72%	0.723	79%	0.785	S	S	*	*			trans	-70.5	111	165.5	-73.9	160.4	0	0	0	108	Q8 F12	Q8-L10 PolarHBondContact O-N 3Å; L10-F12 HydrophobicContact CB-CE2 4.02Å; L10-F12 HydrophobicContact CB-CZ 4.31Å
11	S	56.2	Low	55.6	Low	117 Å²	117	146.6 Å²	146.6	82%	0.818	79%	0.785	S	S	*	*			trans	-83.2	105.8	169.1	55.6	0	0	0	0	109	K9	K9-S11 PolarHBondContact O-N 3.31Å
12	F	56.8	Low	56.5	Low	140 Å²	140	143.7 Å²	143.7	61%	0.614	77%	0.766	S	S	*	*			trans	-80.1	144.8	167.3	-64.6	-80.8	0	0	0	109.4	L10 V14	L10-F12 HydrophobicContact CB-CE2 4.02Å; L10-F12 HydrophobicContact CB-CZ 4.31Å; F12-V14 PolarHBondContact O-N 3.45Å
13	P	59.6	Low	57.2	Low	106 Å²	106	143.7 Å²	143.7	69%	0.688	76%	0.758	S	S	*	*			trans	-58.6	137.9	171.7	23.4	-31.2	0	0	0	110.2	V15	P13-V15 PolarHBondContact O-N 3.37Å; P13-V15 VanDerWaalsContact O-N 3.09Å
14	V	63.9	Low	57.5	Low	144 Å²	144	141.8 Å²	141.8	87%	0.873	75%	0.75	S	S	*	*			trans	-73	101.5	179	-179.1	0	0	0	0	108.4	F12	F12-V14 PolarHBondContact O-N 3.45Å
15	V	65.3	Low	58	Low	84 Å²	84	135.7 Å²	135.7	51%	0.509	73%	0.732	S	S	.	*			trans	-85.2	123.4	172.6	-174.6	0	0	0	0	108.3	P13 G17 W18	P13-V15 PolarHBondContact O-N 3.37Å; P13-V15 VanDerWaalsContact O-N 3.09Å; V15-G17 PolarHBondContact O-N 3.32Å; V15-W18 HydrophobicContact CB-CB 3.88Å; V15-W18 WeakPolarHBondContact O-CB 3.47Å; V15-W18 PolarHBondContact O-N 3.21Å
16	P	63.2	Low	58.6	Low	128 Å²	128	133.3 Å²	133.3	83%	0.831	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55	122.2	176.1	-21.8	31.3	0	0	0	110.6
17	G	66.3	Low	59.1	Low	84 Å²	84	135.1 Å²	135.1	87%	0.866	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	90.2	-5.3	-178.2	0	0	0	0	0	115.8	V15	V15-G17 PolarHBondContact O-N 3.32Å
18	W	55.7	Low	59.4	Low	142 Å²	142	133.3 Å²	133.3	54%	0.538	72%	0.719	S	S	.	*	P	Polyproline II helix	trans	-84.2	117	174	-171.2	80.6	0	0	0	111.3	V15 P20	V15-W18 HydrophobicContact CB-CB 3.88Å; V15-W18 WeakPolarHBondContact O-CB 3.47Å; V15-W18 PolarHBondContact O-N 3.21Å; W18-P20 HydrophobicContact CE3-CB 4.45Å; W18-P20 HydrophobicContact CE3-CG 4.06Å; W18-P20 HydrophobicContact CH2-CB 3.92Å; W18-P20 HydrophobicContact CH2-CG 4.33Å; W18-P20 HydrophobicContact CZ3-CB 3.73Å; W18-P20 HydrophobicContact CZ3-CG 3.62Å
19	V	65	Low	59.1	Low	119 Å²	119	132.5 Å²	132.5	72%	0.721	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-97.9	118.6	173.6	-174.3	0	0	0	0	108.3	Y21	V19-Y21 PolarHBondContact O-N 2.94Å
20	P	63.7	Low	59.4	Low	74 Å²	74	129.3 Å²	129.3	48%	0.481	71%	0.707	S	S	.	*	P	Polyproline II helix	trans	-58.6	138	178	-15.1	23.5	0	0	0	110.5	W18 K22	W18-P20 HydrophobicContact CE3-CB 4.45Å; W18-P20 HydrophobicContact CE3-CG 4.06Å; W18-P20 HydrophobicContact CH2-CB 3.92Å; W18-P20 HydrophobicContact CH2-CG 4.33Å; W18-P20 HydrophobicContact CZ3-CB 3.73Å; W18-P20 HydrophobicContact CZ3-CG 3.62Å; P20-K22 PolarHBondContact O-N 3.04Å
21	Y	60.9	Low	59.4	Low	199 Å²	199	132.1 Å²	132.1	78%	0.78	72%	0.717	S	S	*	*			trans	-54.7	114.2	172.7	174.1	-102.4	0	0	0	110.1	V19 A23	V19-Y21 PolarHBondContact O-N 2.94Å; Y21-A23 HydrophobicContact CE1-CB 4.39Å
22	K	62.4	Low	59.4	Low	183 Å²	183	133.2 Å²	133.2	80%	0.796	72%	0.718	S	S	*	*			trans	-85.9	120.6	168.3	-79.2	179.6	179.1	171.8	0	107.9	P20 F24	P20-K22 PolarHBondContact O-N 3.04Å; K22-F24 PolarHBondContact O-N 3.09Å
23	A	57.1	Low	59.5	Low	80 Å²	80	131.3 Å²	131.3	66%	0.661	72%	0.722	S	S	*	*			trans	-53.9	123.9	174.6	0	0	0	0	0	110.1	Y21 S25	Y21-A23 HydrophobicContact CE1-CB 4.39Å; A23-S25 PolarHBondContact O-N 3.26Å; A23-S25 VanDerWaalsContact O-N 3.14Å
24	F	55.4	Low	59.5	Low	166 Å²	166	134.6 Å²	134.6	73%	0.728	73%	0.728	S	S	*	*			trans	-54.8	115.4	177.8	-179.4	-96.8	0	0	0	110.1	K22 A26	K22-F24 PolarHBondContact O-N 3.09Å; F24-A26 HydrophobicContact CE1-CB 4.28Å
25	S	58	Low	59.3	Low	73 Å²	73	131.9 Å²	131.9	51%	0.51	71%	0.713	S	S	.	*			trans	-100.5	114.6	170.2	-178.5	0	0	0	0	108.3	A23 K27 K28	A23-S25 PolarHBondContact O-N 3.26Å; A23-S25 VanDerWaalsContact O-N 3.14Å; S25-K27 PolarHBondContact O-N 2.9Å; S25-K28 PolarHBondContact O-N 3.44Å; S25-K28 VanDerWaalsContact O-N 3.13Å
26	A	63.1	Low	59.2	Low	80 Å²	80	136.9 Å²	136.9	66%	0.661	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.6	-10.6	-179.6	0	0	0	0	0	114.5	F24	F24-A26 HydrophobicContact CE1-CB 4.28Å
27	K	60.4	Low	59.5	Low	197 Å²	197	140.5 Å²	140.5	86%	0.857	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.4	0.9	-177.9	-66.8	-174.1	178	-176.9	0	114.7	S25	S25-K27 PolarHBondContact O-N 2.9Å
28	K	56	Low	59.7	Low	156 Å²	156	140.9 Å²	140.9	68%	0.678	73%	0.725	S	S	*	*			trans	-131.5	77.9	173.6	-84.2	-173.9	174.9	-176	0	110.3	S25 H30	S25-K28 PolarHBondContact O-N 3.44Å; S25-K28 VanDerWaalsContact O-N 3.13Å; K28-H30 PolarHBondContact O-N 3.05Å
29	L	46.6	Very low	60.7	Low	166 Å²	166	142.9 Å²	142.9	87%	0.869	74%	0.74	S	S	*	*			trans	-72.9	78.2	160.3	-93.7	147.8	0	0	0	107.9
30	H	55.7	Low	61.2	Low	140 Å²	140	142.4 Å²	142.4	65%	0.648	74%	0.737	S	S	*	*			trans	-78.4	133.7	156.2	-77.2	-67.2	0	0	0	107	K28 V32	K28-H30 PolarHBondContact O-N 3.05Å; H30-V32 PolarHBondContact O-N 3.43Å
31	E	57	Low	62.2	Low	197 Å²	197	143 Å²	143	92%	0.921	74%	0.741	S	S	*	*			trans	-44.3	108.1	169.6	-87.7	169.1	147.9	0	0	109	S33	E31-S33 VanDerWaalsContact C-N 3.35Å; E31-S33 PolarHBondContact O-N 3.25Å
32	V	55.3	Low	62.9	Low	140 Å²	140	142.7 Å²	142.7	85%	0.848	74%	0.744	S	S	*	*			trans	-71.8	100.9	170.8	-179.3	0	0	0	0	104.8	H30 E34	H30-V32 PolarHBondContact O-N 3.43Å; V32-E34 PolarHBondContact O-N 3.2Å
33	S	59.1	Low	63.7	Low	100 Å²	100	141 Å²	141	70%	0.699	74%	0.743	S	S	*	*			trans	-45.9	134.8	168.7	55.6	0	0	0	0	108.6	E31	E31-S33 VanDerWaalsContact C-N 3.35Å; E31-S33 PolarHBondContact O-N 3.25Å
34	E	58.8	Low	65	Low	175 Å²	175	145.3 Å²	145.3	82%	0.818	74%	0.743	S	S	*	*			trans	-43.6	131	176.6	-69.6	-176.8	159.7	0	0	109.7	V32 Q36	V32-E34 PolarHBondContact O-N 3.2Å; E34-Q36 PolarHBondContact O-N 3.42Å
35	P	60.4	Low	66.3	Low	86 Å²	86	145 Å²	145	56%	0.558	74%	0.741	S	S	*	*			trans	-58.5	112.3	-180	24.7	-32.3	0	0	0	107.5	Y37	P35-Y37 VanDerWaalsContact C-N 3.3Å; P35-Y37 HydrophobicContact CG-CE2 4.31Å; P35-Y37 WeakPolarHBondContact O-CD2 3.37Å; P35-Y37 PolarHBondContact O-N 2.93Å
36	Q	62.8	Low	67.5	Low	190 Å²	190	149.7 Å²	149.7	89%	0.888	76%	0.755	S	S	*	*			trans	-61.5	100.9	168	-71.8	-179.2	-7.4	0	0	105.9	E34 A38	E34-Q36 PolarHBondContact O-N 3.42Å; Q36-A38 PolarHBondContact O-N 2.97Å; Q36-A38 VanDerWaalsContact O-N 3.07Å
37	Y	69.2	Low	68.5	Low	203 Å²	203	151.2 Å²	151.2	80%	0.796	76%	0.758	S	S	*	*			trans	-63.4	113.1	172.8	-67.3	-77.9	0	0	0	106.9	P35 E39	P35-Y37 VanDerWaalsContact C-N 3.3Å; P35-Y37 HydrophobicContact CG-CE2 4.31Å; P35-Y37 WeakPolarHBondContact O-CD2 3.37Å; P35-Y37 PolarHBondContact O-N 2.93Å; Y37-E39 PolarHBondContact O-N 3.48Å
38	A	71.7	Confident	69.7	Low	92 Å²	92	149.2 Å²	149.2	76%	0.76	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-64.3	120	167.8	0	0	0	0	0	107.6	Q36 V40	Q36-A38 PolarHBondContact O-N 2.97Å; Q36-A38 VanDerWaalsContact O-N 3.07Å; A38-V40 PolarHBondContact O-N 2.75Å
39	E	75.1	Confident	71.2	Confident	185 Å²	185	145.6 Å²	145.6	86%	0.864	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-64.2	122.2	173.4	-66.8	-174.4	176.2	0	0	108.4	Y37 P41	Y37-E39 PolarHBondContact O-N 3.48Å; E39-P41 WeakPolarHBondContact O-CD 3.41Å
40	V	77.2	Confident	73.1	Confident	109 Å²	109	141.6 Å²	141.6	66%	0.661	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-62.3	125.9	175	178.7	0	0	0	0	107.6	A38 K42 W44	A38-V40 PolarHBondContact O-N 2.75Å; V40-K42 PolarHBondContact O-N 2.65Å; V40-W44 HydrophobicContact CG1-CB 3.59Å; V40-W44 HydrophobicContact CG1-CG 3.94Å
41	P	82.9	Confident	74.5	Confident	86 Å²	86	138.6 Å²	138.6	56%	0.558	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-52.1	138.3	176.4	-27.1	34.9	0	0	0	110.8	E39 D43 W44	E39-P41 WeakPolarHBondContact O-CD 3.41Å; P41-D43 PolarHBondContact O-N 3.27Å; P41-W44 HydrophobicContact CB-CB 4.49Å; P41-W44 VanDerWaalsContact O-CB 3.32Å; P41-W44 WeakPolarHBondContact O-CB 3.14Å; P41-W44 PolarHBondContact O-N 3.08Å
42	K	75.8	Confident	75.9	Confident	192 Å²	192	137.8 Å²	137.8	84%	0.835	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.3	-25.8	-172.7	-165	174.4	-178.7	179.3	0	113.9	V40	V40-K42 PolarHBondContact O-N 2.65Å
43	D	80.4	Confident	77.4	Confident	147 Å²	147	135.4 Å²	135.4	79%	0.786	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.7	11.6	-177.7	-56.3	-45	0	0	0	113.4	P41 K45	P41-D43 PolarHBondContact O-N 3.27Å; D43-K45 PolarHBondContact O-N 3.27Å
44	W	84.2	Confident	78.6	Confident	172 Å²	172	131.7 Å²	131.7	65%	0.652	66%	0.657	S	S	*	*			trans	-65.2	119.3	176.8	-174.4	-87.2	0	0	0	110.5	V40 P41	V40-W44 HydrophobicContact CG1-CB 3.59Å; V40-W44 HydrophobicContact CG1-CG 3.94Å; P41-W44 HydrophobicContact CB-CB 4.49Å; P41-W44 VanDerWaalsContact O-CB 3.32Å; P41-W44 WeakPolarHBondContact O-CB 3.14Å; P41-W44 PolarHBondContact O-N 3.08Å
45	K	82.5	Confident	79.5	Confident	160 Å²	160	129 Å²	129	70%	0.696	66%	0.655	S	S	*	*			trans	-116.7	136.9	170.6	-65.6	-170.7	178.3	-169.3	0	108.9	D43	D43-K45 PolarHBondContact O-N 3.27Å
46	E	82.7	Confident	80.4	Confident	170 Å²	170	130.5 Å²	130.5	79%	0.794	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-61.6	129.2	173.2	-68.5	174.1	-168.1	0	0	108.9
47	P	85.4	Confident	81	Confident	113 Å²	113	123.3 Å²	123.3	73%	0.734	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-65	144.3	178.4	27.4	-33.4	0	0	0	109.9	F49	P47-F49 PolarHBondContact O-N 3.12Å
48	K	85.4	Confident	81.6	Confident	155 Å²	155	120.6 Å²	120.6	67%	0.674	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-65.1	133.9	172.9	-68.7	-172.3	176.4	-172.2	0	109.2	N50	K48-N50 PolarHBondContact O-N 3.41Å
49	F	86.6	Confident	82.1	Confident	80 Å²	80	118.1 Å²	118.1	35%	0.351	59%	0.593	S	S	.	*			trans	-74.2	112.8	175.8	-167.2	-95.8	0	0	0	109.4	P47 D53 N54 F113 D114	P47-F49 PolarHBondContact O-N 3.12Å; F49-D53 HydrophobicContact CD2-CB 3.94Å; F49-D53 HydrophobicContact CE1-CB 4.46Å; F49-D53 HydrophobicContact CE2-CB 3.58Å; F49-D53 HydrophobicContact CZ-CB 3.87Å; F49-N54 HydrophobicContact CE1-CB 4.2Å; F49-N54 HydrophobicContact CZ-CB 4.07Å; F49-F113 AromaticContact CD1-CD2 3.83Å; F49-F113 HydrophobicContact CD1-CD2 3.83Å; F49-F113 HydrophobicContact CD1-CE2 4.1Å; F49-F113 AromaticContact CE1-CD2 3.96Å; F49-F113 HydrophobicContact CE1-CD2 3.96Å; F49-F113 WeakPolarHBondContact CE1-O 3.47Å; F49-F113 WeakPolarHBondContact O-CE2 3.37Å; F49-D114 HydrophobicContact CD1-CB 3.98Å
50	N	86.8	Confident	82.3	Confident	82 Å²	82	117.6 Å²	117.6	44%	0.439	59%	0.588	S	S	.	*			trans	-96.1	160	180	-69.1	-38.5	0	0	0	110.7	K48 E52 D53	K48-N50 PolarHBondContact O-N 3.41Å; N50-E52 PolarHBondContact O-N 2.91Å; N50-E52 VanDerWaalsContact O-N 3.12Å; N50-D53 PolarHBondContact N-OD2 3.17Å; N50-D53 WeakPolarHBondContact O-CB 3.49Å; N50-D53 PolarHBondContact O-N 3.23Å
51	P	85.9	Confident	82.7	Confident	77 Å²	77	115.5 Å²	115.5	50%	0.5	58%	0.582	S	S	.	*	G	3₁₀ helix	trans	-54.9	-29.3	173.6	-26.3	34.8	0	0	0	113.8	D53 N54 F113	P51-D53 VanDerWaalsContact C-N 3.29Å; P51-D53 PolarHBondContact O-N 3.33Å; P51-N54 PolarHBondContact O-N 3.38Å; P51-F113 HydrophobicContact CB-CB 4.4Å; P51-F113 HydrophobicContact CB-CD1 4.36Å; P51-F113 HydrophobicContact CB-CD2 4.24Å; P51-F113 HydrophobicContact CB-CG 4.08Å; P51-F113 HydrophobicContact CG-CD1 4Å; P51-F113 HydrophobicContact CG-CD2 4.03Å; P51-F113 HydrophobicContact CG-CE1 3.96Å; P51-F113 HydrophobicContact CG-CE2 4Å; P51-F113 HydrophobicContact CG-CG 4.04Å; P51-F113 HydrophobicContact CG-CZ 3.97Å
52	E	86.3	Confident	83.1	Confident	179 Å²	179	116.2 Å²	116.2	84%	0.836	59%	0.589	S	S	*	*	G	3₁₀ helix	trans	-67	-27.4	178.3	-60.8	-179.3	-177.7	0	0	113.2	N50 N54	N50-E52 PolarHBondContact O-N 2.91Å; N50-E52 VanDerWaalsContact O-N 3.12Å; E52-N54 PolarHBondContact O-N 3.02Å
53	D	86.3	Confident	84	Confident	90 Å²	90	108.9 Å²	108.9	48%	0.481	56%	0.563	S	S	.	*	G	3₁₀ helix	trans	-73.8	-15.2	-179.3	-61.8	-44.5	0	0	0	112.5	F49 N50 P51 P55	F49-D53 HydrophobicContact CD2-CB 3.94Å; F49-D53 HydrophobicContact CE1-CB 4.46Å; F49-D53 HydrophobicContact CE2-CB 3.58Å; F49-D53 HydrophobicContact CZ-CB 3.87Å; N50-D53 PolarHBondContact N-OD2 3.17Å; N50-D53 WeakPolarHBondContact O-CB 3.49Å; N50-D53 PolarHBondContact O-N 3.23Å; P51-D53 VanDerWaalsContact C-N 3.29Å; P51-D53 PolarHBondContact O-N 3.33Å; D53-P55 VanDerWaalsContact O-CD 3.23Å; D53-P55 WeakPolarHBondContact O-CD 3.34Å
54	N	84.4	Confident	84.7	Confident	23 Å²	23	105.1 Å²	105.1	12%	0.123	55%	0.548	C	S	.	.			trans	-100.8	95.8	173.8	-173.3	-11.4	0	0	0	110.5	F49 P51 E52 H56 G57 R58 F113	F49-N54 HydrophobicContact CE1-CB 4.2Å; F49-N54 HydrophobicContact CZ-CB 4.07Å; P51-N54 PolarHBondContact O-N 3.38Å; E52-N54 PolarHBondContact O-N 3.02Å; N54-H56 PolarHBondContact O-N 3.39Å; N54-H56 PolarHBondContact OD1-N 2.92Å; N54-G57 PolarHBondContact O-N 3.05Å; N54-G57 PolarHBondContact OD1-N 3.17Å; N54-R58 PolarHBondContact ND2-O 3.36Å; N54-F113 HydrophobicContact CB-CB 4.45Å; N54-F113 PolarHBondContact ND2-O 3.12Å
55	P	78.3	Confident	85.3	Confident	117 Å²	117	100.6 Å²	100.6	76%	0.76	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-18.4	-174.6	25.5	-35.6	0	0	0	113.9	D53	D53-P55 VanDerWaalsContact O-CD 3.23Å; D53-P55 WeakPolarHBondContact O-CD 3.34Å
56	H	78.9	Confident	86	Confident	119 Å²	119	96.7 Å²	96.7	55%	0.551	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.7	-10.7	177.2	-63.1	-54.1	0	0	0	113.3	N54 R58 F60	N54-H56 PolarHBondContact O-N 3.39Å; N54-H56 PolarHBondContact OD1-N 2.92Å; H56-R58 HydrophobicContact CB-CG 4.27Å; H56-R58 PolarHBondContact O-N 3.1Å; H56-F60 AromaticContact CD2-CZ 3.76Å
57	G	75.3	Confident	86.6	Confident	39 Å²	39	89.7 Å²	89.7	40%	0.402	49%	0.489	S	S	.	.	S	Bend	trans	60.4	12.7	-178.2	0	0	0	0	0	114.9	N54	N54-G57 PolarHBondContact O-N 3.05Å; N54-G57 PolarHBondContact OD1-N 3.17Å
58	R	80.8	Confident	87.1	Confident	146 Å²	146	90.6 Å²	90.6	55%	0.551	49%	0.488	S	S	*	.	S	Bend	trans	-149.2	155.3	-176.2	69.1	-176.1	179.6	174.4	-1.2	111.7	N54 H56 P110	N54-R58 PolarHBondContact ND2-O 3.36Å; H56-R58 HydrophobicContact CB-CG 4.27Å; H56-R58 PolarHBondContact O-N 3.1Å; R58-P110 WeakPolarHBondContact CB-O 3.46Å
59	L	83.5	Confident	87.5	Confident	39 Å²	39	83.7 Å²	83.7	20%	0.204	46%	0.458	C	S	.	.			trans	-86.8	144	165.4	-57.8	177.5	0	0	0	110	A61 T108 T112 P115	L59-A61 VanDerWaalsContact C-N 3.34Å; L59-T108 HydrophobicContact CD1-CG2 4.12Å; L59-T112 HydrophobicContact CD1-CG2 4.05Å; L59-T112 WeakPolarHBondContact CG-O 3.43Å; L59-T112 PolarHBondContact N-O 3.28Å; L59-P115 HydrophobicContact CD2-CB 3.81Å
60	F	78.6	Confident	87.9	Confident	174 Å²	174	82 Å²	82	76%	0.763	46%	0.455	S	S	*	.	S	Bend	trans	-72.7	-27.2	179	-70.3	-77.3	0	0	0	113.4	H56	H56-F60 AromaticContact CD2-CZ 3.76Å
61	A	86.2	Confident	88.2	Confident	65 Å²	65	86 Å²	86	54%	0.537	47%	0.468	S	S	.	.	S	Bend	trans	-119.1	141.2	-178.7	0	0	0	0	0	110.5	L59	L59-A61 VanDerWaalsContact C-N 3.34Å
62	S	89.8	Confident	88.6	Confident	101 Å²	101	89.6 Å²	89.6	71%	0.706	47%	0.473	S	S	*	.			trans	-79.8	130.6	167.7	-172.4	0	0	0	0	109.3	T108	S62-T108 WeakPolarHBondContact CA-OG1 3.45Å
63	S	94.8	Very high	89	Confident	39 Å²	39	82.6 Å²	82.6	27%	0.273	44%	0.439	S	S	.	.			trans	-115.6	130.8	174.5	-61.6	0	0	0	0	109.4	R107 T108	S63-R107 WeakPolarHBondContact O-CA 3.33Å; S63-T108 PolarHBondContact N-OG1 3.45Å; S63-T108 PolarHBondContact O-N 2.97Å; S63-T108 PolarHBondContact O-OG1 3.4Å
64	S	95	Very high	89.4	Confident	68 Å²	68	81 Å²	81	48%	0.476	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	143.9	172.8	62.8	0	0	0	0	111.2	V106	S64-V106 CarbonylContact C-O 3.37Å; S64-V106 VanDerWaalsContact CA-O 3.24Å; S64-V106 WeakPolarHBondContact CA-O 3.46Å
65	Y	97	Very high	89.9	Confident	77 Å²	77	87.4 Å²	87.4	30%	0.302	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	134.4	174.1	-68.6	-74.6	0	0	0	110.1	E105 V106 I118 L119 R122	Y65-E105 CarbonylContact O-C 3.57Å; Y65-E105 WeakPolarHBondContact O-CA 3.38Å; Y65-V106 PolarHBondContact N-O 3.1Å; Y65-V106 PolarHBondContact O-N 3.02Å; Y65-I118 HydrophobicContact CD2-CD1 4.28Å; Y65-I118 HydrophobicContact CD2-CG1 3.8Å; Y65-I118 HydrophobicContact CE2-CG1 3.78Å; Y65-I118 HydrophobicContact CE2-CG2 4.47Å; Y65-L119 HydrophobicContact CE2-CD2 4.04Å; Y65-L119 WeakPolarHBondContact OH-CD2 3.47Å; Y65-R122 HydrophobicContact CD1-CG 4.02Å; Y65-R122 HydrophobicContact CD2-CB 3.86Å; Y65-R122 HydrophobicContact CD2-CG 4.17Å; Y65-R122 HydrophobicContact CE2-CB 4.48Å; Y65-R122 HydrophobicContact CG-CB 3.93Å; Y65-R122 HydrophobicContact CG-CG 3.77Å
66	T	97.1	Very high	90.8	Very high	77 Å²	77	84.7 Å²	84.7	47%	0.472	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	143.1	178.1	-49.8	0	0	0	0	110	T103 M104	T66-T103 HydrophobicContact CG2-CG2 4.33Å; T66-M104 CarbonylContact C-O 3.59Å; T66-M104 VanDerWaalsContact CA-O 3.27Å; T66-M104 WeakPolarHBondContact CA-O 3.25Å
67	T	96.1	Very high	91.6	Very high	23 Å²	23	79 Å²	79	14%	0.141	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	133.6	174.6	-63	0	0	0	0	110.2	M104 R126 A129	T67-M104 PolarHBondContact N-O 3.38Å; T67-M104 PolarHBondContact O-N 3.02Å; T67-R126 HydrophobicContact CG2-CG 4.1Å; T67-A129 HydrophobicContact CG2-CB 3.91Å
68	L	96	Very high	92.5	Very high	133 Å²	133	80.6 Å²	80.6	70%	0.696	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.8	143.3	174.3	-56.1	105.9	0	0	0	110.8	S102 T103	L68-S102 WeakPolarHBondContact CA-O 3.3Å; L68-T103 HydrophobicContact CD2-CG2 4.22Å; L68-T103 HydrophobicContact CG-CG2 4.14Å
69	F	94.9	Very high	93.3	Very high	10 Å²	10	79.4 Å²	79.4	4%	0.044	41%	0.406	C	S	.	.			trans	-120.3	153.9	172.9	60.4	-93.2	0	0	0	112	E74 L77 I97 S102 M104 A129	F69-E74 HydrophobicContact CE2-CB 4.01Å; F69-E74 HydrophobicContact CE2-CG 4.34Å; F69-L77 HydrophobicContact CB-CD1 3.9Å; F69-L77 HydrophobicContact CD1-CD1 3.77Å; F69-L77 HydrophobicContact CD2-CD1 3.54Å; F69-L77 HydrophobicContact CE1-CD1 4.1Å; F69-L77 HydrophobicContact CE2-CD1 3.93Å; F69-L77 HydrophobicContact CG-CD1 3.45Å; F69-L77 VanDerWaalsContact CG-CD1 3.45Å; F69-L77 HydrophobicContact CZ-CD1 4.18Å; F69-I97 HydrophobicContact CE1-CD1 4.2Å; F69-I97 HydrophobicContact CE1-CG1 4.05Å; F69-I97 HydrophobicContact CZ-CD1 4.14Å; F69-I97 HydrophobicContact CZ-CG1 4.22Å; F69-S102 VanDerWaalsContact CD1-C 3.49Å; F69-S102 WeakPolarHBondContact CD1-O 3.42Å; F69-S102 WeakPolarHBondContact CE1-O 3.44Å; F69-S102 PolarHBondContact N-O 2.92Å; F69-M104 HydrophobicContact CB-CE 4.04Å; F69-M104 HydrophobicContact CD1-CE 3.97Å; F69-M104 HydrophobicContact CD1-CG 3.68Å; F69-M104 HydrophobicContact CD1-SD 4.18Å; F69-M104 HydrophobicContact CE1-CG 3.82Å; F69-M104 HydrophobicContact CG-CE 4.39Å; F69-A129 HydrophobicContact CB-CB 4.07Å
70	P	94.1	Very high	93.8	Very high	45 Å²	45	78.6 Å²	78.6	29%	0.292	40%	0.402	S	S	.	.			trans	-69.4	142.3	175.8	-19.8	33.6	0	0	0	112.5	Y72 R73 A129	P70-Y72 VanDerWaalsContact C-N 3.26Å; P70-Y72 HydrophobicContact CB-CD1 3.62Å; P70-Y72 HydrophobicContact CB-CE1 3.16Å; P70-Y72 HydrophobicContact CB-CE2 4.37Å; P70-Y72 HydrophobicContact CB-CG 4.39Å; P70-Y72 HydrophobicContact CG-CE1 3.85Å; P70-Y72 PolarHBondContact O-N 3.35Å; P70-Y72 VanDerWaalsContact O-N 3.09Å; P70-R73 VanDerWaalsContact O-CB 3.29Å; P70-R73 WeakPolarHBondContact O-CB 3.05Å; P70-R73 PolarHBondContact O-N 2.97Å; P70-A129 WeakPolarHBondContact CD-O 3.27Å
71	K	94	Very high	94.6	Very high	164 Å²	164	70.9 Å²	70.9	71%	0.713	37%	0.368	S	S	*	.	G	3₁₀ helix	trans	-49.7	-38.5	-179.6	-172	172.4	-176.6	172.3	0	114.9	R73 E74	K71-R73 PolarHBondContact O-N 3.36Å; K71-R73 VanDerWaalsContact O-N 3.12Å; K71-E74 WeakPolarHBondContact O-CB 3.48Å; K71-E74 PolarHBondContact O-N 2.89Å
72	Y	94.1	Very high	95.1	Very high	153 Å²	153	71.6 Å²	71.6	60%	0.6	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-65	-17.1	178.8	64.3	-98.8	0	0	0	113.9	P70 Q189	P70-Y72 VanDerWaalsContact C-N 3.26Å; P70-Y72 HydrophobicContact CB-CD1 3.62Å; P70-Y72 HydrophobicContact CB-CE1 3.16Å; P70-Y72 HydrophobicContact CB-CE2 4.37Å; P70-Y72 HydrophobicContact CB-CG 4.39Å; P70-Y72 HydrophobicContact CG-CE1 3.85Å; P70-Y72 PolarHBondContact O-N 3.35Å; P70-Y72 VanDerWaalsContact O-N 3.09Å; Y72-Q189 PolarHBondContact OH-NE2 2.97Å
73	R	93.8	Very high	95.4	Very high	33 Å²	33	69.4 Å²	69.4	13%	0.125	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-88.6	-13.6	-178.5	-163.9	54.8	175.4	159.6	-5.5	112.6	P70 K71 K75 Y76 L77 V132	P70-R73 VanDerWaalsContact O-CB 3.29Å; P70-R73 WeakPolarHBondContact O-CB 3.05Å; P70-R73 PolarHBondContact O-N 2.97Å; K71-R73 PolarHBondContact O-N 3.36Å; K71-R73 VanDerWaalsContact O-N 3.12Å; R73-K75 PolarHBondContact O-N 2.7Å; R73-Y76 PolarHBondContact O-N 3Å; R73-L77 HydrophobicContact CB-CD1 4.36Å; R73-L77 HydrophobicContact CG-CD1 3.94Å; R73-L77 HydrophobicContact CG-CG 4Å; R73-L77 WeakPolarHBondContact O-CG 3.42Å; R73-L77 PolarHBondContact O-N 3.03Å; R73-V132 PolarHBondContact NH2-O 3.2Å; R73-V132 VanDerWaalsContact NH2-O 3.15Å
74	E	94.4	Very high	95.5	Very high	57 Å²	57	67.5 Å²	67.5	27%	0.266	34%	0.336	S	S	.	.	H	α-helix	trans	-51.1	-53.6	-177.7	-172.7	-170.5	143	0	0	112.8	F69 K71 Y76 L77 T78 V99	F69-E74 HydrophobicContact CE2-CB 4.01Å; F69-E74 HydrophobicContact CE2-CG 4.34Å; K71-E74 WeakPolarHBondContact O-CB 3.48Å; K71-E74 PolarHBondContact O-N 2.89Å; E74-Y76 VanDerWaalsContact C-N 3.32Å; E74-Y76 PolarHBondContact O-N 2.66Å; E74-L77 PolarHBondContact O-N 2.98Å; E74-L77 VanDerWaalsContact O-N 3.08Å; E74-T78 PolarHBondContact O-N 3.15Å; E74-T78 PolarHBondContact O-OG1 2.79Å; E74-T78 VanDerWaalsContact O-OG1 3.08Å; E74-V99 VanDerWaalsContact CD-CG1 3.44Å; E74-V99 HydrophobicContact CG-CG1 3.79Å; E74-V99 WeakPolarHBondContact OE1-CG1 3.32Å
75	K	95.6	Very high	95.5	Very high	156 Å²	156	69.1 Å²	69.1	68%	0.678	33%	0.331	S	S	*	.	H	α-helix	trans	-53.5	-48.5	-178.8	-177.3	177.7	177.1	-178.8	0	112.2	R73 E79	R73-K75 PolarHBondContact O-N 2.7Å; K75-E79 WeakPolarHBondContact CE-OE1 3.14Å; K75-E79 WeakPolarHBondContact O-CG 3.4Å; K75-E79 PolarHBondContact O-N 3.06Å
76	Y	96.4	Very high	95.5	Very high	61 Å²	61	73.4 Å²	73.4	24%	0.239	35%	0.347	C	S	.	.	H	α-helix	trans	-63.7	-46.2	178.4	175.4	-95	0	0	0	111.6	R73 E74 T78 E79 I80 M134	R73-Y76 PolarHBondContact O-N 3Å; E74-Y76 VanDerWaalsContact C-N 3.32Å; E74-Y76 PolarHBondContact O-N 2.66Å; Y76-T78 VanDerWaalsContact C-N 3.33Å; Y76-T78 PolarHBondContact O-N 2.89Å; Y76-E79 PolarHBondContact O-N 3.08Å; Y76-I80 HydrophobicContact CD1-CD1 4.04Å; Y76-I80 HydrophobicContact CD1-CG1 4.19Å; Y76-I80 HydrophobicContact CD1-CG2 4.35Å; Y76-I80 HydrophobicContact CD2-CG2 4.18Å; Y76-I80 HydrophobicContact CE1-CD1 3.46Å; Y76-I80 VanDerWaalsContact CE1-CD1 3.46Å; Y76-I80 HydrophobicContact CE1-CG1 4Å; Y76-I80 HydrophobicContact CE1-CG2 3.98Å; Y76-I80 HydrophobicContact CE2-CG2 3.76Å; Y76-I80 HydrophobicContact CG-CG2 4.47Å; Y76-I80 WeakPolarHBondContact O-CG1 3.28Å; Y76-I80 WeakPolarHBondContact O-CG2 3.46Å; Y76-I80 PolarHBondContact O-N 2.85Å; Y76-M134 PolarHBondContact OH-N 3.4Å
77	L	96.3	Very high	95.4	Very high	0 Å²	0	71.4 Å²	71.4	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-61.6	-41.7	-178	-69	171.1	0	0	0	111.7	F69 R73 E74 I80 W81 I97 M104 L128	F69-L77 HydrophobicContact CB-CD1 3.9Å; F69-L77 HydrophobicContact CD1-CD1 3.77Å; F69-L77 HydrophobicContact CD2-CD1 3.54Å; F69-L77 HydrophobicContact CE1-CD1 4.1Å; F69-L77 HydrophobicContact CE2-CD1 3.93Å; F69-L77 HydrophobicContact CG-CD1 3.45Å; F69-L77 VanDerWaalsContact CG-CD1 3.45Å; F69-L77 HydrophobicContact CZ-CD1 4.18Å; R73-L77 HydrophobicContact CB-CD1 4.36Å; R73-L77 HydrophobicContact CG-CD1 3.94Å; R73-L77 HydrophobicContact CG-CG 4Å; R73-L77 WeakPolarHBondContact O-CG 3.42Å; R73-L77 PolarHBondContact O-N 3.03Å; E74-L77 PolarHBondContact O-N 2.98Å; E74-L77 VanDerWaalsContact O-N 3.08Å; L77-I80 HydrophobicContact CD2-CD1 4.3Å; L77-I80 WeakPolarHBondContact O-CG1 3.02Å; L77-I80 PolarHBondContact O-N 2.81Å; L77-W81 VanDerWaalsContact O-CB 3.28Å; L77-W81 WeakPolarHBondContact O-CB 3.37Å; L77-W81 PolarHBondContact O-N 2.77Å; L77-I97 HydrophobicContact CB-CD1 3.75Å; L77-M104 HydrophobicContact CD1-CE 4.31Å; L77-M104 HydrophobicContact CD1-SD 3.79Å; L77-M104 HydrophobicContact CD2-SD 3.86Å; L77-M104 HydrophobicContact CG-SD 4.4Å; L77-L128 HydrophobicContact CD2-CB 3.98Å
78	T	94.8	Very high	95.4	Very high	71 Å²	71	70.3 Å²	70.3	44%	0.436	33%	0.327	S	S	.	.	H	α-helix	trans	-62.3	-42.5	176.6	-56.3	0	0	0	0	111.9	E74 Y76	E74-T78 PolarHBondContact O-N 3.15Å; E74-T78 PolarHBondContact O-OG1 2.79Å; E74-T78 VanDerWaalsContact O-OG1 3.08Å; Y76-T78 VanDerWaalsContact C-N 3.33Å; Y76-T78 PolarHBondContact O-N 2.89Å
79	E	96.1	Very high	95.3	Very high	122 Å²	122	68.8 Å²	68.8	57%	0.57	32%	0.317	S	S	*	.	H	α-helix	trans	-64	-43.8	177.8	-73.1	170	-170.6	0	0	112.2	K75 Y76	K75-E79 WeakPolarHBondContact CE-OE1 3.14Å; K75-E79 WeakPolarHBondContact O-CG 3.4Å; K75-E79 PolarHBondContact O-N 3.06Å; Y76-E79 PolarHBondContact O-N 3.08Å
80	I	95.9	Very high	95.2	Very high	22 Å²	22	74.9 Å²	74.9	11%	0.113	35%	0.346	C	S	.	.	H	α-helix	trans	-83.2	-14.5	-176.2	70	151.5	0	0	0	113.6	Y76 L77 V83 L84 L128 M134	Y76-I80 HydrophobicContact CD1-CD1 4.04Å; Y76-I80 HydrophobicContact CD1-CG1 4.19Å; Y76-I80 HydrophobicContact CD1-CG2 4.35Å; Y76-I80 HydrophobicContact CD2-CG2 4.18Å; Y76-I80 HydrophobicContact CE1-CD1 3.46Å; Y76-I80 VanDerWaalsContact CE1-CD1 3.46Å; Y76-I80 HydrophobicContact CE1-CG1 4Å; Y76-I80 HydrophobicContact CE1-CG2 3.98Å; Y76-I80 HydrophobicContact CE2-CG2 3.76Å; Y76-I80 HydrophobicContact CG-CG2 4.47Å; Y76-I80 WeakPolarHBondContact O-CG1 3.28Å; Y76-I80 WeakPolarHBondContact O-CG2 3.46Å; Y76-I80 PolarHBondContact O-N 2.85Å; L77-I80 HydrophobicContact CD2-CD1 4.3Å; L77-I80 WeakPolarHBondContact O-CG1 3.02Å; L77-I80 PolarHBondContact O-N 2.81Å; I80-V83 PolarHBondContact O-N 3.21Å; I80-V83 VanDerWaalsContact O-N 3.14Å; I80-L84 PolarHBondContact O-N 3.06Å; I80-L84 VanDerWaalsContact O-N 3.09Å; I80-L128 HydrophobicContact CD1-CD1 4.43Å; I80-L128 HydrophobicContact CD1-CD2 3.89Å; I80-M134 HydrophobicContact CB-CE 3.53Å; I80-M134 HydrophobicContact CD1-CB 3.84Å; I80-M134 HydrophobicContact CD1-CE 4.09Å; I80-M134 HydrophobicContact CD1-CG 4.04Å; I80-M134 HydrophobicContact CG1-CE 4.23Å; I80-M134 HydrophobicContact CG2-CE 4.39Å; I80-M134 WeakPolarHBondContact O-CE 3.4Å
81	W	95.3	Very high	95.1	Very high	12 Å²	12	75.1 Å²	75.1	5%	0.045	34%	0.343	C	S	.	.	H	α-helix	trans	-57.3	-43.7	-169.8	-157.5	-103.3	0	0	0	114.9	L77 V83 L84 R85 V95 E96 I97 M104	L77-W81 VanDerWaalsContact O-CB 3.28Å; L77-W81 WeakPolarHBondContact O-CB 3.37Å; L77-W81 PolarHBondContact O-N 2.77Å; W81-V83 VanDerWaalsContact C-N 3.26Å; W81-V83 PolarHBondContact O-N 2.85Å; W81-L84 HydrophobicContact CE3-CD2 4.03Å; W81-L84 HydrophobicContact CH2-CD2 4.32Å; W81-L84 HydrophobicContact CZ3-CD2 3.83Å; W81-L84 PolarHBondContact O-N 3.26Å; W81-R85 WeakPolarHBondContact O-CB 3.3Å; W81-R85 PolarHBondContact O-N 3.12Å; W81-V95 HydrophobicContact CH2-CG1 3.33Å; W81-V95 HydrophobicContact CZ2-CB 3.99Å; W81-V95 HydrophobicContact CZ2-CG1 3.19Å; W81-V95 HydrophobicContact CZ3-CG1 4.38Å; W81-E96 VanDerWaalsContact CZ2-O 3.28Å; W81-E96 WeakPolarHBondContact CZ2-O 3.33Å; W81-I97 HydrophobicContact CD2-CB 3.77Å; W81-I97 HydrophobicContact CD2-CD1 4.31Å; W81-I97 HydrophobicContact CD2-CG2 3.62Å; W81-I97 HydrophobicContact CE3-CB 3.97Å; W81-I97 HydrophobicContact CE3-CD1 3.87Å; W81-I97 HydrophobicContact CE3-CG1 4.45Å; W81-I97 HydrophobicContact CE3-CG2 4.24Å; W81-I97 HydrophobicContact CG-CB 4.47Å; W81-I97 HydrophobicContact CG-CG2 3.8Å; W81-I97 HydrophobicContact CH2-CB 3.74Å; W81-I97 HydrophobicContact CZ2-CB 3.55Å; W81-I97 HydrophobicContact CZ2-CG2 4.05Å; W81-I97 HydrophobicContact CZ3-CB 3.95Å; W81-I97 HydrophobicContact CZ3-CD1 4.09Å; W81-I97 HydrophobicContact CZ3-CG1 4.39Å; W81-M104 HydrophobicContact CH2-CB 4.07Å; W81-M104 HydrophobicContact CH2-CG 3.81Å; W81-M104 HydrophobicContact CH2-SD 4.31Å; W81-M104 HydrophobicContact CZ3-CB 4.46Å; W81-M104 HydrophobicContact CZ3-CG 3.75Å; W81-M104 HydrophobicContact CZ3-SD 3.78Å
82	P	96	Very high	95	Very high	79 Å²	79	70.5 Å²	70.5	51%	0.513	32%	0.324	S	S	.	.	H	α-helix	trans	-61.1	-36.4	179.1	-23.5	35.2	0	0	0	112.5	R86	P82-R86 WeakPolarHBondContact O-CG 3.35Å; P82-R86 PolarHBondContact O-N 2.86Å
83	V	96.2	Very high	95.1	Very high	55 Å²	55	63.2 Å²	63.2	33%	0.333	30%	0.295	S	S	.	.	H	α-helix	trans	-70.8	-44.1	178.1	-178.8	0	0	0	0	110.4	I80 W81 R85 R86 I87 M134	I80-V83 PolarHBondContact O-N 3.21Å; I80-V83 VanDerWaalsContact O-N 3.14Å; W81-V83 VanDerWaalsContact C-N 3.26Å; W81-V83 PolarHBondContact O-N 2.85Å; V83-R85 VanDerWaalsContact C-N 3.3Å; V83-R85 PolarHBondContact O-N 2.75Å; V83-R86 PolarHBondContact O-N 2.86Å; V83-I87 HydrophobicContact CG1-CD1 4.27Å; V83-I87 PolarHBondContact O-N 3.41Å; V83-M134 HydrophobicContact CB-CE 3.5Å; V83-M134 HydrophobicContact CB-SD 4.5Å; V83-M134 HydrophobicContact CG1-CE 3.68Å; V83-M134 HydrophobicContact CG1-SD 4.05Å
84	L	95.8	Very high	95.2	Very high	0 Å²	0	67.9 Å²	67.9	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-61.2	-41.2	177.3	-178.2	66.3	0	0	0	111.3	I80 W81 R86 I87 M88 V95 V124 L128 M134	I80-L84 PolarHBondContact O-N 3.06Å; I80-L84 VanDerWaalsContact O-N 3.09Å; W81-L84 HydrophobicContact CE3-CD2 4.03Å; W81-L84 HydrophobicContact CH2-CD2 4.32Å; W81-L84 HydrophobicContact CZ3-CD2 3.83Å; W81-L84 PolarHBondContact O-N 3.26Å; L84-R86 VanDerWaalsContact C-N 3.33Å; L84-R86 PolarHBondContact O-N 2.83Å; L84-I87 PolarHBondContact O-N 3.33Å; L84-M88 HydrophobicContact CD1-CE 3.99Å; L84-M88 HydrophobicContact CD1-CG 4.21Å; L84-M88 HydrophobicContact CG-CG 4.37Å; L84-M88 WeakPolarHBondContact O-CB 3.3Å; L84-M88 VanDerWaalsContact O-CG 3.3Å; L84-M88 WeakPolarHBondContact O-CG 3.44Å; L84-M88 PolarHBondContact O-N 2.56Å; L84-V95 HydrophobicContact CD2-CG1 4.48Å; L84-V124 HydrophobicContact CD1-CG1 4.15Å; L84-L128 HydrophobicContact CD1-CD1 4.38Å; L84-L128 HydrophobicContact CD2-CD1 3.58Å; L84-M134 HydrophobicContact CB-CE 4.03Å
85	R	96.2	Very high	95.3	Very high	101 Å²	101	65.2 Å²	65.2	38%	0.381	30%	0.3	S	S	.	.	H	α-helix	trans	-58.8	-42.4	176.3	-174.1	-174.7	-62	-75	1.8	111.7	W81 V83 M89 V95	W81-R85 WeakPolarHBondContact O-CB 3.3Å; W81-R85 PolarHBondContact O-N 3.12Å; V83-R85 VanDerWaalsContact C-N 3.3Å; V83-R85 PolarHBondContact O-N 2.75Å; R85-M89 HydrophobicContact CG-CG 4.44Å; R85-M89 WeakPolarHBondContact O-CB 3.27Å; R85-M89 WeakPolarHBondContact O-CG 3.47Å; R85-M89 PolarHBondContact O-N 3.02Å; R85-V95 PolarHBondContact NH1-O 3.47Å; R85-V95 PolarHBondContact NH2-O 3.28Å
86	R	96.2	Very high	95.3	Very high	167 Å²	167	60.1 Å²	60.1	63%	0.63	28%	0.279	S	S	*	.	H	α-helix	trans	-61.4	-50	177.9	-71.5	-175	-62.4	176.6	3.3	111.7	P82 V83 L84 M88 M89 E90	P82-R86 WeakPolarHBondContact O-CG 3.35Å; P82-R86 PolarHBondContact O-N 2.86Å; V83-R86 PolarHBondContact O-N 2.86Å; L84-R86 VanDerWaalsContact C-N 3.33Å; L84-R86 PolarHBondContact O-N 2.83Å; R86-M88 PolarHBondContact O-N 2.93Å; R86-M89 PolarHBondContact O-N 3.44Å; R86-E90 PolarHBondContact O-N 3.03Å
87	I	95.7	Very high	95.2	Very high	36 Å²	36	59.1 Å²	59.1	19%	0.185	28%	0.277	C	S	.	.	H	α-helix	trans	-63.2	-41.9	-178.3	-63.1	171.4	0	0	0	111.2	V83 L84 M89 E90 I138 L141	V83-I87 HydrophobicContact CG1-CD1 4.27Å; V83-I87 PolarHBondContact O-N 3.41Å; L84-I87 PolarHBondContact O-N 3.33Å; I87-M89 VanDerWaalsContact C-N 3.32Å; I87-M89 PolarHBondContact O-N 3.21Å; I87-E90 WeakPolarHBondContact O-CB 3.06Å; I87-E90 PolarHBondContact O-N 3.28Å; I87-I138 HydrophobicContact CD1-CD1 3.38Å; I87-I138 HydrophobicContact CD1-CG1 4.21Å; I87-I138 HydrophobicContact CD1-CG2 4.47Å; I87-I138 HydrophobicContact CG2-CG2 4.04Å; I87-L141 HydrophobicContact CG2-CD1 3.86Å
88	M	95.1	Very high	95.2	Very high	0 Å²	0	62 Å²	62	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-71.1	-28.6	179.3	-69.3	-79.3	-177.3	0	0	112.8	L84 R86 E90 H91 H92 I93 V95 A121 V124 L141	L84-M88 HydrophobicContact CD1-CE 3.99Å; L84-M88 HydrophobicContact CD1-CG 4.21Å; L84-M88 HydrophobicContact CG-CG 4.37Å; L84-M88 WeakPolarHBondContact O-CB 3.3Å; L84-M88 VanDerWaalsContact O-CG 3.3Å; L84-M88 WeakPolarHBondContact O-CG 3.44Å; L84-M88 PolarHBondContact O-N 2.56Å; R86-M88 PolarHBondContact O-N 2.93Å; M88-E90 VanDerWaalsContact C-N 3.32Å; M88-H91 CarbonylContact O-C 3.29Å; M88-H91 PolarHBondContact O-N 2.9Å; M88-H92 PolarHBondContact O-N 3.42Å; M88-I93 CarbonylContact C-O 3.6Å; M88-I93 HydrophobicContact CB-CB 4.42Å; M88-I93 PolarHBondContact O-N 2.66Å; M88-V95 HydrophobicContact CB-CG2 3.53Å; M88-V95 HydrophobicContact CG-CG2 3.66Å; M88-V95 HydrophobicContact SD-CG2 4.39Å; M88-A121 HydrophobicContact CE-CB 4.11Å; M88-A121 HydrophobicContact SD-CB 3.82Å; M88-V124 HydrophobicContact CE-CB 3.74Å; M88-V124 HydrophobicContact CE-CG1 3.64Å; M88-V124 HydrophobicContact CE-CG2 3.88Å; M88-L141 HydrophobicContact CE-CD1 4.27Å; M88-L141 HydrophobicContact CE-CD2 4.1Å; M88-L141 HydrophobicContact SD-CD1 4.42Å; M88-L141 HydrophobicContact SD-CD2 4.3Å
89	M	94	Very high	95.2	Very high	101 Å²	101	61.3 Å²	61.3	50%	0.498	29%	0.288	S	S	.	.	H	α-helix	trans	-69.9	-25.5	174.7	-77.5	-66.3	-58.4	0	0	113.1	R85 R86 I87 H91 H92	R85-M89 HydrophobicContact CG-CG 4.44Å; R85-M89 WeakPolarHBondContact O-CB 3.27Å; R85-M89 WeakPolarHBondContact O-CG 3.47Å; R85-M89 PolarHBondContact O-N 3.02Å; R86-M89 PolarHBondContact O-N 3.44Å; I87-M89 VanDerWaalsContact C-N 3.32Å; I87-M89 PolarHBondContact O-N 3.21Å; M89-H91 PolarHBondContact O-N 3.24Å; M89-H92 WeakPolarHBondContact O-CA 3.41Å; M89-H92 PolarHBondContact O-N 3.23Å
90	E	93.1	Very high	95.1	Very high	137 Å²	137	60 Å²	60	64%	0.64	30%	0.298	S	S	*	.	H	α-helix	trans	-59.7	-33.7	171	-64.8	172.1	-169	0	0	111.2	R86 I87 M88 H92	R86-E90 PolarHBondContact O-N 3.03Å; I87-E90 WeakPolarHBondContact O-CB 3.06Å; I87-E90 PolarHBondContact O-N 3.28Å; M88-E90 VanDerWaalsContact C-N 3.32Å; E90-H92 VanDerWaalsContact C-N 3.35Å
91	H	91.7	Very high	95	Very high	51 Å²	51	65.3 Å²	65.3	24%	0.236	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91	8.7	173.4	-60.7	-70.8	0	0	0	114	M88 M89 I93 I117	M88-H91 CarbonylContact O-C 3.29Å; M88-H91 PolarHBondContact O-N 2.9Å; M89-H91 PolarHBondContact O-N 3.24Å; H91-I93 VanDerWaalsContact C-N 3.27Å; H91-I93 HydrophobicContact CB-CD1 4.09Å; H91-I93 HydrophobicContact CB-CG1 4.16Å; H91-I93 PolarHBondContact O-N 3.46Å; H91-I117 HydrophobicContact CB-CG1 3.9Å
92	H	92.9	Very high	95	Very high	67 Å²	67	66 Å²	66	31%	0.31	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.4	32.5	-177.5	-56.4	79.2	0	0	0	114.3	M88 M89 E90 T109 K111 T112	M88-H92 PolarHBondContact O-N 3.42Å; M89-H92 WeakPolarHBondContact O-CA 3.41Å; M89-H92 PolarHBondContact O-N 3.23Å; E90-H92 VanDerWaalsContact C-N 3.35Å; H92-T109 WeakPolarHBondContact O-CB 3.38Å; H92-T109 VanDerWaalsContact O-CG2 3.27Å; H92-T109 WeakPolarHBondContact O-CG2 3.46Å; H92-T109 PolarHBondContact O-OG1 3.13Å; H92-K111 HydrophobicContact CB-CB 4.19Å; H92-T112 PolarHBondContact O-OG1 2.86Å
93	I	95.2	Very high	95	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	129	177.6	-58.3	175.5	0	0	0	109.8	M88 H91 V95 V106 I117 I118 A121	M88-I93 CarbonylContact C-O 3.6Å; M88-I93 HydrophobicContact CB-CB 4.42Å; M88-I93 PolarHBondContact O-N 2.66Å; H91-I93 VanDerWaalsContact C-N 3.27Å; H91-I93 HydrophobicContact CB-CD1 4.09Å; H91-I93 HydrophobicContact CB-CG1 4.16Å; H91-I93 PolarHBondContact O-N 3.46Å; I93-V95 HydrophobicContact CG2-CG2 4.34Å; I93-V106 HydrophobicContact CG2-CG1 3.22Å; I93-I117 HydrophobicContact CD1-CB 4.16Å; I93-I117 HydrophobicContact CD1-CG1 3.66Å; I93-I117 HydrophobicContact CD1-CG2 3.67Å; I93-I117 HydrophobicContact CG1-CG2 4.19Å; I93-I118 HydrophobicContact CG2-CD1 4.48Å; I93-A121 HydrophobicContact CD1-CB 3.71Å; I93-A121 HydrophobicContact CG2-CB 4.34Å
94	R	95.8	Very high	95	Very high	130 Å²	130	60.5 Å²	60.5	49%	0.491	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	130.9	174.9	-179	175.2	177.4	159.8	-1.4	109.4	E96 V106 R107 T109	R94-E96 HydrophobicContact CG-CG 4.35Å; R94-E96 IonicContact CZ-OE1 3.07Å; R94-E96 IonicContact NE-OE1 3.03Å; R94-E96 PolarHBondContact NE-OE1 2.81Å; R94-E96 IonicContact NH2-OE1 2.65Å; R94-E96 PolarHBondContact NH2-OE1 3.06Å; R94-V106 CarbonylContact O-C 3.58Å; R94-V106 WeakPolarHBondContact O-CA 3.48Å; R94-R107 HydrophobicContact CB-CB 4.4Å; R94-R107 PolarHBondContact N-O 3.45Å; R94-R107 PolarHBondContact O-N 2.87Å; R94-T109 HydrophobicContact CB-CG2 3.97Å
95	V	96.5	Very high	95.1	Very high	1 Å²	1	62 Å²	62	1%	0.006	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	131.4	178.1	-165.4	0	0	0	0	109.6	W81 L84 R85 M88 I93 E105 V106	W81-V95 HydrophobicContact CH2-CG1 3.33Å; W81-V95 HydrophobicContact CZ2-CB 3.99Å; W81-V95 HydrophobicContact CZ2-CG1 3.19Å; W81-V95 HydrophobicContact CZ3-CG1 4.38Å; L84-V95 HydrophobicContact CD2-CG1 4.48Å; R85-V95 PolarHBondContact NH1-O 3.47Å; R85-V95 PolarHBondContact NH2-O 3.28Å; M88-V95 HydrophobicContact CB-CG2 3.53Å; M88-V95 HydrophobicContact CG-CG2 3.66Å; M88-V95 HydrophobicContact SD-CG2 4.39Å; I93-V95 HydrophobicContact CG2-CG2 4.34Å; V95-E105 CarbonylContact C-O 3.53Å; V95-E105 WeakPolarHBondContact CA-O 3.23Å; V95-E105 WeakPolarHBondContact CG1-O 3.42Å; V95-V106 HydrophobicContact CG1-CG2 4.14Å; V95-V106 HydrophobicContact CG2-CG2 4.41Å
96	E	95.7	Very high	95.1	Very high	50 Å²	50	57.2 Å²	57.2	23%	0.234	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	141.9	-179.4	-61.5	-174.1	145.6	0	0	110.4	W81 R94 E105 R107	W81-E96 VanDerWaalsContact CZ2-O 3.28Å; W81-E96 WeakPolarHBondContact CZ2-O 3.33Å; R94-E96 HydrophobicContact CG-CG 4.35Å; R94-E96 IonicContact CZ-OE1 3.07Å; R94-E96 IonicContact NE-OE1 3.03Å; R94-E96 PolarHBondContact NE-OE1 2.81Å; R94-E96 IonicContact NH2-OE1 2.65Å; R94-E96 PolarHBondContact NH2-OE1 3.06Å; E96-E105 PolarHBondContact N-O 3.05Å; E96-E105 PolarHBondContact O-N 3.21Å; E96-R107 IonicContact OE2-CZ 3.1Å; E96-R107 IonicContact OE2-NE 2.75Å; E96-R107 IonicContact OE2-NH1 3.93Å; E96-R107 PolarHBondContact OE2-NH1 3.45Å
97	I	95.5	Very high	95.1	Very high	40 Å²	40	53.7 Å²	53.7	21%	0.205	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	124.4	175.5	-174.9	167.7	0	0	0	107.2	F69 L77 W81 V99 M104	F69-I97 HydrophobicContact CE1-CD1 4.2Å; F69-I97 HydrophobicContact CE1-CG1 4.05Å; F69-I97 HydrophobicContact CZ-CD1 4.14Å; F69-I97 HydrophobicContact CZ-CG1 4.22Å; L77-I97 HydrophobicContact CB-CD1 3.75Å; W81-I97 HydrophobicContact CD2-CB 3.77Å; W81-I97 HydrophobicContact CD2-CD1 4.31Å; W81-I97 HydrophobicContact CD2-CG2 3.62Å; W81-I97 HydrophobicContact CE3-CB 3.97Å; W81-I97 HydrophobicContact CE3-CD1 3.87Å; W81-I97 HydrophobicContact CE3-CG1 4.45Å; W81-I97 HydrophobicContact CE3-CG2 4.24Å; W81-I97 HydrophobicContact CG-CB 4.47Å; W81-I97 HydrophobicContact CG-CG2 3.8Å; W81-I97 HydrophobicContact CH2-CB 3.74Å; W81-I97 HydrophobicContact CZ2-CB 3.55Å; W81-I97 HydrophobicContact CZ2-CG2 4.05Å; W81-I97 HydrophobicContact CZ3-CB 3.95Å; W81-I97 HydrophobicContact CZ3-CD1 4.09Å; W81-I97 HydrophobicContact CZ3-CG1 4.39Å; I97-V99 HydrophobicContact CG1-CG2 4.44Å; I97-M104 HydrophobicContact CG1-CG 4.31Å
98	D	95.7	Very high	95	Very high	59 Å²	59	52.5 Å²	52.5	32%	0.316	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	109.7	167.9	-172.1	-11.9	0	0	0	108.6	A100 E101 S102 T103	D98-A100 WeakPolarHBondContact OD1-CB 3.17Å; D98-A100 PolarHBondContact OD1-N 3.31Å; D98-E101 HydrophobicContact CB-CB 4.38Å; D98-E101 PolarHBondContact OD1-N 3.48Å; D98-E101 VanDerWaalsContact OD2-CG 3.3Å; D98-E101 WeakPolarHBondContact OD2-CG 3.33Å; D98-S102 CarbonylContact O-C 3.58Å; D98-S102 WeakPolarHBondContact O-CA 3.28Å; D98-S102 PolarHBondContact O-N 2.98Å; D98-T103 PolarHBondContact N-O 2.77Å; D98-T103 PolarHBondContact O-N 2.88Å
99	V	93.8	Very high	94.9	Very high	57 Å²	57	54.2 Å²	54.2	35%	0.345	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-33.7	179.4	177.1	0	0	0	0	111.1	E74 I97 S102	E74-V99 VanDerWaalsContact CD-CG1 3.44Å; E74-V99 HydrophobicContact CG-CG1 3.79Å; E74-V99 WeakPolarHBondContact OE1-CG1 3.32Å; I97-V99 HydrophobicContact CG1-CG2 4.44Å; V99-S102 PolarHBondContact O-N 3.28Å
100	A	94.2	Very high	94.7	Very high	94 Å²	94	54.6 Å²	54.6	78%	0.777	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-45.9	-177.8	0	0	0	0	0	111.2	D98 S102	D98-A100 WeakPolarHBondContact OD1-CB 3.17Å; D98-A100 PolarHBondContact OD1-N 3.31Å; A100-S102 VanDerWaalsContact C-N 3.32Å
101	E	94.2	Very high	94.5	Very high	135 Å²	135	55.1 Å²	55.1	63%	0.631	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-8.5	176.3	-64.6	-172.4	171.6	0	0	113.5	D98 T103	D98-E101 HydrophobicContact CB-CB 4.38Å; D98-E101 PolarHBondContact OD1-N 3.48Å; D98-E101 VanDerWaalsContact OD2-CG 3.3Å; D98-E101 WeakPolarHBondContact OD2-CG 3.33Å; E101-T103 VanDerWaalsContact C-N 3.31Å; E101-T103 HydrophobicContact CB-CG2 3.88Å; E101-T103 PolarHBondContact O-N 2.94Å
102	S	95.2	Very high	94.5	Very high	26 Å²	26	52.7 Å²	52.7	18%	0.182	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.7	43.6	-171.8	-56.8	0	0	0	0	112.6	L68 F69 D98 V99 A100	L68-S102 WeakPolarHBondContact CA-O 3.3Å; F69-S102 VanDerWaalsContact CD1-C 3.49Å; F69-S102 WeakPolarHBondContact CD1-O 3.42Å; F69-S102 WeakPolarHBondContact CE1-O 3.44Å; F69-S102 PolarHBondContact N-O 2.92Å; D98-S102 CarbonylContact O-C 3.58Å; D98-S102 WeakPolarHBondContact O-CA 3.28Å; D98-S102 PolarHBondContact O-N 2.98Å; V99-S102 PolarHBondContact O-N 3.28Å; A100-S102 VanDerWaalsContact C-N 3.32Å
103	T	96.8	Very high	94.3	Very high	18 Å²	18	50.9 Å²	50.9	11%	0.11	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	145.4	-179.1	67.5	0	0	0	0	112.1	T66 L68 D98 E101	T66-T103 HydrophobicContact CG2-CG2 4.33Å; L68-T103 HydrophobicContact CD2-CG2 4.22Å; L68-T103 HydrophobicContact CG-CG2 4.14Å; D98-T103 PolarHBondContact N-O 2.77Å; D98-T103 PolarHBondContact O-N 2.88Å; E101-T103 VanDerWaalsContact C-N 3.31Å; E101-T103 HydrophobicContact CB-CG2 3.88Å; E101-T103 PolarHBondContact O-N 2.94Å
104	M	96.6	Very high	94.1	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	133.8	169.8	-69.2	173.9	-62.6	0	0	108.4	T66 T67 F69 L77 W81 I97 I125 L128 A129	T66-M104 CarbonylContact C-O 3.59Å; T66-M104 VanDerWaalsContact CA-O 3.27Å; T66-M104 WeakPolarHBondContact CA-O 3.25Å; T67-M104 PolarHBondContact N-O 3.38Å; T67-M104 PolarHBondContact O-N 3.02Å; F69-M104 HydrophobicContact CB-CE 4.04Å; F69-M104 HydrophobicContact CD1-CE 3.97Å; F69-M104 HydrophobicContact CD1-CG 3.68Å; F69-M104 HydrophobicContact CD1-SD 4.18Å; F69-M104 HydrophobicContact CE1-CG 3.82Å; F69-M104 HydrophobicContact CG-CE 4.39Å; L77-M104 HydrophobicContact CD1-CE 4.31Å; L77-M104 HydrophobicContact CD1-SD 3.79Å; L77-M104 HydrophobicContact CD2-SD 3.86Å; L77-M104 HydrophobicContact CG-SD 4.4Å; W81-M104 HydrophobicContact CH2-CB 4.07Å; W81-M104 HydrophobicContact CH2-CG 3.81Å; W81-M104 HydrophobicContact CH2-SD 4.31Å; W81-M104 HydrophobicContact CZ3-CB 4.46Å; W81-M104 HydrophobicContact CZ3-CG 3.75Å; W81-M104 HydrophobicContact CZ3-SD 3.78Å; I97-M104 HydrophobicContact CG1-CG 4.31Å; M104-I125 HydrophobicContact CB-CB 4.38Å; M104-I125 HydrophobicContact CB-CG2 4.36Å; M104-I125 HydrophobicContact CE-CB 4.32Å; M104-I125 WeakPolarHBondContact CE-O 3.37Å; M104-L128 HydrophobicContact CE-CB 4.42Å; M104-L128 HydrophobicContact SD-CB 4.47Å; M104-A129 HydrophobicContact CE-CB 3.79Å
105	E	96.8	Very high	93.8	Very high	33 Å²	33	49.1 Å²	49.1	15%	0.154	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	141.2	-179.9	-171	174.8	-176.4	0	0	111.6	Y65 V95 E96 R107	Y65-E105 CarbonylContact O-C 3.57Å; Y65-E105 WeakPolarHBondContact O-CA 3.38Å; V95-E105 CarbonylContact C-O 3.53Å; V95-E105 WeakPolarHBondContact CA-O 3.23Å; V95-E105 WeakPolarHBondContact CG1-O 3.42Å; E96-E105 PolarHBondContact N-O 3.05Å; E96-E105 PolarHBondContact O-N 3.21Å; E105-R107 VanDerWaalsContact CD-CZ 3.42Å; E105-R107 HydrophobicContact CG-CG 4.04Å; E105-R107 IonicContact OE1-CZ 3.52Å; E105-R107 IonicContact OE1-NE 3.23Å; E105-R107 PolarHBondContact OE1-NE 3.33Å; E105-R107 IonicContact OE1-NH2 2.78Å; E105-R107 PolarHBondContact OE1-NH2 3.2Å; E105-R107 IonicContact OE2-CZ 3.69Å; E105-R107 IonicContact OE2-NE 3.4Å; E105-R107 PolarHBondContact OE2-NE 2.96Å; E105-R107 IonicContact OE2-NH2 2.9Å; E105-R107 PolarHBondContact OE2-NH2 3.26Å
106	V	96.9	Very high	93.6	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	129	174.9	-179.6	0	0	0	0	107.9	S64 Y65 I93 R94 V95 I118 A121 I125	S64-V106 CarbonylContact C-O 3.37Å; S64-V106 VanDerWaalsContact CA-O 3.24Å; S64-V106 WeakPolarHBondContact CA-O 3.46Å; Y65-V106 PolarHBondContact N-O 3.1Å; Y65-V106 PolarHBondContact O-N 3.02Å; I93-V106 HydrophobicContact CG2-CG1 3.22Å; R94-V106 CarbonylContact O-C 3.58Å; R94-V106 WeakPolarHBondContact O-CA 3.48Å; V95-V106 HydrophobicContact CG1-CG2 4.14Å; V95-V106 HydrophobicContact CG2-CG2 4.41Å; V106-I118 HydrophobicContact CB-CD1 4.4Å; V106-I118 HydrophobicContact CG1-CD1 3.54Å; V106-A121 HydrophobicContact CG1-CB 3.6Å; V106-I125 HydrophobicContact CB-CD1 4.42Å; V106-I125 HydrophobicContact CG2-CB 4.37Å; V106-I125 HydrophobicContact CG2-CD1 3.73Å; V106-I125 HydrophobicContact CG2-CG1 4.19Å; V106-I125 HydrophobicContact CG2-CG2 3.36Å
107	R	95.6	Very high	93.5	Very high	93 Å²	93	51.9 Å²	51.9	35%	0.351	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	135.6	-177.7	-61.3	-179.6	169.3	160.2	-3.6	110.7	S63 R94 E96 E105	S63-R107 WeakPolarHBondContact O-CA 3.33Å; R94-R107 HydrophobicContact CB-CB 4.4Å; R94-R107 PolarHBondContact N-O 3.45Å; R94-R107 PolarHBondContact O-N 2.87Å; E96-R107 IonicContact OE2-CZ 3.1Å; E96-R107 IonicContact OE2-NE 2.75Å; E96-R107 IonicContact OE2-NH1 3.93Å; E96-R107 PolarHBondContact OE2-NH1 3.45Å; E105-R107 VanDerWaalsContact CD-CZ 3.42Å; E105-R107 HydrophobicContact CG-CG 4.04Å; E105-R107 IonicContact OE1-CZ 3.52Å; E105-R107 IonicContact OE1-NE 3.23Å; E105-R107 PolarHBondContact OE1-NE 3.33Å; E105-R107 IonicContact OE1-NH2 2.78Å; E105-R107 PolarHBondContact OE1-NH2 3.2Å; E105-R107 IonicContact OE2-CZ 3.69Å; E105-R107 IonicContact OE2-NE 3.4Å; E105-R107 PolarHBondContact OE2-NE 2.96Å; E105-R107 IonicContact OE2-NH2 2.9Å; E105-R107 PolarHBondContact OE2-NH2 3.26Å
108	T	94.9	Very high	93.4	Very high	11 Å²	11	50.2 Å²	50.2	7%	0.067	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	142.3	166.5	54.4	0	0	0	0	110.4	L59 S62 S63 T112 I118	L59-T108 HydrophobicContact CD1-CG2 4.12Å; S62-T108 WeakPolarHBondContact CA-OG1 3.45Å; S63-T108 PolarHBondContact N-OG1 3.45Å; S63-T108 PolarHBondContact O-N 2.97Å; S63-T108 PolarHBondContact O-OG1 3.4Å; T108-T112 HydrophobicContact CG2-CG2 4.49Å; T108-I118 HydrophobicContact CG2-CB 3.75Å; T108-I118 HydrophobicContact CG2-CD1 3.78Å; T108-I118 HydrophobicContact CG2-CG1 3.69Å; T108-I118 HydrophobicContact CG2-CG2 4.33Å
109	T	92.6	Very high	93.4	Very high	35 Å²	35	49.6 Å²	49.6	22%	0.215	27%	0.269	C	S	.	.			trans	-99.6	164.4	169.5	71.7	0	0	0	0	111	H92 R94 K111 T112	H92-T109 WeakPolarHBondContact O-CB 3.38Å; H92-T109 VanDerWaalsContact O-CG2 3.27Å; H92-T109 WeakPolarHBondContact O-CG2 3.46Å; H92-T109 PolarHBondContact O-OG1 3.13Å; R94-T109 HydrophobicContact CB-CG2 3.97Å; T109-K111 PolarHBondContact O-N 3.17Å; T109-K111 PolarHBondContact OG1-N 3.31Å; T109-T112 PolarHBondContact N-OG1 2.94Å; T109-T112 WeakPolarHBondContact O-CB 3.38Å; T109-T112 PolarHBondContact O-N 3.44Å; T109-T112 PolarHBondContact O-OG1 2.86Å
110	P	89	Confident	93.5	Very high	110 Å²	110	47.2 Å²	47.2	71%	0.714	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-14.5	173.8	-25.4	35.3	0	0	0	114.8	R58	R58-P110 WeakPolarHBondContact CB-O 3.46Å
111	K	89.4	Confident	93.6	Very high	147 Å²	147	42.8 Å²	42.8	64%	0.639	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.9	-0.7	178	-61.1	-176.1	177.4	-175.5	0	113.2	H92 T109 F113	H92-K111 HydrophobicContact CB-CB 4.19Å; T109-K111 PolarHBondContact O-N 3.17Å; T109-K111 PolarHBondContact OG1-N 3.31Å; K111-F113 PolarHBondContact O-N 3.43Å; K111-F113 VanDerWaalsContact O-N 3.17Å
112	T	91.5	Very high	93.7	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.196	C	C	.	.			trans	-65.2	117.7	177.2	-40.6	0	0	0	0	107.9	L59 H92 T108 T109 I117	L59-T112 HydrophobicContact CD1-CG2 4.05Å; L59-T112 WeakPolarHBondContact CG-O 3.43Å; L59-T112 PolarHBondContact N-O 3.28Å; H92-T112 PolarHBondContact O-OG1 2.86Å; T108-T112 HydrophobicContact CG2-CG2 4.49Å; T109-T112 PolarHBondContact N-OG1 2.94Å; T109-T112 WeakPolarHBondContact O-CB 3.38Å; T109-T112 PolarHBondContact O-N 3.44Å; T109-T112 PolarHBondContact O-OG1 2.86Å; T112-I117 HydrophobicContact CG2-CG2 3.89Å
113	F	88.8	Confident	93.8	Very high	29 Å²	29	39.1 Å²	39.1	13%	0.127	20%	0.196	C	C	.	.			trans	-91	-41.6	-179.2	65.5	-87.6	0	0	0	111.2	F49 P51 N54 K111	F49-F113 AromaticContact CD1-CD2 3.83Å; F49-F113 HydrophobicContact CD1-CD2 3.83Å; F49-F113 HydrophobicContact CD1-CE2 4.1Å; F49-F113 AromaticContact CE1-CD2 3.96Å; F49-F113 HydrophobicContact CE1-CD2 3.96Å; F49-F113 WeakPolarHBondContact CE1-O 3.47Å; F49-F113 WeakPolarHBondContact O-CE2 3.37Å; P51-F113 HydrophobicContact CB-CB 4.4Å; P51-F113 HydrophobicContact CB-CD1 4.36Å; P51-F113 HydrophobicContact CB-CD2 4.24Å; P51-F113 HydrophobicContact CB-CG 4.08Å; P51-F113 HydrophobicContact CG-CD1 4Å; P51-F113 HydrophobicContact CG-CD2 4.03Å; P51-F113 HydrophobicContact CG-CE1 3.96Å; P51-F113 HydrophobicContact CG-CE2 4Å; P51-F113 HydrophobicContact CG-CG 4.04Å; P51-F113 HydrophobicContact CG-CZ 3.97Å; N54-F113 HydrophobicContact CB-CB 4.45Å; N54-F113 PolarHBondContact ND2-O 3.12Å; K111-F113 PolarHBondContact O-N 3.43Å; K111-F113 VanDerWaalsContact O-N 3.17Å
114	D	90.2	Very high	93.8	Very high	20 Å²	20	38.3 Å²	38.3	11%	0.107	19%	0.191	C	C	.	.			trans	-80	121.7	-179.8	-179.5	-3.6	0	0	0	111.1	F49 F116 I117	F49-D114 HydrophobicContact CD1-CB 3.98Å; D114-F116 PolarHBondContact OD1-N 3Å; D114-I117 HydrophobicContact CB-CB 4.04Å; D114-I117 HydrophobicContact CB-CG2 3.93Å; D114-I117 WeakPolarHBondContact O-CG2 3.49Å; D114-I117 PolarHBondContact OD1-N 3.28Å; D114-I117 WeakPolarHBondContact OD2-CB 3.1Å
115	P	90.2	Very high	93.8	Very high	74 Å²	74	38.3 Å²	38.3	48%	0.481	19%	0.191	S	C	.	.	S	Bend	trans	-71.7	-24.6	176.3	28.8	-34.9	0	0	0	114.3	L59	L59-P115 HydrophobicContact CD2-CB 3.81Å
116	F	91.5	Very high	93.7	Very high	105 Å²	105	41.2 Å²	41.2	46%	0.461	20%	0.2	S	C	.	.	S	Bend	trans	-92.5	-25.4	-172.7	-166.7	-101.7	0	0	0	113.2	D114 I118 L119 K120	D114-F116 PolarHBondContact OD1-N 3Å; F116-I118 PolarHBondContact O-N 2.88Å; F116-L119 HydrophobicContact CD2-CD1 3.68Å; F116-L119 HydrophobicContact CE2-CD1 3.55Å; F116-L119 HydrophobicContact CZ-CD1 4.33Å; F116-L119 WeakPolarHBondContact O-CB 3.43Å; F116-L119 PolarHBondContact O-N 2.67Å; F116-K120 HydrophobicContact CD1-CD 4.33Å; F116-K120 HydrophobicContact CD1-CG 4.22Å; F116-K120 HydrophobicContact CE1-CD 4.49Å; F116-K120 HydrophobicContact CE1-CG 4.1Å
117	I	93.4	Very high	93.7	Very high	4 Å²	4	41.2 Å²	41.2	2%	0.021	20%	0.2	C	C	.	.	H	α-helix	trans	-55.5	-29.7	-176.7	-161.2	67.2	0	0	0	113.8	H91 I93 T112 D114 L119 K120 A121 L141	H91-I117 HydrophobicContact CB-CG1 3.9Å; I93-I117 HydrophobicContact CD1-CB 4.16Å; I93-I117 HydrophobicContact CD1-CG1 3.66Å; I93-I117 HydrophobicContact CD1-CG2 3.67Å; I93-I117 HydrophobicContact CG1-CG2 4.19Å; T112-I117 HydrophobicContact CG2-CG2 3.89Å; D114-I117 HydrophobicContact CB-CB 4.04Å; D114-I117 HydrophobicContact CB-CG2 3.93Å; D114-I117 WeakPolarHBondContact O-CG2 3.49Å; D114-I117 PolarHBondContact OD1-N 3.28Å; D114-I117 WeakPolarHBondContact OD2-CB 3.1Å; I117-L119 VanDerWaalsContact C-N 3.26Å; I117-L119 PolarHBondContact O-N 2.83Å; I117-K120 HydrophobicContact CD1-CD 4.05Å; I117-K120 PolarHBondContact O-N 2.86Å; I117-A121 WeakPolarHBondContact O-CB 3.35Å; I117-A121 PolarHBondContact O-N 2.9Å; I117-L141 HydrophobicContact CD1-CD2 4.15Å
118	I	94.4	Very high	93.7	Very high	5 Å²	5	36.8 Å²	36.8	3%	0.026	18%	0.184	C	C	.	.	H	α-helix	trans	-62.8	-33.3	176.8	-171.5	60.8	0	0	0	112.4	Y65 I93 V106 T108 F116 R122	Y65-I118 HydrophobicContact CD2-CD1 4.28Å; Y65-I118 HydrophobicContact CD2-CG1 3.8Å; Y65-I118 HydrophobicContact CE2-CG1 3.78Å; Y65-I118 HydrophobicContact CE2-CG2 4.47Å; I93-I118 HydrophobicContact CG2-CD1 4.48Å; V106-I118 HydrophobicContact CB-CD1 4.4Å; V106-I118 HydrophobicContact CG1-CD1 3.54Å; T108-I118 HydrophobicContact CG2-CB 3.75Å; T108-I118 HydrophobicContact CG2-CD1 3.78Å; T108-I118 HydrophobicContact CG2-CG1 3.69Å; T108-I118 HydrophobicContact CG2-CG2 4.33Å; F116-I118 PolarHBondContact O-N 2.88Å; I118-R122 WeakPolarHBondContact O-CB 3.37Å; I118-R122 PolarHBondContact O-N 2.94Å
119	L	95.4	Very high	93.7	Very high	45 Å²	45	36.5 Å²	36.5	24%	0.236	18%	0.182	C	C	.	.	H	α-helix	trans	-71.9	-36.9	177.2	-61.4	177.3	0	0	0	111.3	Y65 F116 I117 R122 D123	Y65-L119 HydrophobicContact CE2-CD2 4.04Å; Y65-L119 WeakPolarHBondContact OH-CD2 3.47Å; F116-L119 HydrophobicContact CD2-CD1 3.68Å; F116-L119 HydrophobicContact CE2-CD1 3.55Å; F116-L119 HydrophobicContact CZ-CD1 4.33Å; F116-L119 WeakPolarHBondContact O-CB 3.43Å; F116-L119 PolarHBondContact O-N 2.67Å; I117-L119 VanDerWaalsContact C-N 3.26Å; I117-L119 PolarHBondContact O-N 2.83Å; L119-R122 WeakPolarHBondContact O-CB 3.45Å; L119-R122 PolarHBondContact O-N 3.32Å; L119-D123 VanDerWaalsContact O-CG 3.3Å; L119-D123 PolarHBondContact O-N 3.09Å; L119-D123 VanDerWaalsContact O-N 3.15Å
120	K	95.6	Very high	93.8	Very high	8 Å²	8	39.1 Å²	39.1	4%	0.035	19%	0.188	C	C	.	.	H	α-helix	trans	-67.4	-44	172.9	-68.4	175.3	167.4	-179.9	0	111.4	F116 I117 R122 D123 V124 V140 L141 D143	F116-K120 HydrophobicContact CD1-CD 4.33Å; F116-K120 HydrophobicContact CD1-CG 4.22Å; F116-K120 HydrophobicContact CE1-CD 4.49Å; F116-K120 HydrophobicContact CE1-CG 4.1Å; I117-K120 HydrophobicContact CD1-CD 4.05Å; I117-K120 PolarHBondContact O-N 2.86Å; K120-R122 VanDerWaalsContact C-N 3.3Å; K120-R122 PolarHBondContact O-N 3.48Å; K120-D123 CarbonylContact O-C 3.59Å; K120-D123 WeakPolarHBondContact O-CA 3.49Å; K120-D123 WeakPolarHBondContact O-CB 3.44Å; K120-D123 PolarHBondContact O-N 2.95Å; K120-V124 WeakPolarHBondContact O-CG2 3.38Å; K120-V124 PolarHBondContact O-N 2.72Å; K120-V140 WeakPolarHBondContact CD-O 3.29Å; K120-L141 HydrophobicContact CB-CD2 4.19Å; K120-L141 WeakPolarHBondContact CD-O 3.39Å; K120-L141 PolarHBondContact NZ-O 2.91Å; K120-D143 IonicContact NZ-OD1 3.72Å; K120-D143 PolarHBondContact NZ-OD1 2.91Å
121	A	96.4	Very high	94	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-62.5	-36.8	176.8	0	0	0	0	0	112.4	M88 I93 V106 I117 D123 V124 I125	M88-A121 HydrophobicContact CE-CB 4.11Å; M88-A121 HydrophobicContact SD-CB 3.82Å; I93-A121 HydrophobicContact CD1-CB 3.71Å; I93-A121 HydrophobicContact CG2-CB 4.34Å; V106-A121 HydrophobicContact CG1-CB 3.6Å; I117-A121 WeakPolarHBondContact O-CB 3.35Å; I117-A121 PolarHBondContact O-N 2.9Å; A121-D123 VanDerWaalsContact C-N 3.29Å; A121-D123 PolarHBondContact O-N 2.86Å; A121-V124 PolarHBondContact O-N 3.2Å; A121-I125 PolarHBondContact O-N 3.1Å; A121-I125 VanDerWaalsContact O-N 3.13Å
122	R	96.3	Very high	94.4	Very high	52 Å²	52	28.4 Å²	28.4	20%	0.196	14%	0.135	C	C	.	.	H	α-helix	trans	-58.3	-40.5	168.3	175	-153.9	74.1	-170.6	-4.3	111.9	Y65 I118 L119 K120 I125 R126	Y65-R122 HydrophobicContact CD1-CG 4.02Å; Y65-R122 HydrophobicContact CD2-CB 3.86Å; Y65-R122 HydrophobicContact CD2-CG 4.17Å; Y65-R122 HydrophobicContact CE2-CB 4.48Å; Y65-R122 HydrophobicContact CG-CB 3.93Å; Y65-R122 HydrophobicContact CG-CG 3.77Å; I118-R122 WeakPolarHBondContact O-CB 3.37Å; I118-R122 PolarHBondContact O-N 2.94Å; L119-R122 WeakPolarHBondContact O-CB 3.45Å; L119-R122 PolarHBondContact O-N 3.32Å; K120-R122 VanDerWaalsContact C-N 3.3Å; K120-R122 PolarHBondContact O-N 3.48Å; R122-I125 WeakPolarHBondContact O-CG1 3.49Å; R122-R126 VanDerWaalsContact NE-NH1 3.1Å; R122-R126 VanDerWaalsContact O-CG 3.27Å; R122-R126 WeakPolarHBondContact O-CG 3.42Å; R122-R126 PolarHBondContact O-N 3.42Å
123	D	97	Very high	94.6	Very high	32 Å²	32	30.5 Å²	30.5	17%	0.171	15%	0.148	C	C	.	.	H	α-helix	trans	-73.2	-33.5	179.9	-66	-18.8	0	0	0	111.7	L119 K120 A121 R126 L127 V140 A147	L119-D123 VanDerWaalsContact O-CG 3.3Å; L119-D123 PolarHBondContact O-N 3.09Å; L119-D123 VanDerWaalsContact O-N 3.15Å; K120-D123 CarbonylContact O-C 3.59Å; K120-D123 WeakPolarHBondContact O-CA 3.49Å; K120-D123 WeakPolarHBondContact O-CB 3.44Å; K120-D123 PolarHBondContact O-N 2.95Å; A121-D123 VanDerWaalsContact C-N 3.29Å; A121-D123 PolarHBondContact O-N 2.86Å; D123-R126 PolarHBondContact O-N 2.79Å; D123-R126 IonicContact OD1-NH1 2.67Å; D123-L127 VanDerWaalsContact O-CG 3.31Å; D123-L127 WeakPolarHBondContact O-CG 3.47Å; D123-L127 PolarHBondContact O-N 3.38Å; D123-V140 HydrophobicContact CB-CG1 4.14Å; D123-A147 HydrophobicContact CB-CB 4.08Å
124	V	96.9	Very high	94.9	Very high	1 Å²	1	30 Å²	30	1%	0.006	15%	0.146	C	C	.	.	H	α-helix	trans	-58.4	-52.2	170.8	176.7	0	0	0	0	111.4	L84 M88 K120 A121 R126 L127 L128 A137 V140 L141	L84-V124 HydrophobicContact CD1-CG1 4.15Å; M88-V124 HydrophobicContact CE-CB 3.74Å; M88-V124 HydrophobicContact CE-CG1 3.64Å; M88-V124 HydrophobicContact CE-CG2 3.88Å; K120-V124 WeakPolarHBondContact O-CG2 3.38Å; K120-V124 PolarHBondContact O-N 2.72Å; A121-V124 PolarHBondContact O-N 3.2Å; V124-R126 VanDerWaalsContact C-N 3.26Å; V124-R126 PolarHBondContact O-N 3.45Å; V124-L127 PolarHBondContact O-N 2.97Å; V124-L128 HydrophobicContact CG1-CD1 4.11Å; V124-L128 HydrophobicContact CG1-CG 4.43Å; V124-L128 WeakPolarHBondContact O-CG 3.34Å; V124-L128 PolarHBondContact O-N 3.31Å; V124-A137 HydrophobicContact CG1-CB 4.21Å; V124-V140 HydrophobicContact CG2-CB 4.33Å; V124-L141 HydrophobicContact CG2-CD2 4.04Å; V124-L141 HydrophobicContact CG2-CG 4.23Å
125	I	96.2	Very high	95.1	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-62.6	-34.6	179.4	60.5	172.8	0	0	0	112.2	M104 V106 A121 R122 L128 A129	M104-I125 HydrophobicContact CB-CB 4.38Å; M104-I125 HydrophobicContact CB-CG2 4.36Å; M104-I125 HydrophobicContact CE-CB 4.32Å; M104-I125 WeakPolarHBondContact CE-O 3.37Å; V106-I125 HydrophobicContact CB-CD1 4.42Å; V106-I125 HydrophobicContact CG2-CB 4.37Å; V106-I125 HydrophobicContact CG2-CD1 3.73Å; V106-I125 HydrophobicContact CG2-CG1 4.19Å; V106-I125 HydrophobicContact CG2-CG2 3.36Å; A121-I125 PolarHBondContact O-N 3.1Å; A121-I125 VanDerWaalsContact O-N 3.13Å; R122-I125 WeakPolarHBondContact O-CG1 3.49Å; I125-L128 PolarHBondContact O-N 3.03Å; I125-A129 WeakPolarHBondContact O-CB 3.04Å; I125-A129 PolarHBondContact O-N 2.85Å
126	R	96	Very high	95.4	Very high	94 Å²	94	34.7 Å²	34.7	36%	0.355	16%	0.161	S	C	.	.	H	α-helix	trans	-67.2	-39.9	175.8	-73.5	172	174.9	175.8	-3.9	112.2	T67 R122 D123 V124 A129 R130 I149	T67-R126 HydrophobicContact CG2-CG 4.1Å; R122-R126 VanDerWaalsContact NE-NH1 3.1Å; R122-R126 VanDerWaalsContact O-CG 3.27Å; R122-R126 WeakPolarHBondContact O-CG 3.42Å; R122-R126 PolarHBondContact O-N 3.42Å; D123-R126 PolarHBondContact O-N 2.79Å; D123-R126 IonicContact OD1-NH1 2.67Å; V124-R126 VanDerWaalsContact C-N 3.26Å; V124-R126 PolarHBondContact O-N 3.45Å; R126-A129 PolarHBondContact O-N 3.44Å; R126-R130 WeakPolarHBondContact O-CG 3.46Å; R126-R130 PolarHBondContact O-N 3.01Å; R126-I149 HydrophobicContact CB-CD1 3.76Å
127	L	96.7	Very high	95.7	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-66.2	-42.4	175	-71.7	172.7	0	0	0	111.8	D123 V124 A129 R130 S131 V132 A137 V140 A147 V196	D123-L127 VanDerWaalsContact O-CG 3.31Å; D123-L127 WeakPolarHBondContact O-CG 3.47Å; D123-L127 PolarHBondContact O-N 3.38Å; V124-L127 PolarHBondContact O-N 2.97Å; L127-A129 VanDerWaalsContact C-N 3.33Å; L127-A129 PolarHBondContact O-N 3.32Å; L127-R130 CarbonylContact O-C 3.56Å; L127-R130 WeakPolarHBondContact O-CA 3.21Å; L127-R130 PolarHBondContact O-N 3.08Å; L127-S131 PolarHBondContact O-N 3.44Å; L127-V132 HydrophobicContact CB-CB 4.03Å; L127-V132 HydrophobicContact CB-CG1 4.38Å; L127-V132 HydrophobicContact CB-CG2 4.16Å; L127-V132 HydrophobicContact CD2-CG2 4.03Å; L127-V132 WeakPolarHBondContact O-CB 3.24Å; L127-V132 PolarHBondContact O-N 2.87Å; L127-V132 VanDerWaalsContact O-N 3.1Å; L127-A137 HydrophobicContact CB-CB 4.15Å; L127-A137 HydrophobicContact CD1-CB 4.39Å; L127-V140 HydrophobicContact CD1-CG2 3.63Å; L127-A147 HydrophobicContact CD1-CB 3.72Å; L127-A147 HydrophobicContact CD2-CB 4.22Å; L127-A147 HydrophobicContact CG-CB 4.12Å; L127-V196 HydrophobicContact CD1-CG2 3.59Å; L127-V196 HydrophobicContact CD2-CG2 3.97Å; L127-V196 HydrophobicContact CG-CG2 4.45Å
128	L	95.9	Very high	95.8	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-60.8	-41.9	176.4	-71.7	176.6	0	0	0	111.9	L77 I80 L84 M104 V124 I125 R130 S131 M134 A137	L77-L128 HydrophobicContact CD2-CB 3.98Å; I80-L128 HydrophobicContact CD1-CD1 4.43Å; I80-L128 HydrophobicContact CD1-CD2 3.89Å; L84-L128 HydrophobicContact CD1-CD1 4.38Å; L84-L128 HydrophobicContact CD2-CD1 3.58Å; M104-L128 HydrophobicContact CE-CB 4.42Å; M104-L128 HydrophobicContact SD-CB 4.47Å; V124-L128 HydrophobicContact CG1-CD1 4.11Å; V124-L128 HydrophobicContact CG1-CG 4.43Å; V124-L128 WeakPolarHBondContact O-CG 3.34Å; V124-L128 PolarHBondContact O-N 3.31Å; I125-L128 PolarHBondContact O-N 3.03Å; L128-R130 PolarHBondContact O-N 3.1Å; L128-S131 PolarHBondContact O-N 3.46Å; L128-S131 VanDerWaalsContact O-N 3.12Å; L128-M134 HydrophobicContact CD2-CB 4.36Å; L128-A137 HydrophobicContact CD2-CB 4.11Å; L128-A137 HydrophobicContact CG-CB 4.28Å
129	A	95.2	Very high	95.8	Very high	5 Å²	5	36 Å²	36	4%	0.041	17%	0.165	C	C	.	.	H	α-helix	trans	-60.7	-29.3	172.8	0	0	0	0	0	112.4	T67 F69 P70 M104 I125 R126 L127 S131	T67-A129 HydrophobicContact CG2-CB 3.91Å; F69-A129 HydrophobicContact CB-CB 4.07Å; P70-A129 WeakPolarHBondContact CD-O 3.27Å; M104-A129 HydrophobicContact CE-CB 3.79Å; I125-A129 WeakPolarHBondContact O-CB 3.04Å; I125-A129 PolarHBondContact O-N 2.85Å; R126-A129 PolarHBondContact O-N 3.44Å; L127-A129 VanDerWaalsContact C-N 3.33Å; L127-A129 PolarHBondContact O-N 3.32Å; A129-S131 VanDerWaalsContact C-N 3.28Å; A129-S131 PolarHBondContact O-N 3.42Å
130	R	94.7	Very high	95.9	Very high	91 Å²	91	34 Å²	34	34%	0.343	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.5	20.3	176.7	-61.7	-61.7	180	172.7	-3	114.6	R126 L127 L128 V132 I149 Q189 T192 S194	R126-R130 WeakPolarHBondContact O-CG 3.46Å; R126-R130 PolarHBondContact O-N 3.01Å; L127-R130 CarbonylContact O-C 3.56Å; L127-R130 WeakPolarHBondContact O-CA 3.21Å; L127-R130 PolarHBondContact O-N 3.08Å; L128-R130 PolarHBondContact O-N 3.1Å; R130-V132 PolarHBondContact O-N 3.11Å; R130-I149 HydrophobicContact CG-CD1 4.25Å; R130-Q189 PolarHBondContact O-OE1 3.35Å; R130-Q189 VanDerWaalsContact O-OE1 3.06Å; R130-T192 PolarHBondContact NH1-OG1 2.93Å; R130-S194 VanDerWaalsContact CB-OG 3.29Å; R130-S194 WeakPolarHBondContact CB-OG 3.45Å
131	S	93.4	Very high	95.8	Very high	32 Å²	32	34.2 Å²	34.2	22%	0.224	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.2	21.7	178.2	-50.5	0	0	0	0	115.3	L127 L128 A129 Q189	L127-S131 PolarHBondContact O-N 3.44Å; L128-S131 PolarHBondContact O-N 3.46Å; L128-S131 VanDerWaalsContact O-N 3.12Å; A129-S131 VanDerWaalsContact C-N 3.28Å; A129-S131 PolarHBondContact O-N 3.42Å; S131-Q189 PolarHBondContact OG-NE2 3.3Å
132	V	95.8	Very high	95.7	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	18%	0.18	C	C	.	.			trans	-69.9	136.6	167.7	176.2	0	0	0	0	108.5	R73 L127 R130 Q136 A137 Y185 V187	R73-V132 PolarHBondContact NH2-O 3.2Å; R73-V132 VanDerWaalsContact NH2-O 3.15Å; L127-V132 HydrophobicContact CB-CB 4.03Å; L127-V132 HydrophobicContact CB-CG1 4.38Å; L127-V132 HydrophobicContact CB-CG2 4.16Å; L127-V132 HydrophobicContact CD2-CG2 4.03Å; L127-V132 WeakPolarHBondContact O-CB 3.24Å; L127-V132 PolarHBondContact O-N 2.87Å; L127-V132 VanDerWaalsContact O-N 3.1Å; R130-V132 PolarHBondContact O-N 3.11Å; V132-Q136 HydrophobicContact CG1-CB 4.17Å; V132-Q136 HydrophobicContact CG1-CG 4.38Å; V132-A137 HydrophobicContact CG1-CB 4.2Å; V132-Y185 HydrophobicContact CG1-CD1 4.32Å; V132-Y185 HydrophobicContact CG1-CE1 3.92Å; V132-V187 HydrophobicContact CG2-CB 4.34Å; V132-V187 HydrophobicContact CG2-CG2 4.25Å
133	P	96.2	Very high	95.4	Very high	43 Å²	43	40.2 Å²	40.2	28%	0.279	19%	0.192	S	C	.	.			trans	-61.8	147.2	173.4	-22.5	33.8	0	0	0	111.8	E135 Q136 A137 Y185	P133-E135 PolarHBondContact O-N 2.82Å; P133-Q136 PolarHBondContact O-N 3.02Å; P133-Q136 VanDerWaalsContact O-N 3.17Å; P133-A137 PolarHBondContact O-N 2.9Å; P133-Y185 WeakPolarHBondContact CD-OH 3.35Å; P133-Y185 WeakPolarHBondContact CG-OH 3.35Å
134	M	95.3	Very high	95.2	Very high	18 Å²	18	43.7 Å²	43.7	9%	0.089	21%	0.207	C	C	.	.	H	α-helix	trans	-55.9	-46.9	-178.1	-173.9	-139.7	-105.6	0	0	113	Y76 I80 V83 L84 L128 Q136 A137 I138	Y76-M134 PolarHBondContact OH-N 3.4Å; I80-M134 HydrophobicContact CB-CE 3.53Å; I80-M134 HydrophobicContact CD1-CB 3.84Å; I80-M134 HydrophobicContact CD1-CE 4.09Å; I80-M134 HydrophobicContact CD1-CG 4.04Å; I80-M134 HydrophobicContact CG1-CE 4.23Å; I80-M134 HydrophobicContact CG2-CE 4.39Å; I80-M134 WeakPolarHBondContact O-CE 3.4Å; V83-M134 HydrophobicContact CB-CE 3.5Å; V83-M134 HydrophobicContact CB-SD 4.5Å; V83-M134 HydrophobicContact CG1-CE 3.68Å; V83-M134 HydrophobicContact CG1-SD 4.05Å; L84-M134 HydrophobicContact CB-CE 4.03Å; L128-M134 HydrophobicContact CD2-CB 4.36Å; M134-Q136 PolarHBondContact O-N 3.35Å; M134-Q136 VanDerWaalsContact O-N 3.1Å; M134-A137 PolarHBondContact O-N 2.87Å; M134-I138 HydrophobicContact CG-CD1 3.44Å; M134-I138 VanDerWaalsContact CG-CD1 3.44Å; M134-I138 HydrophobicContact CG-CG1 4.08Å; M134-I138 WeakPolarHBondContact O-CD1 3.46Å; M134-I138 WeakPolarHBondContact O-CG1 3.29Å; M134-I138 PolarHBondContact O-N 3.27Å; M134-I138 HydrophobicContact SD-CD1 3.47Å; M134-I138 WeakPolarHBondContact SD-CD1 3.2Å
135	E	95.5	Very high	95.1	Very high	168 Å²	168	44.4 Å²	44.4	79%	0.785	21%	0.211	S	C	*	.	H	α-helix	trans	-51.4	-38.1	-179.8	-64.8	170.7	-173.2	0	0	112.1	P133	P133-E135 PolarHBondContact O-N 2.82Å
136	Q	95.9	Very high	95.1	Very high	25 Å²	25	48.1 Å²	48.1	12%	0.117	23%	0.228	C	C	.	.	H	α-helix	trans	-87.9	-29.3	-178.3	-170.1	55.6	28.5	0	0	113	V132 P133 M134 R139 Y185	V132-Q136 HydrophobicContact CG1-CB 4.17Å; V132-Q136 HydrophobicContact CG1-CG 4.38Å; P133-Q136 PolarHBondContact O-N 3.02Å; P133-Q136 VanDerWaalsContact O-N 3.17Å; M134-Q136 PolarHBondContact O-N 3.35Å; M134-Q136 VanDerWaalsContact O-N 3.1Å; Q136-R139 VanDerWaalsContact CD-NH1 3.31Å; Q136-Y185 HydrophobicContact CB-CD1 4.26Å; Q136-Y185 HydrophobicContact CB-CE1 4.28Å; Q136-Y185 HydrophobicContact CG-CD1 3.31Å; Q136-Y185 HydrophobicContact CG-CD2 3.98Å; Q136-Y185 HydrophobicContact CG-CE1 3.8Å; Q136-Y185 HydrophobicContact CG-CE2 4.44Å; Q136-Y185 HydrophobicContact CG-CG 3.38Å
137	A	96.5	Very high	95.1	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-69.9	-40.3	175.7	0	0	0	0	0	111.7	V124 L127 L128 V132 P133 M134 R139 V140	V124-A137 HydrophobicContact CG1-CB 4.21Å; L127-A137 HydrophobicContact CB-CB 4.15Å; L127-A137 HydrophobicContact CD1-CB 4.39Å; L128-A137 HydrophobicContact CD2-CB 4.11Å; L128-A137 HydrophobicContact CG-CB 4.28Å; V132-A137 HydrophobicContact CG1-CB 4.2Å; P133-A137 PolarHBondContact O-N 2.9Å; M134-A137 PolarHBondContact O-N 2.87Å; A137-R139 PolarHBondContact O-N 2.83Å; A137-V140 WeakPolarHBondContact O-CB 3.32Å; A137-V140 WeakPolarHBondContact O-CG2 3.48Å; A137-V140 PolarHBondContact O-N 2.84Å
138	I	96.1	Very high	95.1	Very high	35 Å²	35	46 Å²	46	18%	0.179	23%	0.227	C	C	.	.	H	α-helix	trans	-60.3	-31.8	-179.2	-70.3	158	0	0	0	112.2	I87 M134 V140 L141	I87-I138 HydrophobicContact CD1-CD1 3.38Å; I87-I138 HydrophobicContact CD1-CG1 4.21Å; I87-I138 HydrophobicContact CD1-CG2 4.47Å; I87-I138 HydrophobicContact CG2-CG2 4.04Å; M134-I138 HydrophobicContact CG-CD1 3.44Å; M134-I138 VanDerWaalsContact CG-CD1 3.44Å; M134-I138 HydrophobicContact CG-CG1 4.08Å; M134-I138 WeakPolarHBondContact O-CD1 3.46Å; M134-I138 WeakPolarHBondContact O-CG1 3.29Å; M134-I138 PolarHBondContact O-N 3.27Å; M134-I138 HydrophobicContact SD-CD1 3.47Å; M134-I138 WeakPolarHBondContact SD-CD1 3.2Å; I138-V140 PolarHBondContact O-N 2.88Å; I138-L141 HydrophobicContact CG2-CD1 4.21Å; I138-L141 VanDerWaalsContact O-CB 3.3Å; I138-L141 WeakPolarHBondContact O-CB 3.37Å; I138-L141 WeakPolarHBondContact O-CG 3.25Å; I138-L141 PolarHBondContact O-N 3.22Å
139	R	95.5	Very high	95.1	Very high	108 Å²	108	48.4 Å²	48.4	41%	0.408	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-51.3	-33.3	178.3	-67.5	173.4	64.5	-178.8	0	112.7	Q136 A137 L141 D142 T145	Q136-R139 VanDerWaalsContact CD-NH1 3.31Å; A137-R139 PolarHBondContact O-N 2.83Å; R139-L141 PolarHBondContact O-N 2.99Å; R139-D142 VanDerWaalsContact O-CB 3.25Å; R139-D142 WeakPolarHBondContact O-CB 3.43Å; R139-D142 PolarHBondContact O-N 2.8Å; R139-T145 PolarHBondContact O-OG1 2.84Å
140	V	95.9	Very high	95.2	Very high	2 Å²	2	48.3 Å²	48.3	1%	0.012	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-60.3	-16.7	178.6	-179.4	0	0	0	0	113.4	K120 D123 V124 L127 A137 I138 D142 T145 A147 V196	K120-V140 WeakPolarHBondContact CD-O 3.29Å; D123-V140 HydrophobicContact CB-CG1 4.14Å; V124-V140 HydrophobicContact CG2-CB 4.33Å; L127-V140 HydrophobicContact CD1-CG2 3.63Å; A137-V140 WeakPolarHBondContact O-CB 3.32Å; A137-V140 WeakPolarHBondContact O-CG2 3.48Å; A137-V140 PolarHBondContact O-N 2.84Å; I138-V140 PolarHBondContact O-N 2.88Å; V140-D142 PolarHBondContact O-N 2.83Å; V140-T145 WeakPolarHBondContact CA-OG1 3.21Å; V140-T145 PolarHBondContact N-OG1 3.06Å; V140-A147 HydrophobicContact CG1-CB 4.11Å; V140-A147 HydrophobicContact CG2-CB 4.03Å; V140-V196 HydrophobicContact CG2-CG1 3.76Å; V140-V196 HydrophobicContact CG2-CG2 4.34Å
141	L	94.4	Very high	95.2	Very high	12 Å²	12	50.7 Å²	50.7	6%	0.063	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-66.5	-26.6	170.9	-62.6	179.4	0	0	0	111.9	I87 M88 I117 K120 V124 I138 R139	I87-L141 HydrophobicContact CG2-CD1 3.86Å; M88-L141 HydrophobicContact CE-CD1 4.27Å; M88-L141 HydrophobicContact CE-CD2 4.1Å; M88-L141 HydrophobicContact SD-CD1 4.42Å; M88-L141 HydrophobicContact SD-CD2 4.3Å; I117-L141 HydrophobicContact CD1-CD2 4.15Å; K120-L141 HydrophobicContact CB-CD2 4.19Å; K120-L141 WeakPolarHBondContact CD-O 3.39Å; K120-L141 PolarHBondContact NZ-O 2.91Å; V124-L141 HydrophobicContact CG2-CD2 4.04Å; V124-L141 HydrophobicContact CG2-CG 4.23Å; I138-L141 HydrophobicContact CG2-CD1 4.21Å; I138-L141 VanDerWaalsContact O-CB 3.3Å; I138-L141 WeakPolarHBondContact O-CB 3.37Å; I138-L141 WeakPolarHBondContact O-CG 3.25Å; I138-L141 PolarHBondContact O-N 3.22Å; R139-L141 PolarHBondContact O-N 2.99Å
142	D	93.3	Very high	95.3	Very high	97 Å²	97	49.2 Å²	49.2	52%	0.519	24%	0.242	S	C	.	.	S	Bend	trans	-69.9	138.9	174.2	-62.5	-36.9	0	0	0	111.8	R139 V140 E144 T145	R139-D142 VanDerWaalsContact O-CB 3.25Å; R139-D142 WeakPolarHBondContact O-CB 3.43Å; R139-D142 PolarHBondContact O-N 2.8Å; V140-D142 PolarHBondContact O-N 2.83Å; D142-E144 VanDerWaalsContact C-N 3.31Å; D142-E144 PolarHBondContact O-N 3.15Å; D142-T145 HydrophobicContact CB-CG2 4.37Å; D142-T145 PolarHBondContact O-N 3.5Å
143	D	91.2	Very high	95.1	Very high	81 Å²	81	53.8 Å²	53.8	43%	0.433	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-33.2	-177.8	-60.9	-43.2	0	0	0	114.5	K120 T145 F146	K120-D143 IonicContact NZ-OD1 3.72Å; K120-D143 PolarHBondContact NZ-OD1 2.91Å; D143-T145 VanDerWaalsContact C-N 3.29Å; D143-T145 PolarHBondContact O-N 2.96Å; D143-F146 VanDerWaalsContact O-CZ 3.32Å; D143-F146 WeakPolarHBondContact O-CZ 3.34Å
144	E	91.8	Very high	94.9	Very high	106 Å²	106	53.3 Å²	53.3	50%	0.495	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-15.2	-178	-64.6	-169.9	-177.8	0	0	113.4	D142 R198	D142-E144 VanDerWaalsContact C-N 3.31Å; D142-E144 PolarHBondContact O-N 3.15Å; E144-R198 IonicContact OE2-NH2 2.56Å
145	T	95	Very high	94.7	Very high	16 Å²	16	59.6 Å²	59.6	10%	0.098	30%	0.301	C	S	.	.			trans	-113.9	138.3	-173.3	84.6	0	0	0	0	111.6	R139 V140 D142 D143	R139-T145 PolarHBondContact O-OG1 2.84Å; V140-T145 WeakPolarHBondContact CA-OG1 3.21Å; V140-T145 PolarHBondContact N-OG1 3.06Å; D142-T145 HydrophobicContact CB-CG2 4.37Å; D142-T145 PolarHBondContact O-N 3.5Å; D143-T145 VanDerWaalsContact C-N 3.29Å; D143-T145 PolarHBondContact O-N 2.96Å
146	F	96.1	Very high	94.6	Very high	78 Å²	78	55 Å²	55	34%	0.342	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	160.1	-174.8	-60.6	-86.8	0	0	0	109.5	D143 V196 G197 L202	D143-F146 VanDerWaalsContact O-CZ 3.32Å; D143-F146 WeakPolarHBondContact O-CZ 3.34Å; F146-V196 WeakPolarHBondContact O-CA 3.48Å; F146-G197 PolarHBondContact N-O 3.09Å; F146-G197 PolarHBondContact O-N 3.34Å; F146-L202 HydrophobicContact CB-CD1 3.54Å
147	A	96.5	Very high	94.5	Very high	24 Å²	24	63.7 Å²	63.7	20%	0.198	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	142.9	174.4	0	0	0	0	0	110.5	D123 L127 V140 V195	D123-A147 HydrophobicContact CB-CB 4.08Å; L127-A147 HydrophobicContact CD1-CB 3.72Å; L127-A147 HydrophobicContact CD2-CB 4.22Å; L127-A147 HydrophobicContact CG-CB 4.12Å; V140-A147 HydrophobicContact CG1-CB 4.11Å; V140-A147 HydrophobicContact CG2-CB 4.03Å; A147-V195 CarbonylContact C-O 3.49Å; A147-V195 WeakPolarHBondContact CA-O 3.21Å
148	D	96.5	Very high	94.5	Very high	26 Å²	26	70.2 Å²	70.2	14%	0.139	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	134.4	168.4	-164.9	5.9	0	0	0	111	S194 V195 L202 R206	D148-S194 CarbonylContact O-C 3.55Å; D148-S194 WeakPolarHBondContact O-CA 3.31Å; D148-V195 HydrophobicContact CB-CB 4.47Å; D148-V195 PolarHBondContact N-O 3.49Å; D148-V195 PolarHBondContact O-N 3.44Å; D148-L202 HydrophobicContact CB-CD1 4.28Å; D148-L202 HydrophobicContact CB-CD2 4.23Å; D148-R206 IonicContact OD1-CZ 2.94Å; D148-R206 IonicContact OD1-NE 3.18Å; D148-R206 IonicContact OD1-NH2 3.32Å; D148-R206 PolarHBondContact OD1-NH2 2.86Å; D148-R206 IonicContact OD2-CZ 3.2Å; D148-R206 VanDerWaalsContact OD2-CZ 3.23Å; D148-R206 IonicContact OD2-NE 3.91Å; D148-R206 PolarHBondContact OD2-NE 3.38Å; D148-R206 IonicContact OD2-NH2 2.67Å; D148-R206 PolarHBondContact OD2-NH2 3.33Å
149	I	96.4	Very high	94.4	Very high	49 Å²	49	74.8 Å²	74.8	25%	0.251	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	101.8	175.2	-58.8	176.7	0	0	0	107.3	R126 R130 T192	R126-I149 HydrophobicContact CB-CD1 3.76Å; R130-I149 HydrophobicContact CG-CD1 4.25Å; I149-T192 HydrophobicContact CG2-CG2 4.19Å
150	I	96.5	Very high	94.4	Very high	3 Å²	3	70.4 Å²	70.4	2%	0.015	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	115.5	-176.1	-56.2	158.2	0	0	0	108.9	I152 T192 V193 V195 R206 V209	I150-I152 HydrophobicContact CG2-CG2 4.44Å; I150-T192 CarbonylContact O-C 3.45Å; I150-T192 WeakPolarHBondContact O-CA 3.44Å; I150-V193 HydrophobicContact CB-CB 4.34Å; I150-V193 PolarHBondContact N-O 2.98Å; I150-V193 PolarHBondContact O-N 3.24Å; I150-V195 HydrophobicContact CD1-CG2 3.84Å; I150-R206 HydrophobicContact CD1-CB 4.05Å; I150-R206 HydrophobicContact CD1-CG 4.49Å; I150-R206 HydrophobicContact CG1-CB 4.49Å; I150-R206 HydrophobicContact CG1-CG 4.5Å; I150-V209 HydrophobicContact CD1-CB 4.28Å; I150-V209 HydrophobicContact CD1-CG2 4.21Å; I150-V209 HydrophobicContact CG2-CG1 3.91Å
151	E	95.3	Very high	94.4	Very high	142 Å²	142	72.8 Å²	72.8	66%	0.664	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.7	127	172.9	-58.4	-168.3	159.2	0	0	111.1	T192	E151-T192 HydrophobicContact CG-CG2 4.29Å
152	I	94.8	Very high	94.5	Very high	1 Å²	1	79.1 Å²	79.1	1%	0.005	39%	0.385	C	S	.	.			trans	-119.8	106.2	178.4	37.7	167.7	0	0	0	108.8	I150 F160 K191 V193 V209 I213	I150-I152 HydrophobicContact CG2-CG2 4.44Å; I152-F160 HydrophobicContact CB-CE2 4.31Å; I152-F160 HydrophobicContact CD1-CE2 4.47Å; I152-F160 HydrophobicContact CG1-CE2 4.43Å; I152-F160 WeakPolarHBondContact O-CE2 3.42Å; I152-K191 WeakPolarHBondContact CG1-O 3.26Å; I152-K191 PolarHBondContact N-O 3.33Å; I152-V193 HydrophobicContact CD1-CG2 3.39Å; I152-V193 HydrophobicContact CG1-CG2 4.02Å; I152-V209 HydrophobicContact CG2-CG1 3.65Å; I152-I213 HydrophobicContact CB-CG1 4.18Å; I152-I213 HydrophobicContact CB-CG2 4.18Å; I152-I213 HydrophobicContact CD1-CD1 4.45Å; I152-I213 HydrophobicContact CG2-CB 4.05Å; I152-I213 HydrophobicContact CG2-CG1 3.64Å; I152-I213 HydrophobicContact CG2-CG2 4.06Å
153	N	92.6	Very high	94.6	Very high	96 Å²	96	75.3 Å²	75.3	51%	0.513	36%	0.363	S	S	.	.			trans	-124.6	136.8	-179.6	-168.4	9.4	0	0	0	110.3	Y214	N153-Y214 PolarHBondContact N-OH 2.98Å; N153-Y214 WeakPolarHBondContact O-CE1 3.31Å; N153-Y214 PolarHBondContact O-OH 3.27Å
154	L	91.7	Very high	94.8	Very high	33 Å²	33	74.5 Å²	74.5	17%	0.173	35%	0.354	C	S	.	.			trans	-145	137.5	177	-169.3	67.6	0	0	0	109.4	N156 R159 F160	L154-N156 PolarHBondContact O-N 2.93Å; L154-R159 HydrophobicContact CD2-CB 3.95Å; L154-R159 HydrophobicContact CD2-CG 3.59Å; L154-F160 HydrophobicContact CB-CB 4.06Å; L154-F160 HydrophobicContact CB-CD2 3.95Å; L154-F160 HydrophobicContact CB-CG 4.44Å; L154-F160 HydrophobicContact CD2-CB 4.4Å
155	T	91.8	Very high	95	Very high	149 Å²	149	73.2 Å²	73.2	91%	0.914	35%	0.35	S	S	*	.	S	Bend	trans	-61.7	-44.4	-172.3	52.8	0	0	0	0	113.1	R157	T155-R157 PolarHBondContact O-N 3.2Å
156	N	93.3	Very high	95	Very high	72 Å²	72	76 Å²	76	39%	0.385	36%	0.359	S	S	.	.	S	Bend	trans	-85.7	114	178.3	-177.2	-41.7	0	0	0	110.3	L154 E158 R159 F160	L154-N156 PolarHBondContact O-N 2.93Å; N156-E158 PolarHBondContact O-N 3.49Å; N156-E158 PolarHBondContact OD1-N 3.31Å; N156-R159 HydrophobicContact CB-CB 4.03Å; N156-R159 PolarHBondContact O-N 3.18Å; N156-R159 PolarHBondContact OD1-N 2.7Å; N156-R159 VanDerWaalsContact OD1-N 3.15Å; N156-F160 WeakPolarHBondContact O-CB 3.47Å; N156-F160 PolarHBondContact O-N 3.48Å
157	R	94	Very high	95	Very high	208 Å²	208	72.3 Å²	72.3	79%	0.785	34%	0.343	S	S	*	.	H	α-helix	trans	-58.9	-43.3	-178.6	-177	178.7	172	175.9	-2.5	113.4	T155 F160 V161	T155-R157 PolarHBondContact O-N 3.2Å; R157-F160 WeakPolarHBondContact O-CB 3.36Å; R157-F160 PolarHBondContact O-N 3.34Å; R157-V161 WeakPolarHBondContact O-CG2 3.43Å; R157-V161 PolarHBondContact O-N 3.26Å
158	E	95.6	Very high	94.9	Very high	137 Å²	137	73.5 Å²	73.5	64%	0.64	35%	0.346	S	S	*	.	H	α-helix	trans	-65.5	-43.5	-179.5	-63.7	179.9	-175.8	0	0	111.4	N156 F160 V161 K162	N156-E158 PolarHBondContact O-N 3.49Å; N156-E158 PolarHBondContact OD1-N 3.31Å; E158-F160 VanDerWaalsContact C-N 3.28Å; E158-F160 PolarHBondContact O-N 3.2Å; E158-V161 PolarHBondContact O-N 2.98Å; E158-K162 WeakPolarHBondContact O-CG 3.29Å; E158-K162 PolarHBondContact O-N 3.4Å
159	R	94.9	Very high	94.9	Very high	130 Å²	130	73.3 Å²	73.3	49%	0.491	35%	0.349	S	S	.	.	H	α-helix	trans	-62.7	-40.1	176.2	-172.8	-174.7	-67.8	-135.8	1.4	110.8	L154 N156 R163	L154-R159 HydrophobicContact CD2-CB 3.95Å; L154-R159 HydrophobicContact CD2-CG 3.59Å; N156-R159 HydrophobicContact CB-CB 4.03Å; N156-R159 PolarHBondContact O-N 3.18Å; N156-R159 PolarHBondContact OD1-N 2.7Å; N156-R159 VanDerWaalsContact OD1-N 3.15Å; R159-R163 HydrophobicContact CG-CG 4.49Å; R159-R163 WeakPolarHBondContact O-CB 3.41Å; R159-R163 WeakPolarHBondContact O-CG 3.31Å; R159-R163 PolarHBondContact O-N 3.49Å
160	F	96	Very high	94.8	Very high	17 Å²	17	76.4 Å²	76.4	8%	0.075	36%	0.363	C	S	.	.	H	α-helix	trans	-59.8	-53	177.4	177.3	-107.7	0	0	0	111.1	I152 L154 N156 R157 E158 K162 R163 R164 K191	I152-F160 HydrophobicContact CB-CE2 4.31Å; I152-F160 HydrophobicContact CD1-CE2 4.47Å; I152-F160 HydrophobicContact CG1-CE2 4.43Å; I152-F160 WeakPolarHBondContact O-CE2 3.42Å; L154-F160 HydrophobicContact CB-CB 4.06Å; L154-F160 HydrophobicContact CB-CD2 3.95Å; L154-F160 HydrophobicContact CB-CG 4.44Å; L154-F160 HydrophobicContact CD2-CB 4.4Å; N156-F160 WeakPolarHBondContact O-CB 3.47Å; N156-F160 PolarHBondContact O-N 3.48Å; R157-F160 WeakPolarHBondContact O-CB 3.36Å; R157-F160 PolarHBondContact O-N 3.34Å; E158-F160 VanDerWaalsContact C-N 3.28Å; E158-F160 PolarHBondContact O-N 3.2Å; F160-K162 PolarHBondContact O-N 2.94Å; F160-R163 PolarHBondContact O-N 3.28Å; F160-R164 VanDerWaalsContact O-CB 3.3Å; F160-R164 WeakPolarHBondContact O-CB 3.46Å; F160-R164 PolarHBondContact O-N 3.4Å; F160-K191 HydrophobicContact CE1-CG 4.16Å; F160-K191 HydrophobicContact CZ-CB 4.37Å; F160-K191 HydrophobicContact CZ-CG 3.94Å
161	V	95.2	Very high	94.7	Very high	52 Å²	52	83.5 Å²	83.5	32%	0.315	40%	0.4	S	S	.	.	H	α-helix	trans	-60.7	-44.4	-179.7	175.8	0	0	0	0	110.9	R157 E158 R163 R164 N165	R157-V161 WeakPolarHBondContact O-CG2 3.43Å; R157-V161 PolarHBondContact O-N 3.26Å; E158-V161 PolarHBondContact O-N 2.98Å; V161-R163 PolarHBondContact O-N 3.07Å; V161-R164 PolarHBondContact O-N 2.72Å; V161-N165 WeakPolarHBondContact O-CB 3.39Å; V161-N165 PolarHBondContact O-N 3.06Å; V161-N165 PolarHBondContact O-OD1 3.14Å
162	K	95.6	Very high	94.6	Very high	145 Å²	145	77.6 Å²	77.6	63%	0.63	38%	0.378	S	S	*	.	H	α-helix	trans	-61.7	-43.7	177.4	-72.1	177.6	-178.4	176.5	0	112.7	E158 F160 R166	E158-K162 WeakPolarHBondContact O-CG 3.29Å; E158-K162 PolarHBondContact O-N 3.4Å; F160-K162 PolarHBondContact O-N 2.94Å; K162-R166 WeakPolarHBondContact O-CB 3.41Å; K162-R166 PolarHBondContact O-N 3.37Å
163	R	95.7	Very high	94.6	Very high	17 Å²	17	83.1 Å²	83.1	6%	0.064	40%	0.404	C	S	.	.	H	α-helix	trans	-73	-33.9	178.9	-69.9	-176.1	179.4	-179	-1.5	112.6	R159 F160 V161 R166 L167 I213 Y214 N216	R159-R163 HydrophobicContact CG-CG 4.49Å; R159-R163 WeakPolarHBondContact O-CB 3.41Å; R159-R163 WeakPolarHBondContact O-CG 3.31Å; R159-R163 PolarHBondContact O-N 3.49Å; F160-R163 PolarHBondContact O-N 3.28Å; V161-R163 PolarHBondContact O-N 3.07Å; R163-R166 WeakPolarHBondContact O-CB 3.29Å; R163-R166 PolarHBondContact O-N 2.91Å; R163-L167 PolarHBondContact O-N 3.44Å; R163-L167 VanDerWaalsContact O-N 3.13Å; R163-I213 HydrophobicContact CB-CD1 3.94Å; R163-I213 WeakPolarHBondContact CD-O 3.35Å; R163-I213 PolarHBondContact NH1-O 3.4Å; R163-Y214 PolarHBondContact NH1-O 3.48Å; R163-N216 PolarHBondContact NE-OD1 3.41Å; R163-N216 VanDerWaalsContact NH2-CB 3.28Å; R163-N216 VanDerWaalsContact NH2-CG 3.34Å; R163-N216 PolarHBondContact NH2-OD1 3Å
164	R	95.6	Very high	94.7	Very high	64 Å²	64	79.8 Å²	79.8	24%	0.242	39%	0.387	C	S	.	.	H	α-helix	trans	-66.1	-47.4	173.4	-173.8	-167.6	69.2	178.2	3.3	111.2	F160 V161 R166 L167 I168 V188 G190	F160-R164 VanDerWaalsContact O-CB 3.3Å; F160-R164 WeakPolarHBondContact O-CB 3.46Å; F160-R164 PolarHBondContact O-N 3.4Å; V161-R164 PolarHBondContact O-N 2.72Å; R164-R166 PolarHBondContact O-N 3.38Å; R164-L167 WeakPolarHBondContact O-CB 3.31Å; R164-L167 PolarHBondContact O-N 3.36Å; R164-I168 PolarHBondContact O-N 3.11Å; R164-V188 HydrophobicContact CG-CG1 3.88Å; R164-G190 WeakPolarHBondContact CD-O 3.4Å; R164-G190 PolarHBondContact NH1-O 2.72Å
165	N	95.3	Very high	94.9	Very high	78 Å²	78	79.4 Å²	79.4	42%	0.417	39%	0.385	S	S	.	.	H	α-helix	trans	-63.2	-34.1	177.1	-67.3	3.2	0	0	0	111.2	V161 L167 I168 G169	V161-N165 WeakPolarHBondContact O-CB 3.39Å; V161-N165 PolarHBondContact O-N 3.06Å; V161-N165 PolarHBondContact O-OD1 3.14Å; N165-L167 VanDerWaalsContact C-N 3.34Å; N165-L167 PolarHBondContact O-N 3.29Å; N165-I168 PolarHBondContact O-N 2.68Å; N165-G169 PolarHBondContact O-N 3.26Å
166	R	95.7	Very high	95.1	Very high	74 Å²	74	77.7 Å²	77.7	28%	0.279	37%	0.365	S	S	.	.	H	α-helix	trans	-61.5	-37.9	170.9	-177.1	-165.9	-63.8	167.1	-0.8	113.1	K162 R163 R164 I168 G169 N216 P219	K162-R166 WeakPolarHBondContact O-CB 3.41Å; K162-R166 PolarHBondContact O-N 3.37Å; R163-R166 WeakPolarHBondContact O-CB 3.29Å; R163-R166 PolarHBondContact O-N 2.91Å; R164-R166 PolarHBondContact O-N 3.38Å; R166-I168 VanDerWaalsContact C-N 3.32Å; R166-G169 PolarHBondContact O-N 2.98Å; R166-N216 PolarHBondContact NH1-OD1 3.43Å; R166-P219 HydrophobicContact CG-CG 4.24Å; R166-P219 WeakPolarHBondContact O-CG 3.43Å
167	L	95.9	Very high	95.2	Very high	1 Å²	1	75.9 Å²	75.9	1%	0.005	36%	0.36	C	S	.	.	H	α-helix	trans	-65.3	-37.8	176.7	-177.8	67.6	0	0	0	111.5	R163 R164 N165 V188 V193 V209 C212	R163-L167 PolarHBondContact O-N 3.44Å; R163-L167 VanDerWaalsContact O-N 3.13Å; R164-L167 WeakPolarHBondContact O-CB 3.31Å; R164-L167 PolarHBondContact O-N 3.36Å; N165-L167 VanDerWaalsContact C-N 3.34Å; N165-L167 PolarHBondContact O-N 3.29Å; L167-V188 HydrophobicContact CD2-CG2 4.2Å; L167-V193 HydrophobicContact CD2-CG2 4.01Å; L167-V209 HydrophobicContact CD1-CG2 4.31Å; L167-V209 HydrophobicContact CD2-CG1 4.23Å; L167-V209 HydrophobicContact CD2-CG2 4.13Å; L167-C212 HydrophobicContact CD1-CB 4.36Å
168	I	95.7	Very high	95.3	Very high	50 Å²	50	66 Å²	66	26%	0.256	32%	0.323	S	S	.	.	H	α-helix	trans	-70	-44.2	176.5	-61.7	169	0	0	0	110.4	R164 N165 R166 G172 T174 L175 V188	R164-I168 PolarHBondContact O-N 3.11Å; N165-I168 PolarHBondContact O-N 2.68Å; R166-I168 VanDerWaalsContact C-N 3.32Å; I168-G172 CarbonylContact O-C 3.59Å; I168-G172 VanDerWaalsContact O-C 3.29Å; I168-G172 VanDerWaalsContact O-CA 3.29Å; I168-G172 WeakPolarHBondContact O-CA 3.33Å; I168-T174 WeakPolarHBondContact O-CB 3.46Å; I168-T174 PolarHBondContact O-N 3.2Å; I168-L175 PolarHBondContact O-N 3.38Å; I168-V188 HydrophobicContact CD1-CB 4.37Å; I168-V188 HydrophobicContact CD1-CG1 4.2Å; I168-V188 HydrophobicContact CG1-CB 4.2Å; I168-V188 HydrophobicContact CG1-CG1 4.28Å; I168-V188 HydrophobicContact CG1-CG2 4.22Å
169	G	94.8	Very high	95.3	Very high	21 Å²	21	60.6 Å²	60.6	22%	0.216	30%	0.297	C	S	.	.			trans	87.3	179.8	-172.5	0	0	0	0	0	112.1	N165 R166 T174	N165-G169 PolarHBondContact O-N 3.26Å; R166-G169 PolarHBondContact O-N 2.98Å; G169-T174 WeakPolarHBondContact CA-OG1 3.44Å
170	H	94.7	Very high	95.3	Very high	115 Å²	115	59.8 Å²	59.8	53%	0.532	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-66.5	133.3	165.8	118	74.8	0	0	0	108	G172 E173	H170-G172 PolarHBondContact O-N 2.99Å; H170-E173 IonicContact CD2-OE1 2.7Å; H170-E173 IonicContact CD2-OE2 2.76Å; H170-E173 PolarHBondContact CD2-OE2 3.47Å; H170-E173 IonicContact CE1-OE1 3.95Å; H170-E173 IonicContact NE2-OE1 3.99Å; H170-E173 PolarHBondContact NE2-OE1 3.06Å; H170-E173 VanDerWaalsContact NE2-OE1 3.1Å; H170-E173 IonicContact NE2-OE2 2.62Å; H170-E173 PolarHBondContact NE2-OE2 3.29Å; H170-E173 WeakPolarHBondContact O-CB 3.3Å; H170-E173 WeakPolarHBondContact O-CG 3.32Å; H170-E173 PolarHBondContact O-N 3.38Å
171	D	93.7	Very high	95.2	Very high	151 Å²	151	59.8 Å²	59.8	81%	0.807	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	46	23.6	-179.9	-56.8	-28.5	0	0	0	116.6
172	G	93.4	Very high	95.1	Very high	19 Å²	19	57.4 Å²	57.4	20%	0.196	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	80.8	8.3	-177.7	0	0	0	0	0	115.2	I168 H170 T174 L175 K176	I168-G172 CarbonylContact O-C 3.59Å; I168-G172 VanDerWaalsContact O-C 3.29Å; I168-G172 VanDerWaalsContact O-CA 3.29Å; I168-G172 WeakPolarHBondContact O-CA 3.33Å; H170-G172 PolarHBondContact O-N 2.99Å; G172-T174 VanDerWaalsContact C-N 3.34Å; G172-T174 PolarHBondContact O-N 2.88Å; G172-L175 WeakPolarHBondContact O-CB 3.27Å; G172-L175 PolarHBondContact O-N 2.92Å; G172-K176 PolarHBondContact O-N 2.82Å
173	E	95.3	Very high	95	Very high	116 Å²	116	55.4 Å²	55.4	54%	0.542	29%	0.286	S	S	.	.	H	α-helix	trans	-59.8	-41	-177.3	-71	-170.6	153	0	0	113.4	H170 L175 K176 A177	H170-E173 IonicContact CD2-OE1 2.7Å; H170-E173 IonicContact CD2-OE2 2.76Å; H170-E173 PolarHBondContact CD2-OE2 3.47Å; H170-E173 IonicContact CE1-OE1 3.95Å; H170-E173 IonicContact NE2-OE1 3.99Å; H170-E173 PolarHBondContact NE2-OE1 3.06Å; H170-E173 VanDerWaalsContact NE2-OE1 3.1Å; H170-E173 IonicContact NE2-OE2 2.62Å; H170-E173 PolarHBondContact NE2-OE2 3.29Å; H170-E173 WeakPolarHBondContact O-CB 3.3Å; H170-E173 WeakPolarHBondContact O-CG 3.32Å; H170-E173 PolarHBondContact O-N 3.38Å; E173-L175 VanDerWaalsContact C-N 3.33Å; E173-K176 PolarHBondContact O-N 3.48Å; E173-A177 VanDerWaalsContact O-CB 3.29Å; E173-A177 WeakPolarHBondContact O-CB 3.38Å; E173-A177 PolarHBondContact O-N 2.9Å
174	T	95.8	Very high	95	Very high	26 Å²	26	55 Å²	55	16%	0.16	29%	0.286	C	S	.	.	H	α-helix	trans	-67.1	-40.7	-179.9	-60.6	0	0	0	0	110.5	I168 G169 G172 L178 P219 I223	I168-T174 WeakPolarHBondContact O-CB 3.46Å; I168-T174 PolarHBondContact O-N 3.2Å; G169-T174 WeakPolarHBondContact CA-OG1 3.44Å; G172-T174 VanDerWaalsContact C-N 3.34Å; G172-T174 PolarHBondContact O-N 2.88Å; T174-L178 WeakPolarHBondContact O-CB 3.18Å; T174-L178 PolarHBondContact O-N 2.97Å; T174-P219 HydrophobicContact CG2-CB 3.8Å; T174-P219 HydrophobicContact CG2-CG 3.56Å; T174-I223 HydrophobicContact CG2-CD1 3.83Å
175	L	95.4	Very high	95.1	Very high	26 Å²	26	55 Å²	55	14%	0.136	29%	0.286	C	S	.	.	H	α-helix	trans	-62.3	-47.2	175.2	-168.2	66.2	0	0	0	110.4	I168 G172 E173 A177 L178 E179 I186 V188	I168-L175 PolarHBondContact O-N 3.38Å; G172-L175 WeakPolarHBondContact O-CB 3.27Å; G172-L175 PolarHBondContact O-N 2.92Å; E173-L175 VanDerWaalsContact C-N 3.33Å; L175-A177 PolarHBondContact O-N 3.48Å; L175-L178 WeakPolarHBondContact O-CB 2.85Å; L175-L178 PolarHBondContact O-N 3.03Å; L175-L178 VanDerWaalsContact O-N 3.11Å; L175-E179 WeakPolarHBondContact O-CG 3.2Å; L175-E179 PolarHBondContact O-N 3.34Å; L175-I186 HydrophobicContact CD1-CB 3.78Å; L175-I186 HydrophobicContact CD1-CG2 3.5Å; L175-I186 HydrophobicContact CG-CB 4.42Å; L175-V188 HydrophobicContact CD1-CG2 3.98Å; L175-V188 HydrophobicContact CD2-CG2 4.43Å
176	K	95.5	Very high	95.2	Very high	112 Å²	112	51.4 Å²	51.4	49%	0.487	27%	0.267	S	S	.	.	H	α-helix	trans	-63.9	-41.5	179.5	-168.5	69	-164.9	164.2	0	112.6	G172 E173 L178 E179 L180	G172-K176 PolarHBondContact O-N 2.82Å; E173-K176 PolarHBondContact O-N 3.48Å; K176-L178 VanDerWaalsContact C-N 3.27Å; K176-L178 PolarHBondContact O-N 2.83Å; K176-E179 WeakPolarHBondContact CD-OE2 3.42Å; K176-E179 IonicContact NZ-OE2 2.77Å; K176-E179 PolarHBondContact NZ-OE2 3.28Å; K176-E179 WeakPolarHBondContact O-CB 3.38Å; K176-E179 PolarHBondContact O-N 2.92Å; K176-L180 HydrophobicContact CG-CD1 4.46Å; K176-L180 WeakPolarHBondContact O-CG 3.46Å; K176-L180 PolarHBondContact O-N 2.92Å
177	A	96.1	Very high	95.2	Very high	34 Å²	34	49.2 Å²	49.2	28%	0.281	26%	0.262	S	S	.	.	H	α-helix	trans	-62.6	-36.5	174.4	0	0	0	0	0	111.8	E173 L175 S181 I223	E173-A177 VanDerWaalsContact O-CB 3.29Å; E173-A177 WeakPolarHBondContact O-CB 3.38Å; E173-A177 PolarHBondContact O-N 2.9Å; L175-A177 PolarHBondContact O-N 3.48Å; A177-S181 WeakPolarHBondContact O-CB 3.37Å; A177-S181 PolarHBondContact O-N 3.25Å; A177-S181 PolarHBondContact O-OG 3.26Å; A177-I223 HydrophobicContact CB-CD1 4.06Å; A177-I223 HydrophobicContact CB-CG2 4.37Å
178	L	96.3	Very high	95.1	Very high	2 Å²	2	50.5 Å²	50.5	1%	0.01	27%	0.27	C	S	.	.	H	α-helix	trans	-67.5	-45.1	174.9	-172.5	62	0	0	0	111.4	T174 L175 K176 L180 S181 T182 I186 I208 I223 L226	T174-L178 WeakPolarHBondContact O-CB 3.18Å; T174-L178 PolarHBondContact O-N 2.97Å; L175-L178 WeakPolarHBondContact O-CB 2.85Å; L175-L178 PolarHBondContact O-N 3.03Å; L175-L178 VanDerWaalsContact O-N 3.11Å; K176-L178 VanDerWaalsContact C-N 3.27Å; K176-L178 PolarHBondContact O-N 2.83Å; L178-L180 PolarHBondContact O-N 3.25Å; L178-S181 CarbonylContact O-C 3.54Å; L178-S181 PolarHBondContact O-N 2.78Å; L178-S181 VanDerWaalsContact O-N 3.1Å; L178-T182 HydrophobicContact CD1-CG2 4.15Å; L178-T182 PolarHBondContact O-N 3.01Å; L178-T182 PolarHBondContact O-OG1 3.09Å; L178-I186 HydrophobicContact CB-CD1 4.17Å; L178-I186 HydrophobicContact CD2-CD1 3.62Å; L178-I186 HydrophobicContact CG-CD1 3.65Å; L178-I208 HydrophobicContact CD1-CD1 3.63Å; L178-I208 HydrophobicContact CD1-CG2 4.25Å; L178-I208 HydrophobicContact CD2-CG2 4.2Å; L178-I223 HydrophobicContact CD1-CG1 4.35Å; L178-L226 HydrophobicContact CD1-CD1 4.06Å
179	E	95.3	Very high	94.9	Very high	22 Å²	22	49.5 Å²	49.5	10%	0.103	26%	0.264	C	S	.	.	H	α-helix	trans	-54.9	-49.5	174.6	-70.5	-171.8	159.1	0	0	112.2	L175 K176 S181 T182 N183 C184 I186	L175-E179 WeakPolarHBondContact O-CG 3.2Å; L175-E179 PolarHBondContact O-N 3.34Å; K176-E179 WeakPolarHBondContact CD-OE2 3.42Å; K176-E179 IonicContact NZ-OE2 2.77Å; K176-E179 PolarHBondContact NZ-OE2 3.28Å; K176-E179 WeakPolarHBondContact O-CB 3.38Å; K176-E179 PolarHBondContact O-N 2.92Å; E179-S181 VanDerWaalsContact C-N 3.29Å; E179-S181 PolarHBondContact O-N 3.41Å; E179-T182 PolarHBondContact O-N 3.01Å; E179-N183 VanDerWaalsContact O-CA 3.25Å; E179-N183 WeakPolarHBondContact O-CA 3.39Å; E179-N183 PolarHBondContact O-N 3.2Å; E179-C184 VanDerWaalsContact CA-O 3.31Å; E179-C184 WeakPolarHBondContact CA-O 3.37Å; E179-C184 WeakPolarHBondContact CB-O 3.45Å; E179-C184 WeakPolarHBondContact CG-O 3.46Å; E179-C184 PolarHBondContact O-N 3.29Å; E179-I186 HydrophobicContact CG-CB 4.17Å; E179-I186 HydrophobicContact CG-CD1 4.24Å; E179-I186 HydrophobicContact CG-CG1 4.04Å; E179-I186 PolarHBondContact OE1-N 3.46Å
180	L	94.7	Very high	94.8	Very high	113 Å²	113	50.5 Å²	50.5	59%	0.592	27%	0.274	S	S	*	.	H	α-helix	trans	-66.5	-32.6	177.7	-65.4	173.4	0	0	0	112	K176 L178 N183 K230	K176-L180 HydrophobicContact CG-CD1 4.46Å; K176-L180 WeakPolarHBondContact O-CG 3.46Å; K176-L180 PolarHBondContact O-N 2.92Å; L178-L180 PolarHBondContact O-N 3.25Å; L180-N183 PolarHBondContact O-OD1 3.49Å; L180-K230 PolarHBondContact O-NZ 3.29Å
181	S	93.7	Very high	94.7	Very high	18 Å²	18	51 Å²	51	13%	0.126	28%	0.275	C	S	.	.	H	α-helix	trans	-75.5	-26.9	179.3	-62.8	0	0	0	0	113	A177 L178 E179 K230	A177-S181 WeakPolarHBondContact O-CB 3.37Å; A177-S181 PolarHBondContact O-N 3.25Å; A177-S181 PolarHBondContact O-OG 3.26Å; L178-S181 CarbonylContact O-C 3.54Å; L178-S181 PolarHBondContact O-N 2.78Å; L178-S181 VanDerWaalsContact O-N 3.1Å; E179-S181 VanDerWaalsContact C-N 3.29Å; E179-S181 PolarHBondContact O-N 3.41Å; S181-K230 WeakPolarHBondContact O-CE 3.44Å; S181-K230 PolarHBondContact O-NZ 3.46Å
182	T	93.4	Very high	94.8	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.006	24%	0.238	C	C	.	.	H	α-helix	trans	-114.7	1.3	-180	65.3	0	0	0	0	113.4	L178 E179 C184 D201 V205 L226	L178-T182 HydrophobicContact CD1-CG2 4.15Å; L178-T182 PolarHBondContact O-N 3.01Å; L178-T182 PolarHBondContact O-OG1 3.09Å; E179-T182 PolarHBondContact O-N 3.01Å; T182-C184 PolarHBondContact O-N 2.85Å; T182-C184 VanDerWaalsContact O-N 3.08Å; T182-C184 PolarHBondContact O-SG 3.18Å; T182-C184 VanDerWaalsContact O-SG 3.38Å; T182-C184 WeakPolarHBondContact OG1-CB 3.5Å; T182-C184 PolarHBondContact OG1-SG 2.91Å; T182-C184 VanDerWaalsContact OG1-SG 3.37Å; T182-D201 WeakPolarHBondContact O-CB 3.43Å; T182-V205 HydrophobicContact CG2-CG2 3.74Å; T182-V205 WeakPolarHBondContact OG1-CG2 3.42Å; T182-L226 HydrophobicContact CG2-CD1 3.53Å
183	N	93.7	Very high	95	Very high	104 Å²	104	43.2 Å²	43.2	56%	0.556	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.1	28.2	-172.4	-56	-26.6	0	0	0	113.1	E179 L180	E179-N183 VanDerWaalsContact O-CA 3.25Å; E179-N183 WeakPolarHBondContact O-CA 3.39Å; E179-N183 PolarHBondContact O-N 3.2Å; L180-N183 PolarHBondContact O-OD1 3.49Å
184	C	96.1	Very high	95.1	Very high	8 Å²	8	37.7 Å²	37.7	5%	0.054	20%	0.203	C	C	.	.			trans	-102.7	158.2	176.2	-60	0	0	0	0	110.2	E179 T182 I186 V195 V196 D201 V205	E179-C184 VanDerWaalsContact CA-O 3.31Å; E179-C184 WeakPolarHBondContact CA-O 3.37Å; E179-C184 WeakPolarHBondContact CB-O 3.45Å; E179-C184 WeakPolarHBondContact CG-O 3.46Å; E179-C184 PolarHBondContact O-N 3.29Å; T182-C184 PolarHBondContact O-N 2.85Å; T182-C184 VanDerWaalsContact O-N 3.08Å; T182-C184 PolarHBondContact O-SG 3.18Å; T182-C184 VanDerWaalsContact O-SG 3.38Å; T182-C184 WeakPolarHBondContact OG1-CB 3.5Å; T182-C184 PolarHBondContact OG1-SG 2.91Å; T182-C184 VanDerWaalsContact OG1-SG 3.37Å; C184-I186 HydrophobicContact CB-CG1 4.24Å; C184-V195 HydrophobicContact CB-CG1 3.8Å; C184-V196 CarbonylContact C-O 3.58Å; C184-V196 VanDerWaalsContact CA-O 3.26Å; C184-V196 WeakPolarHBondContact CA-O 3.32Å; C184-V196 WeakPolarHBondContact CB-O 3.5Å; C184-D201 WeakPolarHBondContact SG-CB 3.36Å; C184-V205 HydrophobicContact CB-CG2 4.4Å
185	Y	96.7	Very high	95.1	Very high	63 Å²	63	36.5 Å²	36.5	25%	0.247	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	131.9	162.3	-179.2	-102	0	0	0	109.6	V132 P133 Q136 V187 V195 V196	V132-Y185 HydrophobicContact CG1-CD1 4.32Å; V132-Y185 HydrophobicContact CG1-CE1 3.92Å; P133-Y185 WeakPolarHBondContact CD-OH 3.35Å; P133-Y185 WeakPolarHBondContact CG-OH 3.35Å; Q136-Y185 HydrophobicContact CB-CD1 4.26Å; Q136-Y185 HydrophobicContact CB-CE1 4.28Å; Q136-Y185 HydrophobicContact CG-CD1 3.31Å; Q136-Y185 HydrophobicContact CG-CD2 3.98Å; Q136-Y185 HydrophobicContact CG-CE1 3.8Å; Q136-Y185 HydrophobicContact CG-CE2 4.44Å; Q136-Y185 HydrophobicContact CG-CG 3.38Å; Y185-V187 HydrophobicContact CD1-CG2 3.98Å; Y185-V187 HydrophobicContact CE1-CG2 3.18Å; Y185-V195 CarbonylContact O-C 3.58Å; Y185-V195 VanDerWaalsContact O-CA 3.31Å; Y185-V195 WeakPolarHBondContact O-CA 3.48Å; Y185-V196 PolarHBondContact N-O 2.86Å; Y185-V196 PolarHBondContact O-N 3.2Å
186	I	96.8	Very high	95.2	Very high	4 Å²	4	35.3 Å²	35.3	2%	0.021	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	123.1	-172.6	-52.2	173.5	0	0	0	109.8	L175 L178 E179 C184 V193 S194 V195 V205	L175-I186 HydrophobicContact CD1-CB 3.78Å; L175-I186 HydrophobicContact CD1-CG2 3.5Å; L175-I186 HydrophobicContact CG-CB 4.42Å; L178-I186 HydrophobicContact CB-CD1 4.17Å; L178-I186 HydrophobicContact CD2-CD1 3.62Å; L178-I186 HydrophobicContact CG-CD1 3.65Å; E179-I186 HydrophobicContact CG-CB 4.17Å; E179-I186 HydrophobicContact CG-CD1 4.24Å; E179-I186 HydrophobicContact CG-CG1 4.04Å; E179-I186 PolarHBondContact OE1-N 3.46Å; C184-I186 HydrophobicContact CB-CG1 4.24Å; I186-V193 HydrophobicContact CG2-CG1 3.5Å; I186-S194 CarbonylContact C-O 3.59Å; I186-S194 WeakPolarHBondContact CA-O 3.37Å; I186-V195 HydrophobicContact CG1-CG1 4.15Å; I186-V195 HydrophobicContact CG2-CG2 4.34Å; I186-V205 HydrophobicContact CD1-CG1 3.92Å; I186-V205 HydrophobicContact CD1-CG2 4.14Å; I186-V205 HydrophobicContact CG1-CG1 4.47Å
187	V	95.3	Very high	95.3	Very high	27 Å²	27	30.1 Å²	30.1	16%	0.164	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	123.8	174.1	177	0	0	0	0	109.6	V132 Y185 V193 S194	V132-V187 HydrophobicContact CG2-CB 4.34Å; V132-V187 HydrophobicContact CG2-CG2 4.25Å; Y185-V187 HydrophobicContact CD1-CG2 3.98Å; Y185-V187 HydrophobicContact CE1-CG2 3.18Å; V187-V193 CarbonylContact O-C 3.54Å; V187-V193 WeakPolarHBondContact O-CA 3.43Å; V187-S194 PolarHBondContact N-O 2.86Å; V187-S194 PolarHBondContact O-N 3.22Å
188	V	95	Very high	95.3	Very high	28 Å²	28	35.2 Å²	35.2	17%	0.17	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	113.6	175	-178	0	0	0	0	108.7	R164 L167 I168 L175 V193	R164-V188 HydrophobicContact CG-CG1 3.88Å; L167-V188 HydrophobicContact CD2-CG2 4.2Å; I168-V188 HydrophobicContact CD1-CB 4.37Å; I168-V188 HydrophobicContact CD1-CG1 4.2Å; I168-V188 HydrophobicContact CG1-CB 4.2Å; I168-V188 HydrophobicContact CG1-CG1 4.28Å; I168-V188 HydrophobicContact CG1-CG2 4.22Å; L175-V188 HydrophobicContact CD1-CG2 3.98Å; L175-V188 HydrophobicContact CD2-CG2 4.43Å; V188-V193 HydrophobicContact CG1-CG2 4.41Å; V188-V193 HydrophobicContact CG2-CG1 4.18Å; V188-V193 HydrophobicContact CG2-CG2 4.21Å
189	Q	92.1	Very high	95.2	Very high	30 Å²	30	42.1 Å²	42.1	14%	0.14	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	114.3	-178.8	-167.9	-159.6	27.3	0	0	110.3	Y72 R130 S131 K191 T192	Y72-Q189 PolarHBondContact OH-NE2 2.97Å; R130-Q189 PolarHBondContact O-OE1 3.35Å; R130-Q189 VanDerWaalsContact O-OE1 3.06Å; S131-Q189 PolarHBondContact OG-NE2 3.3Å; Q189-K191 PolarHBondContact O-N 3.45Å; Q189-T192 CarbonylContact C-O 3.59Å; Q189-T192 PolarHBondContact N-O 3.48Å; Q189-T192 PolarHBondContact O-N 3.12Å; Q189-T192 PolarHBondContact O-OG1 3.26Å
190	G	91	Very high	95.1	Very high	41 Å²	41	46.8 Å²	46.8	42%	0.423	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.8	-107.3	176.6	0	0	0	0	0	113.2	R164	R164-G190 WeakPolarHBondContact CD-O 3.4Å; R164-G190 PolarHBondContact NH1-O 2.72Å
191	K	93.9	Very high	95.1	Very high	127 Å²	127	42.9 Å²	42.9	55%	0.552	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-111.1	12.7	178.9	-63.4	-175.1	-176.8	-179.6	0	113.2	I152 F160 Q189	I152-K191 WeakPolarHBondContact CG1-O 3.26Å; I152-K191 PolarHBondContact N-O 3.33Å; F160-K191 HydrophobicContact CE1-CG 4.16Å; F160-K191 HydrophobicContact CZ-CB 4.37Å; F160-K191 HydrophobicContact CZ-CG 3.94Å; Q189-K191 PolarHBondContact O-N 3.45Å
192	T	95.5	Very high	95.2	Very high	5 Å²	5	42.5 Å²	42.5	3%	0.031	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	144.6	179.6	49.8	0	0	0	0	110.1	R130 I149 I150 E151 Q189	R130-T192 PolarHBondContact NH1-OG1 2.93Å; I149-T192 HydrophobicContact CG2-CG2 4.19Å; I150-T192 CarbonylContact O-C 3.45Å; I150-T192 WeakPolarHBondContact O-CA 3.44Å; E151-T192 HydrophobicContact CG-CG2 4.29Å; Q189-T192 CarbonylContact C-O 3.59Å; Q189-T192 PolarHBondContact N-O 3.48Å; Q189-T192 PolarHBondContact O-N 3.12Å; Q189-T192 PolarHBondContact O-OG1 3.26Å
193	V	96.9	Very high	95.3	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	113.3	168.1	-175.1	0	0	0	0	107.2	I150 I152 L167 I186 V187 V188 V195 V209	I150-V193 HydrophobicContact CB-CB 4.34Å; I150-V193 PolarHBondContact N-O 2.98Å; I150-V193 PolarHBondContact O-N 3.24Å; I152-V193 HydrophobicContact CD1-CG2 3.39Å; I152-V193 HydrophobicContact CG1-CG2 4.02Å; L167-V193 HydrophobicContact CD2-CG2 4.01Å; I186-V193 HydrophobicContact CG2-CG1 3.5Å; V187-V193 CarbonylContact O-C 3.54Å; V187-V193 WeakPolarHBondContact O-CA 3.43Å; V188-V193 HydrophobicContact CG1-CG2 4.41Å; V188-V193 HydrophobicContact CG2-CG1 4.18Å; V188-V193 HydrophobicContact CG2-CG2 4.21Å; V193-V195 HydrophobicContact CG1-CG2 4.09Å; V193-V209 HydrophobicContact CB-CG1 4.38Å; V193-V209 HydrophobicContact CG1-CG2 4.26Å; V193-V209 HydrophobicContact CG2-CG1 3.9Å
194	S	97.2	Very high	95.4	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.007	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	131.8	174.6	-67.5	0	0	0	0	109.2	R130 D148 I186 V187	R130-S194 VanDerWaalsContact CB-OG 3.29Å; R130-S194 WeakPolarHBondContact CB-OG 3.45Å; D148-S194 CarbonylContact O-C 3.55Å; D148-S194 WeakPolarHBondContact O-CA 3.31Å; I186-S194 CarbonylContact C-O 3.59Å; I186-S194 WeakPolarHBondContact CA-O 3.37Å; V187-S194 PolarHBondContact N-O 2.86Å; V187-S194 PolarHBondContact O-N 3.22Å
195	V	97.6	Very high	95.4	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	134.8	-177.5	-168.9	0	0	0	0	108.6	A147 D148 I150 C184 Y185 I186 V193 L202 V205	A147-V195 CarbonylContact C-O 3.49Å; A147-V195 WeakPolarHBondContact CA-O 3.21Å; D148-V195 HydrophobicContact CB-CB 4.47Å; D148-V195 PolarHBondContact N-O 3.49Å; D148-V195 PolarHBondContact O-N 3.44Å; I150-V195 HydrophobicContact CD1-CG2 3.84Å; C184-V195 HydrophobicContact CB-CG1 3.8Å; Y185-V195 CarbonylContact O-C 3.58Å; Y185-V195 VanDerWaalsContact O-CA 3.31Å; Y185-V195 WeakPolarHBondContact O-CA 3.48Å; I186-V195 HydrophobicContact CG1-CG1 4.15Å; I186-V195 HydrophobicContact CG2-CG2 4.34Å; V193-V195 HydrophobicContact CG1-CG2 4.09Å; V195-L202 HydrophobicContact CB-CD2 3.74Å; V195-L202 HydrophobicContact CG1-CD2 3.26Å; V195-V205 HydrophobicContact CB-CG1 4.5Å; V195-V205 HydrophobicContact CG1-CB 4.24Å; V195-V205 HydrophobicContact CG1-CG1 3.99Å; V195-V205 HydrophobicContact CG1-CG2 4.3Å; V195-V205 HydrophobicContact CG2-CG1 3.67Å
196	V	97.2	Very high	95.4	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.006	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	127.8	174	179.9	0	0	0	0	108.7	L127 V140 F146 C184 Y185	L127-V196 HydrophobicContact CD1-CG2 3.59Å; L127-V196 HydrophobicContact CD2-CG2 3.97Å; L127-V196 HydrophobicContact CG-CG2 4.45Å; V140-V196 HydrophobicContact CG2-CG1 3.76Å; V140-V196 HydrophobicContact CG2-CG2 4.34Å; F146-V196 WeakPolarHBondContact O-CA 3.48Å; C184-V196 CarbonylContact C-O 3.58Å; C184-V196 VanDerWaalsContact CA-O 3.26Å; C184-V196 WeakPolarHBondContact CA-O 3.32Å; C184-V196 WeakPolarHBondContact CB-O 3.5Å; Y185-V196 PolarHBondContact N-O 2.86Å; Y185-V196 PolarHBondContact O-N 3.2Å
197	G	96.6	Very high	95.3	Very high	4 Å²	4	55.4 Å²	55.4	4%	0.041	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	170.8	-169.2	-178.3	0	0	0	0	0	113.3	F146	F146-G197 PolarHBondContact N-O 3.09Å; F146-G197 PolarHBondContact O-N 3.34Å
198	R	95.8	Very high	95.3	Very high	141 Å²	141	54.7 Å²	54.7	53%	0.532	25%	0.254	S	S	.	.			trans	-72.5	152.8	176.4	-65.8	175.7	169.2	175.3	-4.8	111	E144 N200 D201 L202	E144-R198 IonicContact OE2-NH2 2.56Å; R198-N200 PolarHBondContact O-N 3.42Å; R198-D201 PolarHBondContact O-N 3.31Å; R198-D201 VanDerWaalsContact O-N 3.11Å; R198-L202 WeakPolarHBondContact O-CG 3.29Å; R198-L202 PolarHBondContact O-N 3.03Å
199	Y	94.5	Very high	95.4	Very high	147 Å²	147	53.4 Å²	53.4	58%	0.576	25%	0.245	S	C	*	.	H	α-helix	trans	-54.5	-45.7	-174.9	-178.3	-98.1	0	0	0	114.4	D201 L202 K203	Y199-D201 VanDerWaalsContact C-N 3.33Å; Y199-D201 PolarHBondContact O-N 3.16Å; Y199-L202 PolarHBondContact O-N 2.91Å; Y199-K203 PolarHBondContact O-N 3.26Å; Y199-K203 VanDerWaalsContact O-N 3.16Å
200	N	93.2	Very high	95.6	Very high	120 Å²	120	55.6 Å²	55.6	64%	0.642	26%	0.256	S	S	*	.	H	α-helix	trans	-62.4	-42.1	179.9	-70.5	-24.6	0	0	0	111.7	R198 K203 E204	R198-N200 PolarHBondContact O-N 3.42Å; N200-K203 WeakPolarHBondContact O-CB 3.48Å; N200-K203 PolarHBondContact O-N 3.15Å; N200-E204 PolarHBondContact O-N 3.17Å
201	D	95.2	Very high	95.7	Very high	30 Å²	30	54 Å²	54	16%	0.16	24%	0.239	C	C	.	.	H	α-helix	trans	-68.4	-39.2	-179.8	-59.3	-34	0	0	0	111.1	T182 C184 R198 Y199 K203 E204 V205	T182-D201 WeakPolarHBondContact O-CB 3.43Å; C184-D201 WeakPolarHBondContact SG-CB 3.36Å; R198-D201 PolarHBondContact O-N 3.31Å; R198-D201 VanDerWaalsContact O-N 3.11Å; Y199-D201 VanDerWaalsContact C-N 3.33Å; Y199-D201 PolarHBondContact O-N 3.16Å; D201-K203 VanDerWaalsContact C-N 3.31Å; D201-K203 PolarHBondContact O-N 3.35Å; D201-E204 PolarHBondContact O-N 3.19Å; D201-E204 VanDerWaalsContact O-N 3.15Å; D201-V205 WeakPolarHBondContact O-CG2 3.45Å; D201-V205 PolarHBondContact O-N 3.14Å
202	L	95.9	Very high	95.8	Very high	10 Å²	10	48 Å²	48	5%	0.052	21%	0.214	C	C	.	.	H	α-helix	trans	-58.2	-42.5	174	-66.8	-179.5	0	0	0	112	F146 D148 V195 R198 Y199 E204 V205 R206	F146-L202 HydrophobicContact CB-CD1 3.54Å; D148-L202 HydrophobicContact CB-CD1 4.28Å; D148-L202 HydrophobicContact CB-CD2 4.23Å; V195-L202 HydrophobicContact CB-CD2 3.74Å; V195-L202 HydrophobicContact CG1-CD2 3.26Å; R198-L202 WeakPolarHBondContact O-CG 3.29Å; R198-L202 PolarHBondContact O-N 3.03Å; Y199-L202 PolarHBondContact O-N 2.91Å; L202-E204 VanDerWaalsContact C-N 3.3Å; L202-E204 PolarHBondContact O-N 3.22Å; L202-V205 PolarHBondContact O-N 3.01Å; L202-R206 VanDerWaalsContact O-CB 3.32Å; L202-R206 WeakPolarHBondContact O-CB 3.41Å; L202-R206 PolarHBondContact O-N 3.36Å
203	K	95.7	Very high	95.8	Very high	143 Å²	143	47.8 Å²	47.8	62%	0.622	21%	0.212	S	C	*	.	H	α-helix	trans	-61.9	-39.5	177.6	-173.3	177.9	-178.7	176.2	0	111.6	Y199 N200 D201 K207	Y199-K203 PolarHBondContact O-N 3.26Å; Y199-K203 VanDerWaalsContact O-N 3.16Å; N200-K203 WeakPolarHBondContact O-CB 3.48Å; N200-K203 PolarHBondContact O-N 3.15Å; D201-K203 VanDerWaalsContact C-N 3.31Å; D201-K203 PolarHBondContact O-N 3.35Å; K203-K207 PolarHBondContact O-N 3.08Å
204	E	94.6	Very high	95.7	Very high	63 Å²	63	52.6 Å²	52.6	29%	0.294	23%	0.231	S	C	.	.	H	α-helix	trans	-66.9	-48.9	175.4	-65.2	-164.7	147.9	0	0	111.7	N200 D201 L202 R206 K207 I208 L226	N200-E204 PolarHBondContact O-N 3.17Å; D201-E204 PolarHBondContact O-N 3.19Å; D201-E204 VanDerWaalsContact O-N 3.15Å; L202-E204 VanDerWaalsContact C-N 3.3Å; L202-E204 PolarHBondContact O-N 3.22Å; E204-R206 VanDerWaalsContact C-N 3.32Å; E204-R206 PolarHBondContact O-N 2.93Å; E204-K207 WeakPolarHBondContact O-CB 3.43Å; E204-K207 PolarHBondContact O-N 3.06Å; E204-K207 VanDerWaalsContact O-N 3.17Å; E204-I208 VanDerWaalsContact O-CG1 3.28Å; E204-I208 WeakPolarHBondContact O-CG1 3.28Å; E204-I208 PolarHBondContact O-N 3.03Å; E204-L226 WeakPolarHBondContact OE2-CD2 3.29Å
205	V	96.7	Very high	95.4	Very high	0 Å²	0	58 Å²	58	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-58	-45.2	177.6	176.2	0	0	0	0	110.7	T182 C184 I186 V195 D201 L202 K207 I208 V209	T182-V205 HydrophobicContact CG2-CG2 3.74Å; T182-V205 WeakPolarHBondContact OG1-CG2 3.42Å; C184-V205 HydrophobicContact CB-CG2 4.4Å; I186-V205 HydrophobicContact CD1-CG1 3.92Å; I186-V205 HydrophobicContact CD1-CG2 4.14Å; I186-V205 HydrophobicContact CG1-CG1 4.47Å; V195-V205 HydrophobicContact CB-CG1 4.5Å; V195-V205 HydrophobicContact CG1-CB 4.24Å; V195-V205 HydrophobicContact CG1-CG1 3.99Å; V195-V205 HydrophobicContact CG1-CG2 4.3Å; V195-V205 HydrophobicContact CG2-CG1 3.67Å; D201-V205 WeakPolarHBondContact O-CG2 3.45Å; D201-V205 PolarHBondContact O-N 3.14Å; L202-V205 PolarHBondContact O-N 3.01Å; V205-K207 VanDerWaalsContact C-N 3.33Å; V205-K207 PolarHBondContact O-N 3.43Å; V205-I208 PolarHBondContact O-N 3.31Å; V205-V209 HydrophobicContact CG1-CG2 4.02Å; V205-V209 WeakPolarHBondContact O-CG2 3.05Å; V205-V209 PolarHBondContact O-N 2.85Å
206	R	96.6	Very high	95.1	Very high	96 Å²	96	62 Å²	62	36%	0.362	28%	0.281	S	S	.	.	H	α-helix	trans	-55.9	-46.2	176.6	177.1	176	-81.7	-113.7	-0.7	112.1	D148 I150 L202 E204 I208 V209 Q210	D148-R206 IonicContact OD1-CZ 2.94Å; D148-R206 IonicContact OD1-NE 3.18Å; D148-R206 IonicContact OD1-NH2 3.32Å; D148-R206 PolarHBondContact OD1-NH2 2.86Å; D148-R206 IonicContact OD2-CZ 3.2Å; D148-R206 VanDerWaalsContact OD2-CZ 3.23Å; D148-R206 IonicContact OD2-NE 3.91Å; D148-R206 PolarHBondContact OD2-NE 3.38Å; D148-R206 IonicContact OD2-NH2 2.67Å; D148-R206 PolarHBondContact OD2-NH2 3.33Å; I150-R206 HydrophobicContact CD1-CB 4.05Å; I150-R206 HydrophobicContact CD1-CG 4.49Å; I150-R206 HydrophobicContact CG1-CB 4.49Å; I150-R206 HydrophobicContact CG1-CG 4.5Å; L202-R206 VanDerWaalsContact O-CB 3.32Å; L202-R206 WeakPolarHBondContact O-CB 3.41Å; L202-R206 PolarHBondContact O-N 3.36Å; E204-R206 VanDerWaalsContact C-N 3.32Å; E204-R206 PolarHBondContact O-N 2.93Å; R206-I208 VanDerWaalsContact C-N 3.31Å; R206-I208 PolarHBondContact O-N 3.48Å; R206-V209 PolarHBondContact O-N 2.98Å; R206-Q210 WeakPolarHBondContact O-CB 3.24Å; R206-Q210 VanDerWaalsContact O-CG 3.31Å; R206-Q210 WeakPolarHBondContact O-CG 3.34Å; R206-Q210 PolarHBondContact O-N 3.17Å
207	K	95.4	Very high	94.8	Very high	150 Å²	150	64.4 Å²	64.4	65%	0.652	29%	0.293	S	S	*	.	H	α-helix	trans	-62	-39.4	176.5	-174.6	176.5	-178.9	174.2	0	111.9	K203 E204 V205 G211	K203-K207 PolarHBondContact O-N 3.08Å; E204-K207 WeakPolarHBondContact O-CB 3.43Å; E204-K207 PolarHBondContact O-N 3.06Å; E204-K207 VanDerWaalsContact O-N 3.17Å; V205-K207 VanDerWaalsContact C-N 3.33Å; V205-K207 PolarHBondContact O-N 3.43Å; K207-G211 PolarHBondContact O-N 3.18Å
208	I	95.7	Very high	94.6	Very high	12 Å²	12	67.9 Å²	67.9	6%	0.062	31%	0.308	C	S	.	.	H	α-helix	trans	-69	-46.8	-179.7	-66	172.5	0	0	0	111.1	L178 E204 V205 R206 G211 C212 L226	L178-I208 HydrophobicContact CD1-CD1 3.63Å; L178-I208 HydrophobicContact CD1-CG2 4.25Å; L178-I208 HydrophobicContact CD2-CG2 4.2Å; E204-I208 VanDerWaalsContact O-CG1 3.28Å; E204-I208 WeakPolarHBondContact O-CG1 3.28Å; E204-I208 PolarHBondContact O-N 3.03Å; V205-I208 PolarHBondContact O-N 3.31Å; R206-I208 VanDerWaalsContact C-N 3.31Å; R206-I208 PolarHBondContact O-N 3.48Å; I208-G211 PolarHBondContact O-N 3.39Å; I208-C212 WeakPolarHBondContact O-CB 3.35Å; I208-C212 PolarHBondContact O-N 2.9Å; I208-L226 HydrophobicContact CD1-CD1 3.56Å; I208-L226 HydrophobicContact CD1-CG 4.18Å
209	V	96.7	Very high	94.6	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-61.2	-48.8	178.3	172.6	0	0	0	0	110.3	I150 I152 L167 V193 V205 R206 C212 I213	I150-V209 HydrophobicContact CD1-CB 4.28Å; I150-V209 HydrophobicContact CD1-CG2 4.21Å; I150-V209 HydrophobicContact CG2-CG1 3.91Å; I152-V209 HydrophobicContact CG2-CG1 3.65Å; L167-V209 HydrophobicContact CD1-CG2 4.31Å; L167-V209 HydrophobicContact CD2-CG1 4.23Å; L167-V209 HydrophobicContact CD2-CG2 4.13Å; V193-V209 HydrophobicContact CB-CG1 4.38Å; V193-V209 HydrophobicContact CG1-CG2 4.26Å; V193-V209 HydrophobicContact CG2-CG1 3.9Å; V205-V209 HydrophobicContact CG1-CG2 4.02Å; V205-V209 WeakPolarHBondContact O-CG2 3.05Å; V205-V209 PolarHBondContact O-N 2.85Å; R206-V209 PolarHBondContact O-N 2.98Å; V209-C212 PolarHBondContact O-N 2.9Å; V209-I213 WeakPolarHBondContact O-CG1 3.33Å; V209-I213 PolarHBondContact O-N 2.62Å
210	Q	95.6	Very high	94.5	Very high	77 Å²	77	56.5 Å²	56.5	36%	0.36	28%	0.275	S	S	.	.	H	α-helix	trans	-63.1	-44	177.5	-71.2	-179.4	-8.2	0	0	112.1	R206 C212 I213 Y214	R206-Q210 WeakPolarHBondContact O-CB 3.24Å; R206-Q210 VanDerWaalsContact O-CG 3.31Å; R206-Q210 WeakPolarHBondContact O-CG 3.34Å; R206-Q210 PolarHBondContact O-N 3.17Å; Q210-C212 VanDerWaalsContact C-N 3.31Å; Q210-C212 PolarHBondContact O-N 2.84Å; Q210-I213 PolarHBondContact O-N 2.76Å; Q210-Y214 HydrophobicContact CB-CD2 4.09Å; Q210-Y214 HydrophobicContact CB-CE2 4.49Å; Q210-Y214 HydrophobicContact CG-CD2 4.35Å; Q210-Y214 HydrophobicContact CG-CE2 4.27Å; Q210-Y214 WeakPolarHBondContact O-CB 3.48Å; Q210-Y214 WeakPolarHBondContact O-CD2 3.32Å; Q210-Y214 PolarHBondContact O-N 3.06Å
211	G	94.3	Very high	94.5	Very high	7 Å²	7	57.6 Å²	57.6	7%	0.072	27%	0.271	C	S	.	.	H	α-helix	trans	-63.5	-34.8	177	0	0	0	0	0	113.4	K207 I208 D215 N216 I217	K207-G211 PolarHBondContact O-N 3.18Å; I208-G211 PolarHBondContact O-N 3.39Å; G211-D215 CarbonylContact O-C 3.55Å; G211-D215 WeakPolarHBondContact O-CB 3.5Å; G211-D215 PolarHBondContact O-N 3.45Å; G211-N216 PolarHBondContact O-N 3.13Å; G211-I217 PolarHBondContact O-N 2.82Å
212	C	94.8	Very high	94.4	Very high	2 Å²	2	57.1 Å²	57.1	1%	0.014	27%	0.27	C	S	.	.	H	α-helix	trans	-68.4	-44.2	175.3	-176.7	0	0	0	0	112.1	L167 I208 V209 Q210 I217	L167-C212 HydrophobicContact CD1-CB 4.36Å; I208-C212 WeakPolarHBondContact O-CB 3.35Å; I208-C212 PolarHBondContact O-N 2.9Å; V209-C212 PolarHBondContact O-N 2.9Å; Q210-C212 VanDerWaalsContact C-N 3.31Å; Q210-C212 PolarHBondContact O-N 2.84Å; C212-I217 VanDerWaalsContact CA-O 3.29Å; C212-I217 WeakPolarHBondContact CA-O 3.37Å
213	I	95	Very high	94.3	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-82.9	-43.3	-172.7	-64.4	-66.3	0	0	0	112.6	I152 R163 V209 Q210	I152-I213 HydrophobicContact CB-CG1 4.18Å; I152-I213 HydrophobicContact CB-CG2 4.18Å; I152-I213 HydrophobicContact CD1-CD1 4.45Å; I152-I213 HydrophobicContact CG2-CB 4.05Å; I152-I213 HydrophobicContact CG2-CG1 3.64Å; I152-I213 HydrophobicContact CG2-CG2 4.06Å; R163-I213 HydrophobicContact CB-CD1 3.94Å; R163-I213 WeakPolarHBondContact CD-O 3.35Å; R163-I213 PolarHBondContact NH1-O 3.4Å; V209-I213 WeakPolarHBondContact O-CG1 3.33Å; V209-I213 PolarHBondContact O-N 2.62Å; Q210-I213 PolarHBondContact O-N 2.76Å
214	Y	94.7	Very high	94.2	Very high	101 Å²	101	57.2 Å²	57.2	40%	0.396	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-53.9	-175.7	-59.5	-68.2	0	0	0	111.4	N153 R163 Q210 N216	N153-Y214 PolarHBondContact N-OH 2.98Å; N153-Y214 WeakPolarHBondContact O-CE1 3.31Å; N153-Y214 PolarHBondContact O-OH 3.27Å; R163-Y214 PolarHBondContact NH1-O 3.48Å; Q210-Y214 HydrophobicContact CB-CD2 4.09Å; Q210-Y214 HydrophobicContact CB-CE2 4.49Å; Q210-Y214 HydrophobicContact CG-CD2 4.35Å; Q210-Y214 HydrophobicContact CG-CE2 4.27Å; Q210-Y214 WeakPolarHBondContact O-CB 3.48Å; Q210-Y214 WeakPolarHBondContact O-CD2 3.32Å; Q210-Y214 PolarHBondContact O-N 3.06Å; Y214-N216 VanDerWaalsContact C-N 3.28Å; Y214-N216 PolarHBondContact O-N 3.03Å
215	D	91	Very high	94.1	Very high	114 Å²	114	58.5 Å²	58.5	61%	0.61	27%	0.273	S	S	*	.	S	Bend	trans	-81.3	-1.5	-172.6	-60	-39.1	0	0	0	114.7	G211 I217	G211-D215 CarbonylContact O-C 3.55Å; G211-D215 WeakPolarHBondContact O-CB 3.5Å; G211-D215 PolarHBondContact O-N 3.45Å; D215-I217 HydrophobicContact CB-CD1 3.8Å; D215-I217 HydrophobicContact CB-CG1 3.92Å; D215-I217 PolarHBondContact O-N 3.29Å
216	N	91.3	Very high	94	Very high	84 Å²	84	58.8 Å²	58.8	45%	0.449	28%	0.275	S	S	.	.			trans	59.5	27.5	-178.2	-160.8	35.1	0	0	0	114.1	R163 R166 G211 Y214	R163-N216 PolarHBondContact NE-OD1 3.41Å; R163-N216 VanDerWaalsContact NH2-CB 3.28Å; R163-N216 VanDerWaalsContact NH2-CG 3.34Å; R163-N216 PolarHBondContact NH2-OD1 3Å; R166-N216 PolarHBondContact NH1-OD1 3.43Å; G211-N216 PolarHBondContact O-N 3.13Å; Y214-N216 VanDerWaalsContact C-N 3.28Å; Y214-N216 PolarHBondContact O-N 3.03Å
217	I	92	Very high	93.8	Very high	52 Å²	52	58.1 Å²	58.1	27%	0.267	28%	0.278	S	S	.	.			trans	-82.1	134.2	177.8	-62.7	169.7	0	0	0	108.7	G211 C212 D215 M250	G211-I217 PolarHBondContact O-N 2.82Å; C212-I217 VanDerWaalsContact CA-O 3.29Å; C212-I217 WeakPolarHBondContact CA-O 3.37Å; D215-I217 HydrophobicContact CB-CD1 3.8Å; D215-I217 HydrophobicContact CB-CG1 3.92Å; D215-I217 PolarHBondContact O-N 3.29Å; I217-M250 HydrophobicContact CD1-SD 4.27Å; I217-M250 HydrophobicContact CG1-SD 4.35Å; I217-M250 HydrophobicContact CG2-CE 3.68Å; I217-M250 HydrophobicContact CG2-SD 3.43Å; I217-M250 WeakPolarHBondContact CG2-SD 3.42Å
218	H	92.9	Very high	93.7	Very high	76 Å²	76	52.7 Å²	52.7	35%	0.352	26%	0.256	S	S	.	.			trans	-73.7	131.9	177	-163.3	-79.1	0	0	0	110.5	A220 Y221	H218-A220 WeakPolarHBondContact ND1-CB 3.43Å; H218-A220 PolarHBondContact ND1-N 3.27Å; H218-A220 PolarHBondContact O-N 2.82Å; H218-Y221 HydrophobicContact CB-CD2 3.7Å; H218-Y221 HydrophobicContact CB-CE2 3.83Å; H218-Y221 WeakPolarHBondContact O-CD2 3.2Å; H218-Y221 PolarHBondContact O-N 3.36Å; H218-Y221 VanDerWaalsContact O-N 3.08Å
219	P	94.4	Very high	93.6	Very high	2 Å²	2	53.3 Å²	53.3	1%	0.013	26%	0.259	C	S	.	.	H	α-helix	trans	-60.4	-30.2	-176.1	23.4	-34.6	0	0	0	113.1	R166 T174 Y221 S222 I223	R166-P219 HydrophobicContact CG-CG 4.24Å; R166-P219 WeakPolarHBondContact O-CG 3.43Å; T174-P219 HydrophobicContact CG2-CB 3.8Å; T174-P219 HydrophobicContact CG2-CG 3.56Å; P219-Y221 PolarHBondContact O-N 3.23Å; P219-S222 WeakPolarHBondContact O-CA 3.33Å; P219-S222 WeakPolarHBondContact O-CB 3.37Å; P219-S222 PolarHBondContact O-N 3.43Å; P219-I223 WeakPolarHBondContact O-CG1 3.39Å; P219-I223 PolarHBondContact O-N 3.07Å
220	A	92.9	Very high	93.3	Very high	48 Å²	48	56.5 Å²	56.5	40%	0.397	27%	0.273	S	S	.	.	H	α-helix	trans	-52.7	-35.9	173.9	0	0	0	0	0	114	H218 S222 I223 K224	H218-A220 WeakPolarHBondContact ND1-CB 3.43Å; H218-A220 PolarHBondContact ND1-N 3.27Å; H218-A220 PolarHBondContact O-N 2.82Å; A220-S222 VanDerWaalsContact C-N 3.33Å; A220-I223 PolarHBondContact O-N 3.33Å; A220-K224 WeakPolarHBondContact O-CB 3.18Å; A220-K224 PolarHBondContact O-N 3.44Å
221	Y	92.7	Very high	93.2	Very high	143 Å²	143	59.1 Å²	59.1	56%	0.561	28%	0.283	S	S	*	.	H	α-helix	trans	-67	-38.2	175.9	-66.9	-70.8	0	0	0	111.6	H218 P219 R225 M250	H218-Y221 HydrophobicContact CB-CD2 3.7Å; H218-Y221 HydrophobicContact CB-CE2 3.83Å; H218-Y221 WeakPolarHBondContact O-CD2 3.2Å; H218-Y221 PolarHBondContact O-N 3.36Å; H218-Y221 VanDerWaalsContact O-N 3.08Å; P219-Y221 PolarHBondContact O-N 3.23Å; Y221-R225 WeakPolarHBondContact O-CB 3.45Å; Y221-R225 PolarHBondContact O-N 3.41Å; Y221-M250 VanDerWaalsContact CB-CE 3.45Å; Y221-M250 HydrophobicContact CG-CE 4.39Å
222	S	93.1	Very high	93.2	Very high	20 Å²	20	59.2 Å²	59.2	14%	0.14	28%	0.282	C	S	.	.	H	α-helix	trans	-68.1	-44.1	176.2	-58.9	0	0	0	0	111.5	P219 A220 K224 R225 L226	P219-S222 WeakPolarHBondContact O-CA 3.33Å; P219-S222 WeakPolarHBondContact O-CB 3.37Å; P219-S222 PolarHBondContact O-N 3.43Å; A220-S222 VanDerWaalsContact C-N 3.33Å; S222-K224 VanDerWaalsContact C-N 3.34Å; S222-K224 PolarHBondContact O-N 3.06Å; S222-R225 WeakPolarHBondContact O-CA 3.4Å; S222-R225 WeakPolarHBondContact O-CB 3.3Å; S222-R225 PolarHBondContact O-N 3.29Å; S222-R225 VanDerWaalsContact O-N 3.09Å; S222-L226 WeakPolarHBondContact O-CG 3.47Å; S222-L226 PolarHBondContact O-N 2.92Å
223	I	94	Very high	92.9	Very high	25 Å²	25	61.7 Å²	61.7	13%	0.128	30%	0.299	C	S	.	.	H	α-helix	trans	-58.8	-46.9	176.1	-66.1	165.5	0	0	0	110.3	T174 A177 L178 P219 A220 R225 L226 L227	T174-I223 HydrophobicContact CG2-CD1 3.83Å; A177-I223 HydrophobicContact CB-CD1 4.06Å; A177-I223 HydrophobicContact CB-CG2 4.37Å; L178-I223 HydrophobicContact CD1-CG1 4.35Å; P219-I223 WeakPolarHBondContact O-CG1 3.39Å; P219-I223 PolarHBondContact O-N 3.07Å; A220-I223 PolarHBondContact O-N 3.33Å; I223-R225 VanDerWaalsContact C-N 3.28Å; I223-R225 PolarHBondContact O-N 3.17Å; I223-L226 PolarHBondContact O-N 3.42Å; I223-L227 PolarHBondContact O-N 2.99Å
224	K	93.3	Very high	92.8	Very high	129 Å²	129	68.8 Å²	68.8	56%	0.561	33%	0.334	S	S	*	.	H	α-helix	trans	-58.4	-41.7	175	-174.9	174.5	-177	171.8	0	111.9	A220 S222 L227 I228 P248	A220-K224 WeakPolarHBondContact O-CB 3.18Å; A220-K224 PolarHBondContact O-N 3.44Å; S222-K224 VanDerWaalsContact C-N 3.34Å; S222-K224 PolarHBondContact O-N 3.06Å; K224-L227 PolarHBondContact O-N 3.27Å; K224-I228 HydrophobicContact CG-CD1 4.15Å; K224-I228 WeakPolarHBondContact O-CG1 3.41Å; K224-I228 PolarHBondContact O-N 3.39Å; K224-I228 VanDerWaalsContact O-N 3.12Å; K224-P248 HydrophobicContact CD-CG 4.47Å
225	R	93.4	Very high	92.7	Very high	90 Å²	90	66.9 Å²	66.9	34%	0.34	33%	0.33	S	S	.	.	H	α-helix	trans	-63	-45.7	176.9	-170	-177.2	178.4	-86	-2.6	111.3	Y221 S222 I223 I228 I229 L247	Y221-R225 WeakPolarHBondContact O-CB 3.45Å; Y221-R225 PolarHBondContact O-N 3.41Å; S222-R225 WeakPolarHBondContact O-CA 3.4Å; S222-R225 WeakPolarHBondContact O-CB 3.3Å; S222-R225 PolarHBondContact O-N 3.29Å; S222-R225 VanDerWaalsContact O-N 3.09Å; I223-R225 VanDerWaalsContact C-N 3.28Å; I223-R225 PolarHBondContact O-N 3.17Å; R225-I228 PolarHBondContact O-N 3.2Å; R225-I229 HydrophobicContact CG-CD1 4.06Å; R225-I229 VanDerWaalsContact O-CG1 3.29Å; R225-I229 WeakPolarHBondContact O-CG1 3.5Å; R225-I229 PolarHBondContact O-N 3.3Å; R225-L247 HydrophobicContact CG-CD2 3.93Å
226	L	93.5	Very high	92.9	Very high	7 Å²	7	66.2 Å²	66.2	4%	0.037	33%	0.333	C	S	.	.	H	α-helix	trans	-61.5	-42.7	177.4	-70.1	-177.8	0	0	0	112.2	L178 T182 E204 I208 S222 I223 I228 I229 K230	L178-L226 HydrophobicContact CD1-CD1 4.06Å; T182-L226 HydrophobicContact CG2-CD1 3.53Å; E204-L226 WeakPolarHBondContact OE2-CD2 3.29Å; I208-L226 HydrophobicContact CD1-CD1 3.56Å; I208-L226 HydrophobicContact CD1-CG 4.18Å; S222-L226 WeakPolarHBondContact O-CG 3.47Å; S222-L226 PolarHBondContact O-N 2.92Å; I223-L226 PolarHBondContact O-N 3.42Å; L226-I228 VanDerWaalsContact C-N 3.34Å; L226-I228 PolarHBondContact O-N 3.29Å; L226-I229 WeakPolarHBondContact O-CB 3.43Å; L226-I229 PolarHBondContact O-N 2.96Å; L226-K230 PolarHBondContact O-N 3.42Å
227	L	93	Very high	92.9	Very high	82 Å²	82	67.6 Å²	67.6	43%	0.429	34%	0.344	S	S	.	.	H	α-helix	trans	-62	-42.7	177.7	-173	154.9	0	0	0	111.7	I223 K224 K230 K231	I223-L227 PolarHBondContact O-N 2.99Å; K224-L227 PolarHBondContact O-N 3.27Å; L227-K230 PolarHBondContact O-N 3.36Å; L227-K231 HydrophobicContact CD2-CD 3.88Å; L227-K231 HydrophobicContact CD2-CG 4.42Å; L227-K231 WeakPolarHBondContact O-CG 3.39Å; L227-K231 PolarHBondContact O-N 2.93Å
228	I	93.5	Very high	92.8	Very high	36 Å²	36	67.8 Å²	67.8	19%	0.185	34%	0.343	C	S	.	.	H	α-helix	trans	-64.5	-43.7	175.8	-67.2	166.3	0	0	0	110.2	K224 R225 L226 K230 K231 L232 L247 P248	K224-I228 HydrophobicContact CG-CD1 4.15Å; K224-I228 WeakPolarHBondContact O-CG1 3.41Å; K224-I228 PolarHBondContact O-N 3.39Å; K224-I228 VanDerWaalsContact O-N 3.12Å; R225-I228 PolarHBondContact O-N 3.2Å; L226-I228 VanDerWaalsContact C-N 3.34Å; L226-I228 PolarHBondContact O-N 3.29Å; I228-K230 PolarHBondContact O-N 2.82Å; I228-K231 PolarHBondContact O-N 3.27Å; I228-L232 HydrophobicContact CG2-CD1 3.67Å; I228-L232 HydrophobicContact CG2-CG 4.17Å; I228-L232 WeakPolarHBondContact O-CB 3.2Å; I228-L232 WeakPolarHBondContact O-CG 3.39Å; I228-L232 PolarHBondContact O-N 3.33Å; I228-L247 HydrophobicContact CB-CD2 4.45Å; I228-L247 HydrophobicContact CG2-CD2 4.03Å; I228-P248 HydrophobicContact CD1-CG 3.65Å
229	I	92.9	Very high	92.4	Very high	25 Å²	25	69.3 Å²	69.3	13%	0.128	35%	0.35	C	S	.	.	H	α-helix	trans	-58.5	-48.5	176.7	-73	170.4	0	0	0	111.1	R225 L226 K231 L232 S233 W243 L247	R225-I229 HydrophobicContact CG-CD1 4.06Å; R225-I229 VanDerWaalsContact O-CG1 3.29Å; R225-I229 WeakPolarHBondContact O-CG1 3.5Å; R225-I229 PolarHBondContact O-N 3.3Å; L226-I229 WeakPolarHBondContact O-CB 3.43Å; L226-I229 PolarHBondContact O-N 2.96Å; I229-K231 VanDerWaalsContact C-N 3.34Å; I229-K231 PolarHBondContact O-N 3.45Å; I229-L232 PolarHBondContact O-N 3Å; I229-S233 PolarHBondContact O-N 3.45Å; I229-S233 PolarHBondContact O-OG 3.49Å; I229-W243 HydrophobicContact CG1-CE3 4.43Å; I229-W243 HydrophobicContact CG2-CE3 4.2Å; I229-W243 HydrophobicContact CG2-CZ3 3.78Å; I229-L247 HydrophobicContact CD1-CD2 4.09Å; I229-L247 HydrophobicContact CG1-CD2 3.55Å
230	K	91.6	Very high	92.1	Very high	66 Å²	66	77.1 Å²	77.1	29%	0.287	39%	0.392	S	S	.	.	H	α-helix	trans	-57.8	-44.4	177.3	-80.8	-174.6	158.1	-175.8	0	112.2	L180 S181 L226 L227 I228 S233 M234	L180-K230 PolarHBondContact O-NZ 3.29Å; S181-K230 WeakPolarHBondContact O-CE 3.44Å; S181-K230 PolarHBondContact O-NZ 3.46Å; L226-K230 PolarHBondContact O-N 3.42Å; L227-K230 PolarHBondContact O-N 3.36Å; I228-K230 PolarHBondContact O-N 2.82Å; K230-S233 WeakPolarHBondContact CA-OG 3.48Å; K230-S233 PolarHBondContact O-N 2.67Å; K230-S233 PolarHBondContact O-OG 3.45Å; K230-M234 WeakPolarHBondContact O-CG 3.15Å; K230-M234 PolarHBondContact O-N 3.43Å
231	K	92.7	Very high	92	Very high	133 Å²	133	79.5 Å²	79.5	58%	0.578	40%	0.397	S	S	*	.	H	α-helix	trans	-63.1	-45.2	175.9	-72.8	-176	176.2	-174.3	0	112	L227 I228 I229 S233 M234 D235	L227-K231 HydrophobicContact CD2-CD 3.88Å; L227-K231 HydrophobicContact CD2-CG 4.42Å; L227-K231 WeakPolarHBondContact O-CG 3.39Å; L227-K231 PolarHBondContact O-N 2.93Å; I228-K231 PolarHBondContact O-N 3.27Å; I229-K231 VanDerWaalsContact C-N 3.34Å; I229-K231 PolarHBondContact O-N 3.45Å; K231-S233 VanDerWaalsContact C-N 3.29Å; K231-S233 PolarHBondContact O-N 3.15Å; K231-M234 PolarHBondContact O-N 2.86Å; K231-D235 PolarHBondContact O-N 2.88Å
232	L	93.7	Very high	91.9	Very high	9 Å²	9	77.1 Å²	77.1	5%	0.047	40%	0.401	C	S	.	.	H	α-helix	trans	-66	-31.2	178.4	-66.1	171.1	0	0	0	112.7	I228 I229 D235 K238 W243 F246	I228-L232 HydrophobicContact CG2-CD1 3.67Å; I228-L232 HydrophobicContact CG2-CG 4.17Å; I228-L232 WeakPolarHBondContact O-CB 3.2Å; I228-L232 WeakPolarHBondContact O-CG 3.39Å; I228-L232 PolarHBondContact O-N 3.33Å; I229-L232 PolarHBondContact O-N 3Å; L232-D235 PolarHBondContact O-N 3.49Å; L232-K238 HydrophobicContact CD2-CD 3.43Å; L232-K238 VanDerWaalsContact CD2-CD 3.43Å; L232-W243 HydrophobicContact CB-CD2 4.07Å; L232-W243 HydrophobicContact CB-CG 4.37Å; L232-W243 HydrophobicContact CB-CZ2 4.32Å; L232-W243 HydrophobicContact CD1-CB 4.02Å; L232-W243 HydrophobicContact CD1-CD2 4.29Å; L232-W243 HydrophobicContact CD1-CG 3.91Å; L232-F246 HydrophobicContact CD1-CB 3.71Å; L232-F246 HydrophobicContact CD1-CD2 4.04Å; L232-F246 HydrophobicContact CD1-CG 4.16Å; L232-F246 HydrophobicContact CD2-CB 4.45Å; L232-F246 HydrophobicContact CD2-CD2 4.12Å; L232-F246 HydrophobicContact CD2-CG 4.21Å
233	S	90.2	Very high	91.8	Very high	53 Å²	53	79.4 Å²	79.4	37%	0.371	41%	0.407	S	S	.	.	H	α-helix	trans	-72	-29.5	176	64.5	0	0	0	0	113.4	I229 K230 K231	I229-S233 PolarHBondContact O-N 3.45Å; I229-S233 PolarHBondContact O-OG 3.49Å; K230-S233 WeakPolarHBondContact CA-OG 3.48Å; K230-S233 PolarHBondContact O-N 2.67Å; K230-S233 PolarHBondContact O-OG 3.45Å; K231-S233 VanDerWaalsContact C-N 3.29Å; K231-S233 PolarHBondContact O-N 3.15Å
234	M	91.7	Very high	91.7	Very high	150 Å²	150	82 Å²	82	74%	0.739	42%	0.421	S	S	*	.	H	α-helix	trans	-72.8	-30.2	175.8	-71	171.7	176.1	0	0	111.6	K230 K231 P236	K230-M234 WeakPolarHBondContact O-CG 3.15Å; K230-M234 PolarHBondContact O-N 3.43Å; K231-M234 PolarHBondContact O-N 2.86Å; M234-P236 VanDerWaalsContact O-CD 3.3Å; M234-P236 WeakPolarHBondContact O-CD 3.44Å
235	D	93.8	Very high	91.5	Very high	60 Å²	60	86.5 Å²	86.5	32%	0.321	43%	0.434	S	S	.	.			trans	-73.8	112.8	178.2	-69.9	-14.6	0	0	0	110.7	K231 L232 T237 K238	K231-D235 PolarHBondContact O-N 2.88Å; L232-D235 PolarHBondContact O-N 3.49Å; D235-T237 VanDerWaalsContact C-N 3.27Å; D235-T237 PolarHBondContact O-N 3.47Å; D235-K238 HydrophobicContact CB-CB 4.44Å; D235-K238 HydrophobicContact CB-CD 4.32Å; D235-K238 HydrophobicContact CB-CG 4.36Å; D235-K238 PolarHBondContact O-N 2.88Å; D235-K238 IonicContact OD2-NZ 2.9Å; D235-K238 PolarHBondContact OD2-NZ 3.01Å
236	P	93.4	Very high	91.3	Very high	101 Å²	101	86.2 Å²	86.2	66%	0.656	44%	0.436	S	S	*	.	G	3₁₀ helix	trans	-64.5	-29.6	-177.6	24.7	-33.7	0	0	0	113.1	M234 K238	M234-P236 VanDerWaalsContact O-CD 3.3Å; M234-P236 WeakPolarHBondContact O-CD 3.44Å; P236-K238 PolarHBondContact O-N 3.31Å
237	T	93	Very high	91.2	Very high	113 Å²	113	86.7 Å²	86.7	69%	0.693	44%	0.439	S	S	*	.	G	3₁₀ helix	trans	-68.2	-18.5	-178.2	57.2	0	0	0	0	113.9	D235	D235-T237 VanDerWaalsContact C-N 3.27Å; D235-T237 PolarHBondContact O-N 3.47Å
238	K	88.6	Confident	90.9	Very high	55 Å²	55	85.4 Å²	85.4	24%	0.239	44%	0.435	C	S	.	.	G	3₁₀ helix	trans	-108.2	1.7	-172.1	-62.5	-176.7	-169.7	147	0	114	L232 D235 P236 N240 I241 W243 F246	L232-K238 HydrophobicContact CD2-CD 3.43Å; L232-K238 VanDerWaalsContact CD2-CD 3.43Å; D235-K238 HydrophobicContact CB-CB 4.44Å; D235-K238 HydrophobicContact CB-CD 4.32Å; D235-K238 HydrophobicContact CB-CG 4.36Å; D235-K238 PolarHBondContact O-N 2.88Å; D235-K238 IonicContact OD2-NZ 2.9Å; D235-K238 PolarHBondContact OD2-NZ 3.01Å; P236-K238 PolarHBondContact O-N 3.31Å; K238-N240 VanDerWaalsContact C-N 3.3Å; K238-N240 PolarHBondContact O-N 3.03Å; K238-I241 PolarHBondContact O-N 3.01Å; K238-W243 PolarHBondContact O-NE1 3.27Å; K238-F246 HydrophobicContact CD-CE2 4.49Å
239	Q	85.7	Confident	90.4	Very high	109 Å²	109	90.3 Å²	90.3	51%	0.509	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-35.9	-176.2	-66.1	-176.8	-0.3	0	0	112.7
240	N	88.3	Confident	89.6	Confident	166 Å²	166	93.4 Å²	93.4	89%	0.888	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	-2.3	-176.6	-62.2	-20.5	0	0	0	114	K238	K238-N240 VanDerWaalsContact C-N 3.3Å; K238-N240 PolarHBondContact O-N 3.03Å
241	I	89.8	Confident	88.6	Confident	97 Å²	97	99.3 Å²	99.3	50%	0.497	50%	0.495	S	S	.	.	S	Bend	trans	-105.6	139.7	-173.8	-55.1	170.9	0	0	0	109.4	K238 W243	K238-I241 PolarHBondContact O-N 3.01Å; I241-W243 PolarHBondContact O-N 3.42Å; I241-W243 PolarHBondContact O-NE1 3.01Å
242	S	91.5	Very high	87.6	Confident	94 Å²	94	102.1 Å²	102.1	66%	0.657	51%	0.508	S	S	*	.			trans	-60.2	124.8	172.5	178.9	0	0	0	0	111.9	D244	S242-D244 VanDerWaalsContact C-N 3.33Å; S242-D244 PolarHBondContact O-N 3.01Å
243	W	90.8	Very high	86.3	Confident	67 Å²	67	110.7 Å²	110.7	25%	0.254	55%	0.545	S	S	.	.	G	3₁₀ helix	trans	-79.9	-6.8	-177.6	-62.8	-17.3	0	0	0	114.9	I229 L232 K238 I241 R245 F246 L247	I229-W243 HydrophobicContact CG1-CE3 4.43Å; I229-W243 HydrophobicContact CG2-CE3 4.2Å; I229-W243 HydrophobicContact CG2-CZ3 3.78Å; L232-W243 HydrophobicContact CB-CD2 4.07Å; L232-W243 HydrophobicContact CB-CG 4.37Å; L232-W243 HydrophobicContact CB-CZ2 4.32Å; L232-W243 HydrophobicContact CD1-CB 4.02Å; L232-W243 HydrophobicContact CD1-CD2 4.29Å; L232-W243 HydrophobicContact CD1-CG 3.91Å; K238-W243 PolarHBondContact O-NE1 3.27Å; I241-W243 PolarHBondContact O-N 3.42Å; I241-W243 PolarHBondContact O-NE1 3.01Å; W243-R245 PolarHBondContact O-N 3.39Å; W243-F246 PolarHBondContact O-N 2.7Å; W243-L247 HydrophobicContact CB-CD1 4.38Å; W243-L247 HydrophobicContact CB-CG 4.49Å; W243-L247 WeakPolarHBondContact O-CG 3.39Å; W243-L247 PolarHBondContact O-N 3.14Å
244	D	90.7	Very high	85.2	Confident	80 Å²	80	113.1 Å²	113.1	43%	0.428	56%	0.557	S	S	.	*	G	3₁₀ helix	trans	-56.4	-29.4	-172.7	-174.4	54.1	0	0	0	113.9	S242 F246 L247 K249	S242-D244 VanDerWaalsContact C-N 3.33Å; S242-D244 PolarHBondContact O-N 3.01Å; D244-F246 VanDerWaalsContact C-N 3.33Å; D244-F246 PolarHBondContact O-N 3.18Å; D244-L247 PolarHBondContact O-N 3.16Å; D244-K249 WeakPolarHBondContact OD1-CE 3.49Å; D244-K249 IonicContact OD1-NZ 3.88Å; D244-K249 WeakPolarHBondContact OD2-CE 3.12Å; D244-K249 IonicContact OD2-NZ 2.72Å; D244-K249 PolarHBondContact OD2-NZ 3.01Å
245	R	90.2	Very high	84.1	Confident	223 Å²	223	113.8 Å²	113.8	84%	0.842	56%	0.563	S	S	*	*	G	3₁₀ helix	trans	-64.6	-35.2	175.1	-176.6	179.2	177	-173.7	-0.4	113	W243	W243-R245 PolarHBondContact O-N 3.39Å
246	F	88.8	Confident	82.9	Confident	85 Å²	85	114.7 Å²	114.7	37%	0.373	57%	0.574	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.7	-18.6	-176.6	-54.6	-67	0	0	0	112.6	L232 K238 W243 D244	L232-F246 HydrophobicContact CD1-CB 3.71Å; L232-F246 HydrophobicContact CD1-CD2 4.04Å; L232-F246 HydrophobicContact CD1-CG 4.16Å; L232-F246 HydrophobicContact CD2-CB 4.45Å; L232-F246 HydrophobicContact CD2-CD2 4.12Å; L232-F246 HydrophobicContact CD2-CG 4.21Å; K238-F246 HydrophobicContact CD-CE2 4.49Å; W243-F246 PolarHBondContact O-N 2.7Å; D244-F246 VanDerWaalsContact C-N 3.33Å; D244-F246 PolarHBondContact O-N 3.18Å
247	L	90.3	Very high	81.9	Confident	17 Å²	17	121.8 Å²	121.8	9%	0.089	59%	0.588	C	S	.	*	S	Bend	trans	-81.8	133.2	-175.1	-62	173.7	0	0	0	111	R225 I228 I229 W243 D244 K249	R225-L247 HydrophobicContact CG-CD2 3.93Å; I228-L247 HydrophobicContact CB-CD2 4.45Å; I228-L247 HydrophobicContact CG2-CD2 4.03Å; I229-L247 HydrophobicContact CD1-CD2 4.09Å; I229-L247 HydrophobicContact CG1-CD2 3.55Å; W243-L247 HydrophobicContact CB-CD1 4.38Å; W243-L247 HydrophobicContact CB-CG 4.49Å; W243-L247 WeakPolarHBondContact O-CG 3.39Å; W243-L247 PolarHBondContact O-N 3.14Å; D244-L247 PolarHBondContact O-N 3.16Å; L247-K249 PolarHBondContact O-N 2.93Å
248	P	88.1	Confident	81	Confident	54 Å²	54	123.3 Å²	123.3	35%	0.351	58%	0.58	S	S	.	*			trans	-60.2	112	174.9	-23.7	33.5	0	0	0	111	K224 I228 M250	K224-P248 HydrophobicContact CD-CG 4.47Å; I228-P248 HydrophobicContact CD1-CG 3.65Å; P248-M250 PolarHBondContact O-N 2.92Å
249	K	82.7	Confident	80.1	Confident	140 Å²	140	132.5 Å²	132.5	61%	0.609	61%	0.614	S	S	*	*			trans	-77	119.9	175.6	-64.8	-173.5	177.9	-171.9	0	109.7	D244 L247 K251	D244-K249 WeakPolarHBondContact OD1-CE 3.49Å; D244-K249 IonicContact OD1-NZ 3.88Å; D244-K249 WeakPolarHBondContact OD2-CE 3.12Å; D244-K249 IonicContact OD2-NZ 2.72Å; D244-K249 PolarHBondContact OD2-NZ 3.01Å; L247-K249 PolarHBondContact O-N 2.93Å; K249-K251 PolarHBondContact O-N 3.01Å
250	M	75.6	Confident	79.7	Confident	90 Å²	90	134.6 Å²	134.6	44%	0.443	62%	0.621	S	S	.	*			trans	-72.3	98.3	172.9	-58.1	-172.4	-160.9	0	0	108.8	I217 Y221 P248 K252	I217-M250 HydrophobicContact CD1-SD 4.27Å; I217-M250 HydrophobicContact CG1-SD 4.35Å; I217-M250 HydrophobicContact CG2-CE 3.68Å; I217-M250 HydrophobicContact CG2-SD 3.43Å; I217-M250 WeakPolarHBondContact CG2-SD 3.42Å; Y221-M250 VanDerWaalsContact CB-CE 3.45Å; Y221-M250 HydrophobicContact CG-CE 4.39Å; P248-M250 PolarHBondContact O-N 2.92Å; M250-K252 PolarHBondContact O-N 3.01Å; M250-K252 VanDerWaalsContact O-N 3.16Å
251	K	71.3	Confident	79.1	Confident	189 Å²	189	130.9 Å²	130.9	82%	0.822	61%	0.606	S	S	*	*			trans	-67.5	114.4	170.4	-67	-175.2	-178.9	-179.9	0	107.7	K249 K253	K249-K251 PolarHBondContact O-N 3.01Å; K251-K253 PolarHBondContact O-N 2.79Å
252	K	70.5	Confident	78.6	Confident	192 Å²	192	133.7 Å²	133.7	84%	0.835	62%	0.617	S	S	*	*			trans	-58.9	108.6	165.6	-70.4	-175	179.1	-180	0	106.5	M250 V254	M250-K252 PolarHBondContact O-N 3.01Å; M250-K252 VanDerWaalsContact O-N 3.16Å; K252-V254 HydrophobicContact CB-CG2 4.07Å; K252-V254 PolarHBondContact O-N 2.88Å
253	K	67.2	Low	78.1	Confident	189 Å²	189	136.9 Å²	136.9	82%	0.822	62%	0.619	S	S	*	*			trans	-71.1	72.4	171.5	-66.6	-172.3	-178.7	-177.7	0	108	K251 L255	K251-K253 PolarHBondContact O-N 2.79Å; K253-L255 HydrophobicContact CB-CD1 3.88Å; K253-L255 PolarHBondContact O-N 3.12Å
254	V	67.9	Low	77.6	Confident	105 Å²	105	138.1 Å²	138.1	64%	0.636	63%	0.633	S	S	*	*			trans	-77.1	84.6	166.8	-175.7	0	0	0	0	105.5	K252 S256	K252-V254 HydrophobicContact CB-CG2 4.07Å; K252-V254 PolarHBondContact O-N 2.88Å; V254-S256 VanDerWaalsContact CG1-O 3.28Å; V254-S256 WeakPolarHBondContact CG1-O 3.28Å; V254-S256 PolarHBondContact O-N 3.5Å; V254-S256 VanDerWaalsContact O-N 3.12Å
255	L	67.8	Low	77	Confident	164 Å²	164	144.4 Å²	144.4	86%	0.859	65%	0.651	S	S	*	*			trans	-60.8	-19	-177.7	-95	94	0	0	0	112.6	K253	K253-L255 HydrophobicContact CB-CD1 3.88Å; K253-L255 PolarHBondContact O-N 3.12Å
256	S	69.9	Low	76.7	Confident	78 Å²	78	143.1 Å²	143.1	55%	0.545	65%	0.652	S	S	.	*			trans	-130.1	117.7	177.8	62.2	0	0	0	0	111.3	V254 R258	V254-S256 VanDerWaalsContact CG1-O 3.28Å; V254-S256 WeakPolarHBondContact CG1-O 3.28Å; V254-S256 PolarHBondContact O-N 3.5Å; V254-S256 VanDerWaalsContact O-N 3.12Å; S256-R258 PolarHBondContact O-N 3.06Å; S256-R258 VanDerWaalsContact O-N 3.13Å
257	R	71.5	Confident	76.2	Confident	251 Å²	251	148.8 Å²	148.8	95%	0.947	68%	0.676	S	S	*	*			trans	-68.1	0.2	163.9	-68.2	-176.9	179.8	163.3	-1.1	112.5	R259	R257-R259 PolarHBondContact O-N 3.24Å
258	R	73.6	Confident	75.8	Confident	144 Å²	144	157.5 Å²	157.5	54%	0.543	71%	0.713	S	S	.	*			trans	-80.1	113.3	-170.2	-153.3	-173.8	-172	153.6	7	110.2	S256 K260 H262	S256-R258 PolarHBondContact O-N 3.06Å; S256-R258 VanDerWaalsContact O-N 3.13Å; R258-K260 VanDerWaalsContact C-N 3.28Å; R258-K260 WeakPolarHBondContact CD-O 3.27Å; R258-K260 WeakPolarHBondContact CG-O 3.29Å; R258-K260 PolarHBondContact NE-O 3.13Å; R258-K260 PolarHBondContact O-N 2.62Å; R258-H262 VanDerWaalsContact CZ-CA 3.42Å; R258-H262 PolarHBondContact NH1-CD2 3.13Å; R258-H262 PolarHBondContact NH2-CD2 3.38Å; R258-H262 VanDerWaalsContact NH2-CD2 3.34Å
259	R	71.1	Confident	75.8	Confident	249 Å²	249	164 Å²	164	94%	0.94	74%	0.739	S	S	*	*	S	Bend	trans	-67	-24.4	178.2	-67.5	-174.9	176.7	-175.7	-0.6	114.1	R257	R257-R259 PolarHBondContact O-N 3.24Å
260	K	75.4	Confident	76.2	Confident	152 Å²	152	166.7 Å²	166.7	66%	0.661	75%	0.747	S	S	*	*	S	Bend	trans	-130.2	143	-178.8	-65.8	-178.8	-179.3	177.6	0	110.4	R258 V264	R258-K260 VanDerWaalsContact C-N 3.28Å; R258-K260 WeakPolarHBondContact CD-O 3.27Å; R258-K260 WeakPolarHBondContact CG-O 3.29Å; R258-K260 PolarHBondContact NE-O 3.13Å; R258-K260 PolarHBondContact O-N 2.62Å; K260-V264 HydrophobicContact CB-CG2 4.06Å
261	P	77.5	Confident	76.9	Confident	88 Å²	88	167.4 Å²	167.4	57%	0.571	75%	0.752	S	S	*	*			trans	-58.7	153.5	172.5	26.1	-34	0	0	0	110.4	K263 V264	P261-K263 PolarHBondContact O-N 3.27Å; P261-K263 VanDerWaalsContact O-N 3.11Å; P261-V264 HydrophobicContact CG-CG2 3.94Å
262	H	78.9	Confident	77.9	Confident	157 Å²	157	162.3 Å²	162.3	73%	0.727	74%	0.739	S	S	*	*	S	Bend	trans	-53	-35.4	177.4	-167.2	-66	0	0	0	112.3	R258	R258-H262 VanDerWaalsContact CZ-CA 3.42Å; R258-H262 PolarHBondContact NH1-CD2 3.13Å; R258-H262 PolarHBondContact NH2-CD2 3.38Å; R258-H262 VanDerWaalsContact NH2-CD2 3.34Å
263	K	80.9	Confident	78.9	Confident	161 Å²	161	160.7 Å²	160.7	70%	0.7	73%	0.732	S	S	*	*	S	Bend	trans	-122.2	96.4	179.9	-165	168.9	-175.1	172.2	0	108.3	P261 R265	P261-K263 PolarHBondContact O-N 3.27Å; P261-K263 VanDerWaalsContact O-N 3.11Å; K263-R265 PolarHBondContact O-N 3.02Å
264	V	79.9	Confident	80	Confident	92 Å²	92	157.1 Å²	157.1	56%	0.558	73%	0.728	S	S	*	*			trans	-79.2	100.8	170.8	-176.9	0	0	0	0	107.2	K260 P261 K266	K260-V264 HydrophobicContact CB-CG2 4.06Å; P261-V264 HydrophobicContact CG-CG2 3.94Å; V264-K266 PolarHBondContact O-N 3.09Å
265	R	78	Confident	81.2	Confident	212 Å²	212	157.5 Å²	157.5	80%	0.8	73%	0.732	S	S	*	*			trans	-70.8	114.4	170.5	-63.9	-177	-177.6	-174.6	-0.8	107.6	K263 K267	K263-R265 PolarHBondContact O-N 3.02Å; R265-K267 PolarHBondContact O-N 2.86Å
266	K	83.2	Confident	82.3	Confident	197 Å²	197	155.2 Å²	155.2	86%	0.857	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-60.8	127.6	167	-67.2	-175.7	179.7	-178.2	0	107.2	V264 K268	V264-K266 PolarHBondContact O-N 3.09Å; K266-K268 PolarHBondContact O-N 3.27Å
267	K	79.1	Confident	83.4	Confident	203 Å²	203	157.1 Å²	157.1	88%	0.883	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-60.9	138	172.4	-69.5	-176.8	179	-178.8	0	107.4	R265	R265-K267 PolarHBondContact O-N 2.86Å
268	K	81.9	Confident	84.4	Confident	200 Å²	200	152 Å²	152	87%	0.87	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-60.8	144.5	169.7	-65.3	-177.6	178.8	-176.4	0	108	K266 Y270	K266-K268 PolarHBondContact O-N 3.27Å; K268-Y270 PolarHBondContact O-N 3.13Å
269	E	88.2	Confident	85.3	Confident	190 Å²	190	149.9 Å²	149.9	89%	0.888	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-57.4	136.4	173.4	-168.9	159.7	-160.7	0	0	109.4	N271	E269-N271 PolarHBondContact O-N 3.46Å; E269-N271 VanDerWaalsContact O-N 3.14Å
270	Y	90.2	Very high	86.3	Confident	197 Å²	197	140.4 Å²	140.4	77%	0.773	70%	0.702	S	S	*	*			trans	-71.4	110.2	-178.3	174.4	-104.9	0	0	0	108.6	K268 P272	K268-Y270 PolarHBondContact O-N 3.13Å; Y270-P272 HydrophobicContact CE1-CB 3.96Å
271	N	91.2	Very high	87.1	Confident	106 Å²	106	141.3 Å²	141.3	57%	0.567	71%	0.706	S	S	*	*			trans	-98.2	118.7	167.2	-173.5	-5.6	0	0	0	107.7	E269 F273	E269-N271 PolarHBondContact O-N 3.46Å; E269-N271 VanDerWaalsContact O-N 3.14Å; N271-F273 PolarHBondContact O-N 3.42Å; N271-F273 WeakPolarHBondContact OD1-CD2 3.25Å; N271-F273 PolarHBondContact OD1-N 2.88Å; N271-F273 VanDerWaalsContact OD1-N 3.09Å
272	P	92.5	Very high	87.7	Confident	82 Å²	82	141.4 Å²	141.4	53%	0.532	70%	0.701	S	S	.	*	S	Bend	trans	-65.9	-18.5	178.4	27.7	-35.3	0	0	0	112.9	Y270	Y270-P272 HydrophobicContact CE1-CB 3.96Å
273	F	91.6	Very high	88.3	Confident	158 Å²	158	137.5 Å²	137.5	69%	0.693	69%	0.686	S	S	*	*	S	Bend	trans	-88.5	129	-179.9	-59.7	-71.2	0	0	0	111.4	N271	N271-F273 PolarHBondContact O-N 3.42Å; N271-F273 WeakPolarHBondContact OD1-CD2 3.25Å; N271-F273 PolarHBondContact OD1-N 2.88Å; N271-F273 VanDerWaalsContact OD1-N 3.09Å
274	P	90.8	Very high	88.8	Confident	113 Å²	113	132.5 Å²	132.5	73%	0.734	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-67	148.9	174.9	29.3	-33.7	0	0	0	110.5
275	P	92	Very high	89.3	Confident	113 Å²	113	131.2 Å²	131.2	73%	0.734	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-64.1	153.1	171.8	29.1	-34.4	0	0	0	110.5
276	P	91.4	Very high	89.8	Confident	116 Å²	116	124.7 Å²	124.7	75%	0.753	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-60.3	145.8	176.8	26.1	-33.9	0	0	0	110.8
277	P	92.1	Very high	90.2	Very high	118 Å²	118	121.8 Å²	121.8	77%	0.766	62%	0.624	S	S	*	*	P	Polyproline II helix	trans	-63.7	150.9	175.7	28.4	-34.1	0	0	0	110.4	Q279	P277-Q279 PolarHBondContact O-N 3.41Å
278	V	93.1	Very high	90.6	Very high	145 Å²	145	119.2 Å²	119.2	88%	0.879	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-67.3	121.5	170	-178.2	0	0	0	0	107.5
279	Q	92.2	Very high	90.8	Very high	99 Å²	99	111.7 Å²	111.7	46%	0.463	59%	0.592	S	S	.	*	P	Polyproline II helix	trans	-58.4	144.1	178.8	-70.4	170.7	-28.1	0	0	111.2	P277 D283 I284 E287	P277-Q279 PolarHBondContact O-N 3.41Å; Q279-D283 HydrophobicContact CB-CB 4.04Å; Q279-I284 HydrophobicContact CB-CG1 3.93Å; Q279-E287 VanDerWaalsContact CD-OE2 3.3Å; Q279-E287 PolarHBondContact NE2-OE2 3.27Å; Q279-E287 PolarHBondContact OE1-OE2 2.79Å; Q279-E287 VanDerWaalsContact OE1-OE2 3.1Å
280	S	92.6	Very high	90.6	Very high	49 Å²	49	104.9 Å²	104.9	34%	0.343	56%	0.563	S	S	.	*	P	Polyproline II helix	trans	-70.7	162.8	176	73.2	0	0	0	0	111.1	I282 D283 I284	S280-I282 PolarHBondContact O-N 3.22Å; S280-I282 PolarHBondContact OG-N 3.17Å; S280-D283 VanDerWaalsContact CB-OD2 3.29Å; S280-D283 WeakPolarHBondContact CB-OD2 3.34Å; S280-D283 PolarHBondContact N-OD2 3.36Å; S280-D283 PolarHBondContact O-N 3.23Å; S280-D283 VanDerWaalsContact O-N 3.11Å; S280-D283 PolarHBondContact OG-N 3.11Å; S280-D283 PolarHBondContact OG-OD2 2.67Å; S280-I284 VanDerWaalsContact O-CG1 3.27Å; S280-I284 WeakPolarHBondContact O-CG1 3.34Å; S280-I284 PolarHBondContact O-N 2.76Å
281	K	92	Very high	90.3	Very high	172 Å²	172	100.6 Å²	100.6	75%	0.748	55%	0.546	S	S	*	.	H	α-helix	trans	-55.9	-37.6	173.4	-68.9	-177.2	-179.7	178.3	0	111.5	I284 E285	K281-I284 PolarHBondContact O-N 2.69Å; K281-E285 WeakPolarHBondContact O-CB 3.23Å; K281-E285 VanDerWaalsContact O-CG 3.25Å; K281-E285 WeakPolarHBondContact O-CG 3.04Å; K281-E285 PolarHBondContact O-N 3.24Å
282	I	90.1	Very high	90.1	Very high	90 Å²	90	103.3 Å²	103.3	46%	0.462	55%	0.553	S	S	.	*	H	α-helix	trans	-63.6	-48.6	177.2	-59.2	168.1	0	0	0	109.3	S280 I284 E285 L286 Y291	S280-I282 PolarHBondContact O-N 3.22Å; S280-I282 PolarHBondContact OG-N 3.17Å; I282-I284 VanDerWaalsContact C-N 3.33Å; I282-I284 PolarHBondContact O-N 3.43Å; I282-E285 CarbonylContact O-C 3.57Å; I282-E285 PolarHBondContact O-N 3.34Å; I282-E285 VanDerWaalsContact O-N 3.13Å; I282-L286 HydrophobicContact CG2-CD1 3.76Å; I282-L286 HydrophobicContact CG2-CG 4.16Å; I282-L286 WeakPolarHBondContact O-CB 3.14Å; I282-L286 VanDerWaalsContact O-CG 3.25Å; I282-L286 WeakPolarHBondContact O-CG 3.46Å; I282-L286 PolarHBondContact O-N 3.26Å; I282-Y291 HydrophobicContact CG2-CD2 4.47Å; I282-Y291 HydrophobicContact CG2-CE2 4.09Å
283	D	91.2	Very high	89.6	Confident	75 Å²	75	101.8 Å²	101.8	40%	0.401	54%	0.54	S	S	.	.	H	α-helix	trans	-61.9	-41.6	178.2	-58.2	-40.5	0	0	0	111.6	Q279 S280 E285 L286 E287	Q279-D283 HydrophobicContact CB-CB 4.04Å; S280-D283 VanDerWaalsContact CB-OD2 3.29Å; S280-D283 WeakPolarHBondContact CB-OD2 3.34Å; S280-D283 PolarHBondContact N-OD2 3.36Å; S280-D283 PolarHBondContact O-N 3.23Å; S280-D283 VanDerWaalsContact O-N 3.11Å; S280-D283 PolarHBondContact OG-N 3.11Å; S280-D283 PolarHBondContact OG-OD2 2.67Å; D283-E285 VanDerWaalsContact C-N 3.32Å; D283-E285 PolarHBondContact O-N 3.28Å; D283-L286 PolarHBondContact O-N 3.04Å; D283-E287 VanDerWaalsContact O-CB 3.23Å; D283-E287 WeakPolarHBondContact O-CB 3.09Å; D283-E287 PolarHBondContact O-N 3.44Å
284	I	92.6	Very high	89.1	Confident	55 Å²	55	97.1 Å²	97.1	28%	0.282	53%	0.531	S	S	.	.	H	α-helix	trans	-63.1	-40.7	175.7	-65.4	164	0	0	0	110.4	Q279 S280 K281 I282 K288	Q279-I284 HydrophobicContact CB-CG1 3.93Å; S280-I284 VanDerWaalsContact O-CG1 3.27Å; S280-I284 WeakPolarHBondContact O-CG1 3.34Å; S280-I284 PolarHBondContact O-N 2.76Å; K281-I284 PolarHBondContact O-N 2.69Å; I282-I284 VanDerWaalsContact C-N 3.33Å; I282-I284 PolarHBondContact O-N 3.43Å; I284-K288 HydrophobicContact CG2-CD 3.91Å; I284-K288 VanDerWaalsContact O-CB 3.27Å; I284-K288 WeakPolarHBondContact O-CB 3.25Å; I284-K288 WeakPolarHBondContact O-CG 3.2Å; I284-K288 PolarHBondContact O-N 3.35Å
285	E	88.9	Confident	88.7	Confident	65 Å²	65	98.1 Å²	98.1	30%	0.304	53%	0.526	S	S	.	.	H	α-helix	trans	-72.2	-35.2	178.6	-76.1	179.8	-155.4	0	0	112.6	K281 I282 D283 G289 T290 Y291 R298	K281-E285 WeakPolarHBondContact O-CB 3.23Å; K281-E285 VanDerWaalsContact O-CG 3.25Å; K281-E285 WeakPolarHBondContact O-CG 3.04Å; K281-E285 PolarHBondContact O-N 3.24Å; I282-E285 CarbonylContact O-C 3.57Å; I282-E285 PolarHBondContact O-N 3.34Å; I282-E285 VanDerWaalsContact O-N 3.13Å; D283-E285 VanDerWaalsContact C-N 3.32Å; D283-E285 PolarHBondContact O-N 3.28Å; E285-G289 CarbonylContact O-C 3.59Å; E285-G289 PolarHBondContact O-N 3.11Å; E285-G289 VanDerWaalsContact O-N 3.16Å; E285-T290 PolarHBondContact O-N 3.48Å; E285-T290 PolarHBondContact O-OG1 2.78Å; E285-Y291 HydrophobicContact CB-CD2 4.04Å; E285-Y291 PolarHBondContact O-N 3.36Å; E285-R298 IonicContact OE2-NH2 3.31Å
286	L	89.9	Confident	88.2	Confident	76 Å²	76	96 Å²	96	40%	0.398	52%	0.519	S	S	.	.	H	α-helix	trans	-67.6	-45.9	173.4	-74.4	171.5	0	0	0	110.3	I282 D283 G289 Y291 F292	I282-L286 HydrophobicContact CG2-CD1 3.76Å; I282-L286 HydrophobicContact CG2-CG 4.16Å; I282-L286 WeakPolarHBondContact O-CB 3.14Å; I282-L286 VanDerWaalsContact O-CG 3.25Å; I282-L286 WeakPolarHBondContact O-CG 3.46Å; I282-L286 PolarHBondContact O-N 3.26Å; D283-L286 PolarHBondContact O-N 3.04Å; L286-G289 PolarHBondContact O-N 3.36Å; L286-G289 VanDerWaalsContact O-N 3.12Å; L286-Y291 HydrophobicContact CD2-CD1 3.7Å; L286-Y291 HydrophobicContact CD2-CE1 4.38Å; L286-Y291 HydrophobicContact CD2-CG 3.89Å; L286-Y291 HydrophobicContact CG-CD1 4.49Å; L286-Y291 HydrophobicContact CG-CG 4.28Å; L286-F292 HydrophobicContact CD2-CE2 3.67Å; L286-F292 HydrophobicContact CD2-CZ 3.79Å
287	E	89.9	Confident	87.8	Confident	136 Å²	136	95.3 Å²	95.3	64%	0.636	51%	0.505	S	S	*	.	H	α-helix	trans	-64.3	-39.5	176.6	-174.4	176.7	-179	0	0	111.8	Q279 D283 G289	Q279-E287 VanDerWaalsContact CD-OE2 3.3Å; Q279-E287 PolarHBondContact NE2-OE2 3.27Å; Q279-E287 PolarHBondContact OE1-OE2 2.79Å; Q279-E287 VanDerWaalsContact OE1-OE2 3.1Å; D283-E287 VanDerWaalsContact O-CB 3.23Å; D283-E287 WeakPolarHBondContact O-CB 3.09Å; D283-E287 PolarHBondContact O-N 3.44Å; E287-G289 PolarHBondContact O-N 3.49Å
288	K	88.3	Confident	87.4	Confident	149 Å²	149	94.4 Å²	94.4	65%	0.648	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-8.2	174.7	-72.3	174.5	-177.8	172.9	0	113.8	I284 T290	I284-K288 HydrophobicContact CG2-CD 3.91Å; I284-K288 VanDerWaalsContact O-CB 3.27Å; I284-K288 WeakPolarHBondContact O-CB 3.25Å; I284-K288 WeakPolarHBondContact O-CG 3.2Å; I284-K288 PolarHBondContact O-N 3.35Å; K288-T290 HydrophobicContact CB-CG2 4.11Å; K288-T290 PolarHBondContact O-N 3.14Å; K288-T290 VanDerWaalsContact O-N 3.09Å
289	G	85.2	Confident	87	Confident	41 Å²	41	93.2 Å²	93.2	42%	0.423	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.9	3.1	-173.3	0	0	0	0	0	114.4	E285 L286 E287 Y291	E285-G289 CarbonylContact O-C 3.59Å; E285-G289 PolarHBondContact O-N 3.11Å; E285-G289 VanDerWaalsContact O-N 3.16Å; L286-G289 PolarHBondContact O-N 3.36Å; L286-G289 VanDerWaalsContact O-N 3.12Å; E287-G289 PolarHBondContact O-N 3.49Å; G289-Y291 VanDerWaalsContact C-N 3.28Å; G289-Y291 PolarHBondContact O-N 3.41Å
290	T	84.3	Confident	86.8	Confident	47 Å²	47	98 Å²	98	29%	0.288	48%	0.484	S	S	.	.			trans	-72.9	-24.2	-179.2	50.5	0	0	0	0	112.5	E285 K288 F292 L293 R298	E285-T290 PolarHBondContact O-N 3.48Å; E285-T290 PolarHBondContact O-OG1 2.78Å; K288-T290 HydrophobicContact CB-CG2 4.11Å; K288-T290 PolarHBondContact O-N 3.14Å; K288-T290 VanDerWaalsContact O-N 3.09Å; T290-F292 VanDerWaalsContact C-N 3.28Å; T290-F292 PolarHBondContact O-N 3.1Å; T290-L293 PolarHBondContact O-N 2.96Å; T290-R298 VanDerWaalsContact O-CZ 3.24Å; T290-R298 PolarHBondContact O-NE 2.99Å; T290-R298 VanDerWaalsContact O-NE 3.17Å; T290-R298 PolarHBondContact O-NH2 3.38Å
291	Y	84.9	Confident	86.6	Confident	107 Å²	107	100 Å²	100	42%	0.42	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-44	-173.3	-170.8	-104.4	0	0	0	112.6	I282 E285 L286 G289 R298	I282-Y291 HydrophobicContact CG2-CD2 4.47Å; I282-Y291 HydrophobicContact CG2-CE2 4.09Å; E285-Y291 HydrophobicContact CB-CD2 4.04Å; E285-Y291 PolarHBondContact O-N 3.36Å; L286-Y291 HydrophobicContact CD2-CD1 3.7Å; L286-Y291 HydrophobicContact CD2-CE1 4.38Å; L286-Y291 HydrophobicContact CD2-CG 3.89Å; L286-Y291 HydrophobicContact CG-CD1 4.49Å; L286-Y291 HydrophobicContact CG-CG 4.28Å; G289-Y291 VanDerWaalsContact C-N 3.28Å; G289-Y291 PolarHBondContact O-N 3.41Å; Y291-R298 PolarHBondContact O-NH2 3.12Å
292	F	85.7	Confident	86.5	Confident	163 Å²	163	98.4 Å²	98.4	72%	0.715	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-10.2	-175.1	-59.3	-74.3	0	0	0	114.9	L286 T290 A294	L286-F292 HydrophobicContact CD2-CE2 3.67Å; L286-F292 HydrophobicContact CD2-CZ 3.79Å; T290-F292 VanDerWaalsContact C-N 3.28Å; T290-F292 PolarHBondContact O-N 3.1Å; F292-A294 PolarHBondContact O-N 3.02Å
293	L	82.8	Confident	86.6	Confident	50 Å²	50	98.3 Å²	98.3	26%	0.262	49%	0.486	S	S	.	.	S	Bend	trans	-69.4	128.7	-179.8	-65.6	175.8	0	0	0	111	T290 E297 R298 L301	T290-L293 PolarHBondContact O-N 2.96Å; L293-E297 HydrophobicContact CD2-CG 4.28Å; L293-E297 WeakPolarHBondContact CD2-OE2 3.27Å; L293-R298 HydrophobicContact CB-CG 3.78Å; L293-R298 HydrophobicContact CD1-CG 4.49Å; L293-R298 PolarHBondContact O-NE 3.16Å; L293-L301 HydrophobicContact CD1-CD1 4.07Å
294	A	81.7	Confident	86.6	Confident	61 Å²	61	100.7 Å²	100.7	50%	0.504	50%	0.495	S	S	.	.			trans	-60.1	149.7	173.5	0	0	0	0	0	110.9	F292 A296 E297 R298	F292-A294 PolarHBondContact O-N 3.02Å; A294-A296 PolarHBondContact O-N 3.1Å; A294-A296 VanDerWaalsContact O-N 3.13Å; A294-E297 WeakPolarHBondContact O-CB 3.44Å; A294-E297 PolarHBondContact O-N 3.22Å; A294-R298 PolarHBondContact O-N 3.26Å
295	E	81.2	Confident	86.5	Confident	133 Å²	133	100.1 Å²	100.1	62%	0.621	50%	0.496	S	S	*	.	H	α-helix	trans	-58.1	-34.2	-175.3	-162.4	-169.3	157.6	0	0	112.6	K299	E295-K299 WeakPolarHBondContact O-CG 3.48Å; E295-K299 PolarHBondContact O-N 3.06Å; E295-K299 WeakPolarHBondContact OE1-CE 3.4Å; E295-K299 IonicContact OE1-NZ 3.53Å; E295-K299 PolarHBondContact OE1-NZ 3.03Å
296	A	81.9	Confident	86.7	Confident	70 Å²	70	101 Å²	101	58%	0.579	50%	0.502	S	S	*	.	H	α-helix	trans	-63.1	-41	175.8	0	0	0	0	0	112.4	A294 K299 R300	A294-A296 PolarHBondContact O-N 3.1Å; A294-A296 VanDerWaalsContact O-N 3.13Å; A296-K299 PolarHBondContact O-N 2.97Å; A296-R300 WeakPolarHBondContact O-CG 3.36Å; A296-R300 PolarHBondContact O-N 3.18Å
297	E	83.9	Confident	86.8	Confident	101 Å²	101	102 Å²	102	47%	0.472	51%	0.507	S	S	.	.	H	α-helix	trans	-71.2	-42.1	179.9	-165.3	168	-159.6	0	0	111	L293 A294 K299 R300 L301	L293-E297 HydrophobicContact CD2-CG 4.28Å; L293-E297 WeakPolarHBondContact CD2-OE2 3.27Å; A294-E297 WeakPolarHBondContact O-CB 3.44Å; A294-E297 PolarHBondContact O-N 3.22Å; E297-K299 VanDerWaalsContact C-N 3.3Å; E297-K299 PolarHBondContact O-N 3.01Å; E297-R300 PolarHBondContact O-N 3.16Å; E297-L301 HydrophobicContact CG-CD1 4.49Å; E297-L301 WeakPolarHBondContact O-CG 3.41Å; E297-L301 PolarHBondContact O-N 3.36Å
298	R	82.2	Confident	87	Confident	98 Å²	98	98.8 Å²	98.8	37%	0.37	50%	0.497	S	S	.	.	H	α-helix	trans	-57	-42.7	171.9	-66.7	-175.3	-176.6	-169.9	1.6	111.9	E285 T290 Y291 L293 A294 K302	E285-R298 IonicContact OE2-NH2 3.31Å; T290-R298 VanDerWaalsContact O-CZ 3.24Å; T290-R298 PolarHBondContact O-NE 2.99Å; T290-R298 VanDerWaalsContact O-NE 3.17Å; T290-R298 PolarHBondContact O-NH2 3.38Å; Y291-R298 PolarHBondContact O-NH2 3.12Å; L293-R298 HydrophobicContact CB-CG 3.78Å; L293-R298 HydrophobicContact CD1-CG 4.49Å; L293-R298 PolarHBondContact O-NE 3.16Å; A294-R298 PolarHBondContact O-N 3.26Å; R298-K302 WeakPolarHBondContact O-CB 3.47Å; R298-K302 PolarHBondContact O-N 3.09Å; R298-K302 VanDerWaalsContact O-N 3.1Å
299	K	86	Confident	87.2	Confident	120 Å²	120	97.5 Å²	97.5	52%	0.522	49%	0.491	S	S	.	.	H	α-helix	trans	-66.5	-43.1	177.7	-76.2	174.5	-176.1	167.1	0	112	E295 A296 E297 K302 V303	E295-K299 WeakPolarHBondContact O-CG 3.48Å; E295-K299 PolarHBondContact O-N 3.06Å; E295-K299 WeakPolarHBondContact OE1-CE 3.4Å; E295-K299 IonicContact OE1-NZ 3.53Å; E295-K299 PolarHBondContact OE1-NZ 3.03Å; A296-K299 PolarHBondContact O-N 2.97Å; E297-K299 VanDerWaalsContact C-N 3.3Å; E297-K299 PolarHBondContact O-N 3.01Å; K299-K302 PolarHBondContact O-N 3.13Å; K299-V303 WeakPolarHBondContact O-CG2 3.45Å; K299-V303 PolarHBondContact O-N 3.23Å
300	R	88.3	Confident	87.4	Confident	201 Å²	201	99 Å²	99	76%	0.758	50%	0.496	S	S	*	.	H	α-helix	trans	-58.5	-51.2	176.4	-81.1	-177.3	143	-156.6	-5.8	111.9	A296 E297 K302 V303 E304	A296-R300 WeakPolarHBondContact O-CG 3.36Å; A296-R300 PolarHBondContact O-N 3.18Å; E297-R300 PolarHBondContact O-N 3.16Å; R300-K302 VanDerWaalsContact C-N 3.27Å; R300-K302 PolarHBondContact O-N 3.32Å; R300-V303 PolarHBondContact O-N 3.01Å; R300-V303 VanDerWaalsContact O-N 3.16Å; R300-E304 PolarHBondContact O-N 3.43Å
301	L	87.4	Confident	87.9	Confident	89 Å²	89	101.1 Å²	101.1	47%	0.466	51%	0.505	S	S	.	.	H	α-helix	trans	-59.3	-38.5	177.8	-71	168.5	0	0	0	112	L293 E297 S305	L293-L301 HydrophobicContact CD1-CD1 4.07Å; E297-L301 HydrophobicContact CG-CD1 4.49Å; E297-L301 WeakPolarHBondContact O-CG 3.41Å; E297-L301 PolarHBondContact O-N 3.36Å; L301-S305 WeakPolarHBondContact O-CB 3.49Å; L301-S305 PolarHBondContact O-N 3.29Å
302	K	89.8	Confident	88.2	Confident	140 Å²	140	102.3 Å²	102.3	61%	0.609	51%	0.514	S	S	*	.	H	α-helix	trans	-64.2	-44.5	176.5	-172.8	176.8	-178.9	179.1	0	112.1	R298 K299 R300 S305 N306	R298-K302 WeakPolarHBondContact O-CB 3.47Å; R298-K302 PolarHBondContact O-N 3.09Å; R298-K302 VanDerWaalsContact O-N 3.1Å; K299-K302 PolarHBondContact O-N 3.13Å; R300-K302 VanDerWaalsContact C-N 3.27Å; R300-K302 PolarHBondContact O-N 3.32Å; K302-S305 PolarHBondContact O-N 2.98Å; K302-S305 PolarHBondContact O-OG 3.09Å; K302-N306 PolarHBondContact O-N 3.04Å
303	V	91.6	Very high	88.5	Confident	87 Å²	87	99.8 Å²	99.8	53%	0.527	51%	0.507	S	S	.	.	H	α-helix	trans	-63.1	-46	178.7	172.1	0	0	0	0	110.7	K299 R300 S305 N306 I307	K299-V303 WeakPolarHBondContact O-CG2 3.45Å; K299-V303 PolarHBondContact O-N 3.23Å; R300-V303 PolarHBondContact O-N 3.01Å; R300-V303 VanDerWaalsContact O-N 3.16Å; V303-S305 VanDerWaalsContact C-N 3.31Å; V303-S305 PolarHBondContact O-N 3.44Å; V303-N306 PolarHBondContact O-N 2.73Å; V303-N306 VanDerWaalsContact O-N 3.09Å; V303-I307 HydrophobicContact CG1-CD1 3.79Å; V303-I307 HydrophobicContact CG1-CG1 4.42Å; V303-I307 WeakPolarHBondContact O-CG1 3.41Å; V303-I307 PolarHBondContact O-N 2.98Å
304	E	91.7	Very high	88.8	Confident	125 Å²	125	100 Å²	100	58%	0.584	51%	0.513	S	S	*	.	H	α-helix	trans	-60	-41.4	177.3	-169.6	170.7	-169.7	0	0	111.9	R300 N306 I307 T308	R300-E304 PolarHBondContact O-N 3.43Å; E304-N306 VanDerWaalsContact C-N 3.32Å; E304-N306 PolarHBondContact O-N 2.92Å; E304-I307 PolarHBondContact O-N 3.04Å; E304-T308 WeakPolarHBondContact O-CG2 3.38Å; E304-T308 PolarHBondContact O-N 2.99Å; E304-T308 VanDerWaalsContact O-N 3.09Å; E304-T308 PolarHBondContact O-OG1 2.92Å
305	S	91.4	Very high	89.3	Confident	44 Å²	44	104.4 Å²	104.4	31%	0.308	52%	0.521	S	S	.	.	H	α-helix	trans	-64.8	-32.1	175	81.1	0	0	0	0	113.6	L301 K302 V303 T308 K309	L301-S305 WeakPolarHBondContact O-CB 3.49Å; L301-S305 PolarHBondContact O-N 3.29Å; K302-S305 PolarHBondContact O-N 2.98Å; K302-S305 PolarHBondContact O-OG 3.09Å; V303-S305 VanDerWaalsContact C-N 3.31Å; V303-S305 PolarHBondContact O-N 3.44Å; S305-T308 WeakPolarHBondContact CA-OG1 3.28Å; S305-T308 PolarHBondContact O-OG1 3.44Å; S305-K309 WeakPolarHBondContact O-CB 3.39Å; S305-K309 VanDerWaalsContact O-CG 3.28Å; S305-K309 WeakPolarHBondContact O-CG 3.37Å; S305-K309 PolarHBondContact O-N 3.4Å
306	N	92.3	Very high	89.7	Confident	83 Å²	83	104.8 Å²	104.8	44%	0.444	52%	0.522	S	S	.	.	H	α-helix	trans	-77.1	-39.4	178.8	-74.6	-14.9	0	0	0	111.6	K302 V303 E304 K309 S310	K302-N306 PolarHBondContact O-N 3.04Å; V303-N306 PolarHBondContact O-N 2.73Å; V303-N306 VanDerWaalsContact O-N 3.09Å; E304-N306 VanDerWaalsContact C-N 3.32Å; E304-N306 PolarHBondContact O-N 2.92Å; N306-K309 PolarHBondContact O-N 3.21Å; N306-S310 WeakPolarHBondContact O-CB 3.37Å; N306-S310 PolarHBondContact O-N 3.09Å
307	I	92.8	Very high	90.1	Very high	96 Å²	96	109.4 Å²	109.4	49%	0.492	53%	0.525	S	S	.	.	H	α-helix	trans	-62	-46.6	176.2	-67.7	166.9	0	0	0	110	V303 E304 K309 S310 N311	V303-I307 HydrophobicContact CG1-CD1 3.79Å; V303-I307 HydrophobicContact CG1-CG1 4.42Å; V303-I307 WeakPolarHBondContact O-CG1 3.41Å; V303-I307 PolarHBondContact O-N 2.98Å; E304-I307 PolarHBondContact O-N 3.04Å; I307-K309 PolarHBondContact O-N 2.97Å; I307-S310 PolarHBondContact O-N 2.98Å; I307-N311 WeakPolarHBondContact O-CB 3.38Å; I307-N311 VanDerWaalsContact O-CG 3.27Å; I307-N311 PolarHBondContact O-N 3.36Å; I307-N311 PolarHBondContact O-ND2 3.39Å
308	T	92.9	Very high	90.3	Very high	70 Å²	70	109.6 Å²	109.6	43%	0.429	53%	0.526	S	S	.	.	H	α-helix	trans	-61.8	-44.5	178.4	49.5	0	0	0	0	112.1	E304 S305 N311 Q312	E304-T308 WeakPolarHBondContact O-CG2 3.38Å; E304-T308 PolarHBondContact O-N 2.99Å; E304-T308 VanDerWaalsContact O-N 3.09Å; E304-T308 PolarHBondContact O-OG1 2.92Å; S305-T308 WeakPolarHBondContact CA-OG1 3.28Å; S305-T308 PolarHBondContact O-OG1 3.44Å; T308-N311 PolarHBondContact O-N 3.5Å; T308-Q312 WeakPolarHBondContact O-CG 3.49Å; T308-Q312 PolarHBondContact O-N 3.17Å; T308-Q312 VanDerWaalsContact O-N 3.09Å
309	K	92.8	Very high	90.6	Very high	121 Å²	121	112.7 Å²	112.7	53%	0.526	54%	0.542	S	S	.	.	H	α-helix	trans	-61.8	-45.6	174.6	-76.3	176.2	-177.9	179	0	113	S305 N306 I307 N311 Q312 I313	S305-K309 WeakPolarHBondContact O-CB 3.39Å; S305-K309 VanDerWaalsContact O-CG 3.28Å; S305-K309 WeakPolarHBondContact O-CG 3.37Å; S305-K309 PolarHBondContact O-N 3.4Å; N306-K309 PolarHBondContact O-N 3.21Å; I307-K309 PolarHBondContact O-N 2.97Å; K309-N311 VanDerWaalsContact C-N 3.32Å; K309-N311 PolarHBondContact O-N 3.16Å; K309-Q312 WeakPolarHBondContact O-CB 3.45Å; K309-Q312 PolarHBondContact O-N 3.43Å; K309-Q312 VanDerWaalsContact O-N 3.16Å; K309-I313 WeakPolarHBondContact O-CG1 3.31Å; K309-I313 PolarHBondContact O-N 3.4Å
310	S	90.6	Very high	90.7	Very high	73 Å²	73	109.6 Å²	109.6	51%	0.51	54%	0.539	S	S	.	.	H	α-helix	trans	-59.9	-43.7	178	-176.9	0	0	0	0	111.6	N306 I307 Q312 I313 S314	N306-S310 WeakPolarHBondContact O-CB 3.37Å; N306-S310 PolarHBondContact O-N 3.09Å; I307-S310 PolarHBondContact O-N 2.98Å; S310-Q312 VanDerWaalsContact C-N 3.3Å; S310-Q312 PolarHBondContact O-N 3.38Å; S310-I313 PolarHBondContact O-N 3.39Å; S310-S314 WeakPolarHBondContact O-CB 3.43Å; S310-S314 PolarHBondContact O-N 3.41Å
311	N	93.5	Very high	90.6	Very high	91 Å²	91	106.6 Å²	106.6	49%	0.487	53%	0.531	S	S	.	.	H	α-helix	trans	-62	-37.2	176.4	-73.5	-19.4	0	0	0	112.3	I307 T308 K309 K315	I307-N311 WeakPolarHBondContact O-CB 3.38Å; I307-N311 VanDerWaalsContact O-CG 3.27Å; I307-N311 PolarHBondContact O-N 3.36Å; I307-N311 PolarHBondContact O-ND2 3.39Å; T308-N311 PolarHBondContact O-N 3.5Å; K309-N311 VanDerWaalsContact C-N 3.32Å; K309-N311 PolarHBondContact O-N 3.16Å; N311-K315 VanDerWaalsContact O-CG 3.32Å; N311-K315 WeakPolarHBondContact O-CG 3.45Å; N311-K315 PolarHBondContact O-N 3.15Å; N311-K315 VanDerWaalsContact O-N 3.15Å
312	Q	91.7	Very high	90.6	Very high	132 Å²	132	111.6 Å²	111.6	62%	0.617	54%	0.544	S	S	*	.	H	α-helix	trans	-67.2	-49.6	175.2	-73.8	177.6	-10.7	0	0	112.1	T308 K309 S310 S314 K315 E316	T308-Q312 WeakPolarHBondContact O-CG 3.49Å; T308-Q312 PolarHBondContact O-N 3.17Å; T308-Q312 VanDerWaalsContact O-N 3.09Å; K309-Q312 WeakPolarHBondContact O-CB 3.45Å; K309-Q312 PolarHBondContact O-N 3.43Å; K309-Q312 VanDerWaalsContact O-N 3.16Å; S310-Q312 VanDerWaalsContact C-N 3.3Å; S310-Q312 PolarHBondContact O-N 3.38Å; Q312-S314 VanDerWaalsContact C-N 3.29Å; Q312-S314 PolarHBondContact O-N 2.92Å; Q312-K315 WeakPolarHBondContact O-CB 3.32Å; Q312-K315 PolarHBondContact O-N 3.36Å; Q312-K315 VanDerWaalsContact O-N 3.15Å; Q312-E316 PolarHBondContact O-N 3.09Å
313	I	91.6	Very high	90.4	Very high	110 Å²	110	108.1 Å²	108.1	56%	0.564	54%	0.537	S	S	*	.	H	α-helix	trans	-60.7	-41	179.3	-65.8	167.3	0	0	0	110.7	K309 S310 E316 R317	K309-I313 WeakPolarHBondContact O-CG1 3.31Å; K309-I313 PolarHBondContact O-N 3.4Å; S310-I313 PolarHBondContact O-N 3.39Å; I313-E316 PolarHBondContact O-N 2.86Å; I313-R317 WeakPolarHBondContact O-CB 3.32Å; I313-R317 PolarHBondContact O-N 3.32Å
314	S	90.2	Very high	89.9	Confident	55 Å²	55	107 Å²	107	39%	0.385	54%	0.537	S	S	.	.	H	α-helix	trans	-60.9	-45.6	176.4	-174.7	0	0	0	0	111.6	S310 Q312 E316 R317 Q318	S310-S314 WeakPolarHBondContact O-CB 3.43Å; S310-S314 PolarHBondContact O-N 3.41Å; Q312-S314 VanDerWaalsContact C-N 3.29Å; Q312-S314 PolarHBondContact O-N 2.92Å; S314-E316 PolarHBondContact O-N 3.46Å; S314-R317 PolarHBondContact O-N 3.35Å; S314-Q318 WeakPolarHBondContact O-CB 3.35Å; S314-Q318 VanDerWaalsContact O-CG 3.31Å; S314-Q318 WeakPolarHBondContact O-CG 3.46Å; S314-Q318 PolarHBondContact O-N 3.15Å
315	K	92.1	Very high	89.4	Confident	154 Å²	154	105.4 Å²	105.4	67%	0.67	55%	0.545	S	S	*	.	H	α-helix	trans	-60.3	-43.7	175.5	-76.5	175.9	-179.9	-177.9	0	112	N311 Q312 Q318 K319	N311-K315 VanDerWaalsContact O-CG 3.32Å; N311-K315 WeakPolarHBondContact O-CG 3.45Å; N311-K315 PolarHBondContact O-N 3.15Å; N311-K315 VanDerWaalsContact O-N 3.15Å; Q312-K315 WeakPolarHBondContact O-CB 3.32Å; Q312-K315 PolarHBondContact O-N 3.36Å; Q312-K315 VanDerWaalsContact O-N 3.15Å; K315-Q318 PolarHBondContact O-N 2.96Å; K315-K319 WeakPolarHBondContact O-CB 3.4Å; K315-K319 PolarHBondContact O-N 3.48Å
316	E	90.3	Very high	88.8	Confident	140 Å²	140	110.5 Å²	110.5	65%	0.654	57%	0.568	S	S	*	*	H	α-helix	trans	-67	-43.9	179.5	-168.9	171.9	-165.1	0	0	111.9	Q312 I313 S314 Q318 K319 A320	Q312-E316 PolarHBondContact O-N 3.09Å; I313-E316 PolarHBondContact O-N 2.86Å; S314-E316 PolarHBondContact O-N 3.46Å; E316-Q318 VanDerWaalsContact C-N 3.34Å; E316-Q318 PolarHBondContact O-N 2.91Å; E316-K319 WeakPolarHBondContact O-CB 3.5Å; E316-K319 PolarHBondContact O-N 2.9Å; E316-K319 VanDerWaalsContact O-N 3.13Å; E316-A320 PolarHBondContact O-N 3.01Å
317	R	89.5	Confident	88.1	Confident	168 Å²	168	112.5 Å²	112.5	63%	0.634	58%	0.578	S	S	*	*	H	α-helix	trans	-63.2	-39.9	176.4	-166.9	178.1	-167.2	-171.8	5.1	112	I313 S314 K319 A320 K321	I313-R317 WeakPolarHBondContact O-CB 3.32Å; I313-R317 PolarHBondContact O-N 3.32Å; S314-R317 PolarHBondContact O-N 3.35Å; R317-K319 VanDerWaalsContact C-N 3.34Å; R317-A320 PolarHBondContact O-N 2.96Å; R317-K321 WeakPolarHBondContact O-CB 3.45Å; R317-K321 WeakPolarHBondContact O-CG 3.47Å; R317-K321 PolarHBondContact O-N 2.87Å
318	Q	88.3	Confident	87.3	Confident	104 Å²	104	113.1 Å²	113.1	49%	0.486	59%	0.588	S	S	.	*	H	α-helix	trans	-63	-42.2	173.6	-76	-179.3	9.5	0	0	111.2	S314 K315 E316 R322	S314-Q318 WeakPolarHBondContact O-CB 3.35Å; S314-Q318 VanDerWaalsContact O-CG 3.31Å; S314-Q318 WeakPolarHBondContact O-CG 3.46Å; S314-Q318 PolarHBondContact O-N 3.15Å; K315-Q318 PolarHBondContact O-N 2.96Å; E316-Q318 VanDerWaalsContact C-N 3.34Å; E316-Q318 PolarHBondContact O-N 2.91Å; Q318-R322 VanDerWaalsContact O-CG 3.31Å; Q318-R322 WeakPolarHBondContact O-CG 3.42Å; Q318-R322 PolarHBondContact O-N 3.35Å; Q318-R322 VanDerWaalsContact O-N 3.1Å
319	K	89	Confident	86.5	Confident	164 Å²	164	115.9 Å²	115.9	71%	0.713	61%	0.607	S	S	*	*	H	α-helix	trans	-63.4	-44.3	177.1	-161.8	178.5	-178.4	-176.5	0	111.9	K315 E316 R317 R322 S323	K315-K319 WeakPolarHBondContact O-CB 3.4Å; K315-K319 PolarHBondContact O-N 3.48Å; E316-K319 WeakPolarHBondContact O-CB 3.5Å; E316-K319 PolarHBondContact O-N 2.9Å; E316-K319 VanDerWaalsContact O-N 3.13Å; R317-K319 VanDerWaalsContact C-N 3.34Å; K319-R322 PolarHBondContact O-N 3.43Å; K319-S323 PolarHBondContact O-N 3.46Å; K319-S323 PolarHBondContact O-OG 3.29Å
320	A	87.6	Confident	85.6	Confident	54 Å²	54	117.9 Å²	117.9	45%	0.446	62%	0.624	S	S	.	*	H	α-helix	trans	-66.1	-41.1	178.9	0	0	0	0	0	113.1	E316 R317 R322 S323 A324	E316-A320 PolarHBondContact O-N 3.01Å; R317-A320 PolarHBondContact O-N 2.96Å; A320-R322 VanDerWaalsContact C-N 3.32Å; A320-R322 PolarHBondContact O-N 2.99Å; A320-S323 WeakPolarHBondContact CA-OG 3.42Å; A320-S323 PolarHBondContact O-N 3.13Å; A320-S323 PolarHBondContact O-OG 3.1Å; A320-A324 WeakPolarHBondContact O-CB 3.31Å; A320-A324 PolarHBondContact O-N 3.49Å
321	K	86.4	Confident	84.2	Confident	138 Å²	138	123.3 Å²	123.3	60%	0.6	64%	0.641	S	S	*	*	H	α-helix	trans	-61.8	-41.7	174	-76.8	-176.4	177.1	-171	0	111.6	R317 A324 A325	R317-K321 WeakPolarHBondContact O-CB 3.45Å; R317-K321 WeakPolarHBondContact O-CG 3.47Å; R317-K321 PolarHBondContact O-N 2.87Å; K321-A324 PolarHBondContact O-N 3.21Å; K321-A325 PolarHBondContact O-N 3.21Å
322	R	86.5	Confident	82.1	Confident	194 Å²	194	124.5 Å²	124.5	73%	0.732	66%	0.656	S	S	*	*	H	α-helix	trans	-63.1	-41.9	176.7	-74.9	176.9	178.7	-175.6	0.7	112	Q318 K319 A320	Q318-R322 VanDerWaalsContact O-CG 3.31Å; Q318-R322 WeakPolarHBondContact O-CG 3.42Å; Q318-R322 PolarHBondContact O-N 3.35Å; Q318-R322 VanDerWaalsContact O-N 3.1Å; K319-R322 PolarHBondContact O-N 3.43Å; A320-R322 VanDerWaalsContact C-N 3.32Å; A320-R322 PolarHBondContact O-N 2.99Å
323	S	85.7	Confident	80	Confident	67 Å²	67	126.5 Å²	126.5	47%	0.469	67%	0.671	S	S	.	*	H	α-helix	trans	-70.8	-36.1	177.8	55.4	0	0	0	0	113.2	K319 A320 A325 L326	K319-S323 PolarHBondContact O-N 3.46Å; K319-S323 PolarHBondContact O-OG 3.29Å; A320-S323 WeakPolarHBondContact CA-OG 3.42Å; A320-S323 PolarHBondContact O-N 3.13Å; A320-S323 PolarHBondContact O-OG 3.1Å; S323-A325 PolarHBondContact O-N 3.34Å; S323-L326 PolarHBondContact O-N 3.49Å
324	A	82.3	Confident	77.5	Confident	63 Å²	63	128.2 Å²	128.2	52%	0.521	68%	0.682	S	S	.	*	H	α-helix	trans	-66.6	-36.2	-179.5	0	0	0	0	0	112.9	A320 K321 L326 I327	A320-A324 WeakPolarHBondContact O-CB 3.31Å; A320-A324 PolarHBondContact O-N 3.49Å; K321-A324 PolarHBondContact O-N 3.21Å; A324-L326 PolarHBondContact O-N 3.45Å; A324-I327 PolarHBondContact O-N 3.02Å
325	A	79.6	Confident	75.3	Confident	92 Å²	92	132.9 Å²	132.9	76%	0.76	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.9	-16.6	176.4	0	0	0	0	0	113.5	K321 S323	K321-A325 PolarHBondContact O-N 3.21Å; S323-A325 PolarHBondContact O-N 3.34Å
326	L	78.9	Confident	73.2	Confident	152 Å²	152	132.6 Å²	132.6	80%	0.796	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.1	-6.2	-177.5	-143.2	74.2	0	0	0	113.4	S323 A324	S323-L326 PolarHBondContact O-N 3.49Å; A324-L326 PolarHBondContact O-N 3.45Å
327	I	77.6	Confident	70.9	Confident	125 Å²	125	131.6 Å²	131.6	64%	0.641	71%	0.711	S	S	*	*	S	Bend	trans	-102.1	115.3	-179.8	-56.7	167.8	0	0	0	108	A324	A324-I327 PolarHBondContact O-N 3.02Å
328	P	76.5	Confident	68.8	Low	109 Å²	109	130.7 Å²	130.7	71%	0.708	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-64.3	142.7	178.1	24.2	-31.2	0	0	0	111.2
329	P	75.1	Confident	66.5	Low	127 Å²	127	133.7 Å²	133.7	83%	0.825	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-64.5	140.1	179	25.3	-31.6	0	0	0	111.2
330	N	75.2	Confident	64.4	Low	164 Å²	164	134.4 Å²	134.4	88%	0.877	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-86.2	116.5	-176.8	-157	10.9	0	0	0	110.5
331	E	60.2	Low	62.3	Low	187 Å²	187	141.7 Å²	141.7	87%	0.874	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-81.3	124.9	175.3	-67.8	-175.5	168.9	0	0	110.3
332	S	49.4	Very low	60.6	Low	116 Å²	116	140.8 Å²	140.8	81%	0.811	77%	0.768	S	S	*	*			trans	-104.4	114.4	177.3	55.3	0	0	0	0	110.6	N334	S332-N334 PolarHBondContact O-N 3.31Å
333	N	48	Very low	58.7	Low	173 Å²	173	141.1 Å²	141.1	93%	0.925	77%	0.774	S	S	*	*			trans	-69.3	119	173.1	-105.9	-19.7	0	0	0	110.1	N335	N333-N335 PolarHBondContact O-N 3.36Å
334	N	39.2	Very low	56.8	Low	147 Å²	147	147.8 Å²	147.8	79%	0.786	80%	0.795	S	S	*	*			trans	-67.6	117.1	170.3	-90.5	-29	0	0	0	109.6	S332	S332-N334 PolarHBondContact O-N 3.31Å
335	N	44	Very low	55.2	Low	152 Å²	152	150.4 Å²	150.4	81%	0.813	81%	0.805	S	S	*	*			trans	-177.8	138.6	138.4	-85.4	-25.2	0	0	0	110.7	N333	N333-N335 PolarHBondContact O-N 3.36Å
336	N	47.5	Very low	53.4	Low	149 Å²	149	154.4 Å²	154.4	80%	0.797	81%	0.805	S	S	*	*			trans	88.9	92.1	171	-61.8	-16.5	0	0	0	119.6
337	V	42.9	Very low	51.9	Low	119 Å²	119	156.6 Å²	156.6	72%	0.721	81%	0.808	S	S	*	*				39.6	98.1	116.8	-171.7	0	0	0	0	116.6
338	N	44.7	Very low	50.6	Low	148 Å²	148	157.2 Å²	157.2	79%	0.791	81%	0.813	S	S	*	*				174.6	150.2	117.1	-94.9	-36.2	0	0	0	113.6
339	H	39.7	Very low	48.8	Very low	167 Å²	167	165 Å²	165	77%	0.773	84%	0.84	S	S	*	*			trans	-46	130	-175.9	-60.6	-33.9	0	0	0	117.9
340	H	46.5	Very low	47.5	Very low	180 Å²	180	167 Å²	167	83%	0.833	84%	0.841	S	S	*	*				167.5	113.7	120.8	-100.1	54.3	0	0	0	110.1
341	K	43.4	Very low	46	Very low	206 Å²	206	167.1 Å²	167.1	90%	0.896	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-76.9	124.7	172.8	-113.2	175.4	-177.6	172.5	0	109.8
342	P	48.8	Very low	45.2	Very low	119 Å²	119	166 Å²	166	77%	0.773	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-73.1	140.6	178.5	29	-31.8	0	0	0	111.1
343	K	48.6	Very low	45	Very low	201 Å²	201	168.9 Å²	168.9	87%	0.874	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-61.9	132.8	173.4	-79.6	176.5	175.7	174	0	110.1	V345	K343-V345 PolarHBondContact O-N 3.45Å
344	K	45.7	Very low	44.8	Very low	207 Å²	207	168.7 Å²	168.7	90%	0.9	83%	0.833	S	S	*	*			trans	-52.3	115.9	169.8	-75.8	178.9	173.8	-180	0	110.3	K346	K344-K346 PolarHBondContact O-N 3.34Å
345	V	47.9	Very low	45.1	Very low	119 Å²	119	170.1 Å²	170.1	72%	0.721	84%	0.836	S	S	*	*			trans	-77.3	109.8	161.6	177.9	0	0	0	0	106.4	K343 F347	K343-V345 PolarHBondContact O-N 3.45Å; V345-F347 HydrophobicContact CG1-CD2 4.18Å; V345-F347 HydrophobicContact CG1-CE2 4.21Å
346	K	42	Very low	45.2	Very low	175 Å²	175	171.4 Å²	171.4	76%	0.761	84%	0.838	S	S	*	*			trans	-71.2	120.3	160.7	-82.9	-175.3	172.1	-172.6	0	107	K344	K344-K346 PolarHBondContact O-N 3.34Å
347	F	46	Very low	45.1	Very low	199 Å²	199	173.2 Å²	173.2	87%	0.873	84%	0.841	S	S	*	*			trans	-82.5	113.1	154.1	-90	-96	0	0	0	105.8	V345	V345-F347 HydrophobicContact CG1-CD2 4.18Å; V345-F347 HydrophobicContact CG1-CE2 4.21Å
348	D	51.5	Low	45.2	Very low	138 Å²	138	177.7 Å²	177.7	74%	0.738	85%	0.851	S	S	*	*			trans	-77.1	143.1	165.9	-67.8	-37.1	0	0	0	108.2
349	E	37.9	Very low	45.3	Very low	273 Å²	273	180.4 Å²	180.4	100%	1.276	86%	0.856	S	S	*	*			trans	-55.6	0	178	-74	177.8	145.3	0	0	114.9

Retrieved 349 of 349 residues in 303.2 ms (Link to these results)

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